----------------------------- ------- calculate fc2 ------- ----------------------------- _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1 -------------------------[time 2026-01-07 23:40:49]------------------------- Compiled with OpenMP support (max 128 threads). Running in phonopy.load mode. Python version 3.14.2 Spglib version 2.6.1 Crystal structure was read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". Unit of length: angstrom Settings: Supercell: [1 2 2] Primitive matrix: [0.5 0.5 0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/c (15) Number of symmetry operations in supercell: 32 ------------------------------ primitive cell ------------------------------ Lattice vectors: a 6.419051681957717 -2.435755900000001 0.000000000000000 b 6.419051681957717 2.435755900000001 0.000000000000000 c -1.308196550723201 0.000000000000000 5.371391032357877 Atomic positions (fractional): *1 O 0.72356242001422 0.86597008717783 0.87196470024572 15.999 2 O 0.13402991282217 0.27643757998578 0.62803529975428 15.999 3 O 0.27643757998578 0.13402991282217 0.12803529975428 15.999 4 O 0.86597008717783 0.72356242001422 0.37196470024572 15.999 *5 O 0.89769674044291 0.10230325955709 0.25000000000000 15.999 6 O 0.10230325955709 0.89769674044291 0.75000000000000 15.999 *7 O 0.33638948750944 0.44219600086212 0.02271642346095 15.999 8 O 0.55780399913788 0.66361051249056 0.47728357653905 15.999 9 O 0.66361051249056 0.55780399913788 0.97728357653905 15.999 10 O 0.44219600086212 0.33638948750944 0.52271642346095 15.999 *11 Ta 0.38582456510781 0.89538631427613 0.76856127177417 180.948 12 Ta 0.10461368572387 0.61417543489219 0.73143872822583 180.948 13 Ta 0.61417543489219 0.10461368572387 0.23143872822583 180.948 14 Ta 0.89538631427613 0.38582456510781 0.26856127177417 180.948 -------------------------------- unit cell --------------------------------- Lattice vectors: a 12.838103363915433 0.000000000000000 0.000000000000000 b 0.000000000000000 4.871511800000001 0.000000000000000 c -1.308196550723201 0.000000000000000 5.371391032357877 Atomic positions (fractional): *1 O 0.79476625359602 0.07120383358180 0.87196470024572 15.999 > 1 2 O 0.70523374640398 0.57120383358180 0.62803529975428 15.999 > 2 3 O 0.70523374640398 0.42879616641820 0.12803529975428 15.999 > 3 4 O 0.79476625359602 0.92879616641820 0.37196470024572 15.999 > 4 *5 O 0.00000000000000 0.10230325955709 0.25000000000000 15.999 > 5 6 O 0.00000000000000 0.89769674044291 0.75000000000000 15.999 > 6 *7 O 0.88929274418578 0.55290325667634 0.02271642346095 15.999 > 7 8 O 0.61070725581422 0.05290325667634 0.47728357653905 15.999 > 8 9 O 0.61070725581422 0.94709674332366 0.97728357653905 15.999 > 9 10 O 0.88929274418578 0.44709674332366 0.52271642346095 15.999 > 10 11 O 0.29476625359602 0.57120383358180 0.87196470024572 15.999 > 1 12 O 0.20523374640398 0.07120383358180 0.62803529975428 15.999 > 2 13 O 0.20523374640398 0.92879616641820 0.12803529975428 15.999 > 3 14 O 0.29476625359602 0.42879616641820 0.37196470024572 15.999 > 4 15 O 0.50000000000000 0.60230325955709 0.25000000000000 15.999 > 5 16 O 0.50000000000000 0.39769674044291 0.75000000000000 15.999 > 6 17 O 0.38929274418578 0.05290325667634 0.02271642346095 15.999 > 7 18 O 0.11070725581422 0.55290325667634 0.47728357653905 15.999 > 8 19 O 0.11070725581422 0.44709674332366 0.97728357653905 15.999 > 9 20 O 0.38929274418578 0.94709674332366 0.52271642346095 15.999 > 10 *21 Ta 0.64060543969197 0.25478087458416 0.76856127177417 180.948 > 11 22 Ta 0.85939456030803 0.75478087458416 0.73143872822583 180.948 > 12 23 Ta 0.85939456030803 0.24521912541584 0.23143872822583 180.948 > 13 24 Ta 0.64060543969197 0.74521912541584 0.26856127177417 180.948 > 14 25 Ta 0.14060543969197 0.75478087458416 0.76856127177417 180.948 > 11 26 Ta 0.35939456030803 0.25478087458416 0.73143872822583 180.948 > 12 27 Ta 0.35939456030803 0.74521912541584 0.23143872822583 180.948 > 13 28 Ta 0.14060543969197 0.24521912541584 0.26856127177417 180.948 > 14 -------------------------------- super cell -------------------------------- Lattice vectors: a 12.838103363915433 0.000000000000000 0.000000000000000 b 0.000000000000000 9.743023600000003 0.000000000000000 c -2.616393101446402 0.000000000000000 10.742782064715755 Atomic positions (fractional): *1 O 0.79476625359602 0.03560191679090 0.43598235012286 15.999 > 1 2 O 0.79476625359602 0.53560191679090 0.43598235012286 15.999 > 1 3 O 0.79476625359602 0.03560191679090 0.93598235012286 15.999 > 1 4 O 0.79476625359602 0.53560191679090 0.93598235012286 15.999 > 1 5 O 0.70523374640398 0.28560191679090 0.31401764987714 15.999 > 2 6 O 0.70523374640398 0.78560191679090 0.31401764987714 15.999 > 2 7 O 0.70523374640398 0.28560191679090 0.81401764987714 15.999 > 2 8 O 0.70523374640398 0.78560191679090 0.81401764987714 15.999 > 2 9 O 0.70523374640398 0.21439808320910 0.06401764987714 15.999 > 3 10 O 0.70523374640398 0.71439808320910 0.06401764987714 15.999 > 3 11 O 0.70523374640398 0.21439808320910 0.56401764987714 15.999 > 3 12 O 0.70523374640398 0.71439808320910 0.56401764987714 15.999 > 3 13 O 0.79476625359602 0.46439808320910 0.18598235012286 15.999 > 4 14 O 0.79476625359602 0.96439808320910 0.18598235012286 15.999 > 4 15 O 0.79476625359602 0.46439808320910 0.68598235012286 15.999 > 4 16 O 0.79476625359602 0.96439808320910 0.68598235012286 15.999 > 4 *17 O 0.00000000000000 0.05115162977855 0.12500000000000 15.999 > 5 18 O 0.00000000000000 0.55115162977855 0.12500000000000 15.999 > 5 19 O 0.00000000000000 0.05115162977855 0.62500000000000 15.999 > 5 20 O 0.00000000000000 0.55115162977855 0.62500000000000 15.999 > 5 21 O 0.00000000000000 0.44884837022145 0.37500000000000 15.999 > 6 22 O 0.00000000000000 0.94884837022145 0.37500000000000 15.999 > 6 23 O 0.00000000000000 0.44884837022145 0.87500000000000 15.999 > 6 24 O 0.00000000000000 0.94884837022145 0.87500000000000 15.999 > 6 *25 O 0.88929274418578 0.27645162833817 0.01135821173048 15.999 > 7 26 O 0.88929274418578 0.77645162833817 0.01135821173048 15.999 > 7 27 O 0.88929274418578 0.27645162833817 0.51135821173048 15.999 > 7 28 O 0.88929274418578 0.77645162833817 0.51135821173048 15.999 > 7 29 O 0.61070725581422 0.02645162833817 0.23864178826952 15.999 > 8 30 O 0.61070725581422 0.52645162833817 0.23864178826952 15.999 > 8 31 O 0.61070725581422 0.02645162833817 0.73864178826952 15.999 > 8 32 O 0.61070725581422 0.52645162833817 0.73864178826952 15.999 > 8 33 O 0.61070725581422 0.47354837166183 0.48864178826952 15.999 > 9 34 O 0.61070725581422 0.97354837166183 0.48864178826952 15.999 > 9 35 O 0.61070725581422 0.47354837166183 0.98864178826952 15.999 > 9 36 O 0.61070725581422 0.97354837166183 0.98864178826952 15.999 > 9 37 O 0.88929274418578 0.22354837166183 0.26135821173048 15.999 > 10 38 O 0.88929274418578 0.72354837166183 0.26135821173048 15.999 > 10 39 O 0.88929274418578 0.22354837166183 0.76135821173048 15.999 > 10 40 O 0.88929274418578 0.72354837166183 0.76135821173048 15.999 > 10 41 O 0.29476625359602 0.28560191679090 0.43598235012286 15.999 > 1 42 O 0.29476625359602 0.78560191679090 0.43598235012286 15.999 > 1 43 O 0.29476625359602 0.28560191679090 0.93598235012286 15.999 > 1 44 O 0.29476625359602 0.78560191679090 0.93598235012286 15.999 > 1 45 O 0.20523374640398 0.03560191679090 0.31401764987714 15.999 > 2 46 O 0.20523374640398 0.53560191679090 0.31401764987714 15.999 > 2 47 O 0.20523374640398 0.03560191679090 0.81401764987714 15.999 > 2 48 O 0.20523374640398 0.53560191679090 0.81401764987714 15.999 > 2 49 O 0.20523374640398 0.46439808320910 0.06401764987714 15.999 > 3 50 O 0.20523374640398 0.96439808320910 0.06401764987714 15.999 > 3 51 O 0.20523374640398 0.46439808320910 0.56401764987714 15.999 > 3 52 O 0.20523374640398 0.96439808320910 0.56401764987714 15.999 > 3 53 O 0.29476625359602 0.21439808320910 0.18598235012286 15.999 > 4 54 O 0.29476625359602 0.71439808320910 0.18598235012286 15.999 > 4 55 O 0.29476625359602 0.21439808320910 0.68598235012286 15.999 > 4 56 O 0.29476625359602 0.71439808320910 0.68598235012286 15.999 > 4 57 O 0.50000000000000 0.30115162977855 0.12500000000000 15.999 > 5 58 O 0.50000000000000 0.80115162977855 0.12500000000000 15.999 > 5 59 O 0.50000000000000 0.30115162977855 0.62500000000000 15.999 > 5 60 O 0.50000000000000 0.80115162977855 0.62500000000000 15.999 > 5 61 O 0.50000000000000 0.19884837022145 0.37500000000000 15.999 > 6 62 O 0.50000000000000 0.69884837022145 0.37500000000000 15.999 > 6 63 O 0.50000000000000 0.19884837022145 0.87500000000000 15.999 > 6 64 O 0.50000000000000 0.69884837022145 0.87500000000000 15.999 > 6 65 O 0.38929274418578 0.02645162833817 0.01135821173048 15.999 > 7 66 O 0.38929274418578 0.52645162833817 0.01135821173048 15.999 > 7 67 O 0.38929274418578 0.02645162833817 0.51135821173048 15.999 > 7 68 O 0.38929274418578 0.52645162833817 0.51135821173048 15.999 > 7 69 O 0.11070725581422 0.27645162833817 0.23864178826952 15.999 > 8 70 O 0.11070725581422 0.77645162833817 0.23864178826952 15.999 > 8 71 O 0.11070725581422 0.27645162833817 0.73864178826952 15.999 > 8 72 O 0.11070725581422 0.77645162833817 0.73864178826952 15.999 > 8 73 O 0.11070725581422 0.22354837166183 0.48864178826952 15.999 > 9 74 O 0.11070725581422 0.72354837166183 0.48864178826952 15.999 > 9 75 O 0.11070725581422 0.22354837166183 0.98864178826952 15.999 > 9 76 O 0.11070725581422 0.72354837166183 0.98864178826952 15.999 > 9 77 O 0.38929274418578 0.47354837166183 0.26135821173048 15.999 > 10 78 O 0.38929274418578 0.97354837166183 0.26135821173048 15.999 > 10 79 O 0.38929274418578 0.47354837166183 0.76135821173048 15.999 > 10 80 O 0.38929274418578 0.97354837166183 0.76135821173048 15.999 > 10 *81 Ta 0.64060543969197 0.12739043729208 0.38428063588709 180.948 > 11 82 Ta 0.64060543969197 0.62739043729208 0.38428063588709 180.948 > 11 83 Ta 0.64060543969197 0.12739043729208 0.88428063588709 180.948 > 11 84 Ta 0.64060543969197 0.62739043729208 0.88428063588709 180.948 > 11 85 Ta 0.85939456030803 0.37739043729208 0.36571936411291 180.948 > 12 86 Ta 0.85939456030803 0.87739043729208 0.36571936411291 180.948 > 12 87 Ta 0.85939456030803 0.37739043729208 0.86571936411291 180.948 > 12 88 Ta 0.85939456030803 0.87739043729208 0.86571936411291 180.948 > 12 89 Ta 0.85939456030803 0.12260956270792 0.11571936411291 180.948 > 13 90 Ta 0.85939456030803 0.62260956270792 0.11571936411291 180.948 > 13 91 Ta 0.85939456030803 0.12260956270792 0.61571936411291 180.948 > 13 92 Ta 0.85939456030803 0.62260956270792 0.61571936411291 180.948 > 13 93 Ta 0.64060543969197 0.37260956270792 0.13428063588709 180.948 > 14 94 Ta 0.64060543969197 0.87260956270792 0.13428063588709 180.948 > 14 95 Ta 0.64060543969197 0.37260956270792 0.63428063588709 180.948 > 14 96 Ta 0.64060543969197 0.87260956270792 0.63428063588709 180.948 > 14 97 Ta 0.14060543969197 0.37739043729208 0.38428063588709 180.948 > 11 98 Ta 0.14060543969197 0.87739043729208 0.38428063588709 180.948 > 11 99 Ta 0.14060543969197 0.37739043729208 0.88428063588709 180.948 > 11 100 Ta 0.14060543969197 0.87739043729208 0.88428063588709 180.948 > 11 101 Ta 0.35939456030803 0.12739043729208 0.36571936411291 180.948 > 12 102 Ta 0.35939456030803 0.62739043729208 0.36571936411291 180.948 > 12 103 Ta 0.35939456030803 0.12739043729208 0.86571936411291 180.948 > 12 104 Ta 0.35939456030803 0.62739043729208 0.86571936411291 180.948 > 12 105 Ta 0.35939456030803 0.37260956270792 0.11571936411291 180.948 > 13 106 Ta 0.35939456030803 0.87260956270792 0.11571936411291 180.948 > 13 107 Ta 0.35939456030803 0.37260956270792 0.61571936411291 180.948 > 13 108 Ta 0.35939456030803 0.87260956270792 0.61571936411291 180.948 > 13 109 Ta 0.14060543969197 0.12260956270792 0.13428063588709 180.948 > 14 110 Ta 0.14060543969197 0.62260956270792 0.13428063588709 180.948 > 14 111 Ta 0.14060543969197 0.12260956270792 0.63428063588709 180.948 > 14 112 Ta 0.14060543969197 0.62260956270792 0.63428063588709 180.948 > 14 ---------------------------------------------------------------------------- NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". --------------------------- Dielectric constant ---------------------------- 5.8743453 0.0000000 -0.5398797 0.0000000 5.5364245 0.0000000 -0.5398793 0.0000000 5.8451296 -------------------------- Born effective charges -------------------------- 1 O -3.0079185 1.5107134 -0.0230027 1.2018920 -3.3322280 -1.4732397 0.2651407 -1.0259392 -2.7796607 2 O -3.0079185 -1.5107134 -0.0230027 -1.2018920 -3.3322280 1.4732397 0.2651407 1.0259392 -2.7796607 3 O -3.0079185 1.5107134 -0.0230027 1.2018920 -3.3322280 -1.4732397 0.2651407 -1.0259392 -2.7796607 4 O -3.0079185 -1.5107134 -0.0230027 -1.2018920 -3.3322280 1.4732397 0.2651407 1.0259392 -2.7796607 5 O -6.1301293 0.0000000 -0.1885348 0.0000000 -1.4194695 0.0000000 -0.1625051 0.0000000 -1.0983829 6 O -6.1301293 0.0000000 -0.1885348 0.0000000 -1.4194695 0.0000000 -0.1625051 0.0000000 -1.0983829 7 O -1.3241223 -0.8044454 0.8718623 -0.4463484 -2.9703687 2.0013520 0.6186108 2.5010179 -4.0031889 8 O -1.3241223 0.8044454 0.8718623 0.4463484 -2.9703687 -2.0013520 0.6186108 -2.5010179 -4.0031889 9 O -1.3241223 -0.8044454 0.8718623 -0.4463484 -2.9703687 2.0013520 0.6186108 2.5010179 -4.0031889 10 O -1.3241223 0.8044454 0.8718623 0.4463484 -2.9703687 -2.0013520 0.6186108 -2.5010179 -4.0031889 11 Ta 7.3971054 -0.3245454 -0.7545922 0.7567830 7.0123314 0.4084300 -0.8024990 -0.9231954 7.3320410 12 Ta 7.3971054 0.3245454 -0.7545922 -0.7567830 7.0123314 -0.4084300 -0.8024990 0.9231954 7.3320410 13 Ta 7.3971054 -0.3245454 -0.7545922 0.7567830 7.0123314 0.4084300 -0.8024990 -0.9231954 7.3320410 14 Ta 7.3971054 0.3245454 -0.7545922 -0.7567830 7.0123314 -0.4084300 -0.8024990 0.9231954 7.3320410 ---------------------------------------------------------------------------- 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: 336/336 Permutation basis: 9312/9312 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 1850 Number of blocks in projector: 1850 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: 396 Use standard eigh solver. --- Eigsh_solver_block: 2 / 6 --- Block_size: 388 Use standard eigh solver. --- Eigsh_solver_block: 3 / 6 --- Block_size: 388 Use standard eigh solver. --- Eigsh_solver_block: 4 / 6 --- Block_size: 226 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 226 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 226 Use standard eigh solver. Tree of FC basis block matrices: - (1850, 1819), data: False |-- (226, 222), data: True |-- (226, 222), data: True |-- (226, 222), data: True |-- (388, 382), data: True |-- (388, 382), data: True |-- (396, 389), data: True ----- Solver_atoms: 1 -- 112 / 112 Time (Solver_compr_matrix_reshape): 0.004 Solver_block: 100 / 480 - Time: 2.904 Solver_block: 200 / 480 - Time: 2.924 Solver_block: 300 / 480 - Time: 2.918 Solver_block: 400 / 480 - Time: 2.919 Solver_block: 480 / 480 - Time: 2.364 Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 14.077 --------------------------------- Symfc end -------------------------------- Max drift of force constants: 0.00000000 (xx) 0.00000000 (xx) Permutation basis: 336/336 Permutation basis: 9312/9312 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 1850 Number of blocks in projector: 1850 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: 396 Use standard eigh solver. --- Eigsh_solver_block: 2 / 6 --- Block_size: 388 Use standard eigh solver. --- Eigsh_solver_block: 3 / 6 --- Block_size: 388 Use standard eigh solver. --- Eigsh_solver_block: 4 / 6 --- Block_size: 226 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 226 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 226 Use standard eigh solver. Tree of FC basis block matrices: - (1850, 1819), data: False |-- (226, 222), data: True |-- (226, 222), data: True |-- (226, 222), data: True |-- (388, 382), data: True |-- (388, 382), data: True |-- (396, 389), 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 2026-01-07 23:41:23]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate fc3 ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-07 23:41:24]------------------------- 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: force constants HDF5 data compression filter: gzip Crystal structure was read from "phono3py_mlp_eval_fc3_disp.yaml.xz". Supercell (dim): [1 2 2] Primitive matrix: [0.5 0.5 0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/c (15) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 6.419051681957717 -2.435755900000001 0.000000000000000 b 6.419051681957717 2.435755900000001 0.000000000000000 c -1.308196550723201 0.000000000000000 5.371391032357877 Atomic positions (fractional): 1 O 0.72356242001422 0.86597008717783 0.87196470024572 15.999 2 O 0.13402991282217 0.27643757998578 0.62803529975428 15.999 3 O 0.27643757998578 0.13402991282217 0.12803529975428 15.999 4 O 0.86597008717783 0.72356242001422 0.37196470024572 15.999 5 O 0.89769674044291 0.10230325955709 0.25000000000000 15.999 6 O 0.10230325955709 0.89769674044291 0.75000000000000 15.999 7 O 0.33638948750944 0.44219600086212 0.02271642346095 15.999 8 O 0.55780399913788 0.66361051249056 0.47728357653905 15.999 9 O 0.66361051249056 0.55780399913788 0.97728357653905 15.999 10 O 0.44219600086212 0.33638948750944 0.52271642346095 15.999 11 Ta 0.38582456510781 0.89538631427613 0.76856127177417 180.948 12 Ta 0.10461368572387 0.61417543489219 0.73143872822583 180.948 13 Ta 0.61417543489219 0.10461368572387 0.23143872822583 180.948 14 Ta 0.89538631427613 0.38582456510781 0.26856127177417 180.948 -------------------------------- supercell --------------------------------- Lattice vectors: a 12.838103363915433 0.000000000000000 0.000000000000000 b 0.000000000000000 9.743023600000003 0.000000000000000 c -2.616393101446402 0.000000000000000 10.742782064715755 Atomic positions (fractional): 1 O 0.79476625359602 0.03560191679090 0.43598235012286 15.999 > 1 2 O 0.79476625359602 0.53560191679090 0.43598235012286 15.999 > 1 3 O 0.79476625359602 0.03560191679090 0.93598235012286 15.999 > 1 4 O 0.79476625359602 0.53560191679090 0.93598235012286 15.999 > 1 5 O 0.70523374640398 0.28560191679090 0.31401764987714 15.999 > 5 6 O 0.70523374640398 0.78560191679090 0.31401764987714 15.999 > 5 7 O 0.70523374640398 0.28560191679090 0.81401764987714 15.999 > 5 8 O 0.70523374640398 0.78560191679090 0.81401764987714 15.999 > 5 9 O 0.70523374640398 0.21439808320910 0.06401764987714 15.999 > 9 10 O 0.70523374640398 0.71439808320910 0.06401764987714 15.999 > 9 11 O 0.70523374640398 0.21439808320910 0.56401764987714 15.999 > 9 12 O 0.70523374640398 0.71439808320910 0.56401764987714 15.999 > 9 13 O 0.79476625359602 0.46439808320910 0.18598235012286 15.999 > 13 14 O 0.79476625359602 0.96439808320910 0.18598235012286 15.999 > 13 15 O 0.79476625359602 0.46439808320910 0.68598235012286 15.999 > 13 16 O 0.79476625359602 0.96439808320910 0.68598235012286 15.999 > 13 17 O 0.00000000000000 0.05115162977855 0.12500000000000 15.999 > 17 18 O 0.00000000000000 0.55115162977855 0.12500000000000 15.999 > 17 19 O 0.00000000000000 0.05115162977855 0.62500000000000 15.999 > 17 20 O 0.00000000000000 0.55115162977855 0.62500000000000 15.999 > 17 21 O 0.00000000000000 0.44884837022145 0.37500000000000 15.999 > 21 22 O 0.00000000000000 0.94884837022145 0.37500000000000 15.999 > 21 23 O 0.00000000000000 0.44884837022145 0.87500000000000 15.999 > 21 24 O 0.00000000000000 0.94884837022145 0.87500000000000 15.999 > 21 25 O 0.88929274418578 0.27645162833817 0.01135821173048 15.999 > 25 26 O 0.88929274418578 0.77645162833817 0.01135821173048 15.999 > 25 27 O 0.88929274418578 0.27645162833817 0.51135821173048 15.999 > 25 28 O 0.88929274418578 0.77645162833817 0.51135821173048 15.999 > 25 29 O 0.61070725581422 0.02645162833817 0.23864178826952 15.999 > 29 30 O 0.61070725581422 0.52645162833817 0.23864178826952 15.999 > 29 31 O 0.61070725581422 0.02645162833817 0.73864178826952 15.999 > 29 32 O 0.61070725581422 0.52645162833817 0.73864178826952 15.999 > 29 33 O 0.61070725581422 0.47354837166183 0.48864178826952 15.999 > 33 34 O 0.61070725581422 0.97354837166183 0.48864178826952 15.999 > 33 35 O 0.61070725581422 0.47354837166183 0.98864178826952 15.999 > 33 36 O 0.61070725581422 0.97354837166183 0.98864178826952 15.999 > 33 37 O 0.88929274418578 0.22354837166183 0.26135821173048 15.999 > 37 38 O 0.88929274418578 0.72354837166183 0.26135821173048 15.999 > 37 39 O 0.88929274418578 0.22354837166183 0.76135821173048 15.999 > 37 40 O 0.88929274418578 0.72354837166183 0.76135821173048 15.999 > 37 41 O 0.29476625359602 0.28560191679090 0.43598235012286 15.999 > 1 42 O 0.29476625359602 0.78560191679090 0.43598235012286 15.999 > 1 43 O 0.29476625359602 0.28560191679090 0.93598235012286 15.999 > 1 44 O 0.29476625359602 0.78560191679090 0.93598235012286 15.999 > 1 45 O 0.20523374640398 0.03560191679090 0.31401764987714 15.999 > 5 46 O 0.20523374640398 0.53560191679090 0.31401764987714 15.999 > 5 47 O 0.20523374640398 0.03560191679090 0.81401764987714 15.999 > 5 48 O 0.20523374640398 0.53560191679090 0.81401764987714 15.999 > 5 49 O 0.20523374640398 0.46439808320910 0.06401764987714 15.999 > 9 50 O 0.20523374640398 0.96439808320910 0.06401764987714 15.999 > 9 51 O 0.20523374640398 0.46439808320910 0.56401764987714 15.999 > 9 52 O 0.20523374640398 0.96439808320910 0.56401764987714 15.999 > 9 53 O 0.29476625359602 0.21439808320910 0.18598235012286 15.999 > 13 54 O 0.29476625359602 0.71439808320910 0.18598235012286 15.999 > 13 55 O 0.29476625359602 0.21439808320910 0.68598235012286 15.999 > 13 56 O 0.29476625359602 0.71439808320910 0.68598235012286 15.999 > 13 57 O 0.50000000000000 0.30115162977855 0.12500000000000 15.999 > 17 58 O 0.50000000000000 0.80115162977855 0.12500000000000 15.999 > 17 59 O 0.50000000000000 0.30115162977855 0.62500000000000 15.999 > 17 60 O 0.50000000000000 0.80115162977855 0.62500000000000 15.999 > 17 61 O 0.50000000000000 0.19884837022145 0.37500000000000 15.999 > 21 62 O 0.50000000000000 0.69884837022145 0.37500000000000 15.999 > 21 63 O 0.50000000000000 0.19884837022145 0.87500000000000 15.999 > 21 64 O 0.50000000000000 0.69884837022145 0.87500000000000 15.999 > 21 65 O 0.38929274418578 0.02645162833817 0.01135821173048 15.999 > 25 66 O 0.38929274418578 0.52645162833817 0.01135821173048 15.999 > 25 67 O 0.38929274418578 0.02645162833817 0.51135821173048 15.999 > 25 68 O 0.38929274418578 0.52645162833817 0.51135821173048 15.999 > 25 69 O 0.11070725581422 0.27645162833817 0.23864178826952 15.999 > 29 70 O 0.11070725581422 0.77645162833817 0.23864178826952 15.999 > 29 71 O 0.11070725581422 0.27645162833817 0.73864178826952 15.999 > 29 72 O 0.11070725581422 0.77645162833817 0.73864178826952 15.999 > 29 73 O 0.11070725581422 0.22354837166183 0.48864178826952 15.999 > 33 74 O 0.11070725581422 0.72354837166183 0.48864178826952 15.999 > 33 75 O 0.11070725581422 0.22354837166183 0.98864178826952 15.999 > 33 76 O 0.11070725581422 0.72354837166183 0.98864178826952 15.999 > 33 77 O 0.38929274418578 0.47354837166183 0.26135821173048 15.999 > 37 78 O 0.38929274418578 0.97354837166183 0.26135821173048 15.999 > 37 79 O 0.38929274418578 0.47354837166183 0.76135821173048 15.999 > 37 80 O 0.38929274418578 0.97354837166183 0.76135821173048 15.999 > 37 81 Ta 0.64060543969197 0.12739043729208 0.38428063588709 180.948 > 81 82 Ta 0.64060543969197 0.62739043729208 0.38428063588709 180.948 > 81 83 Ta 0.64060543969197 0.12739043729208 0.88428063588709 180.948 > 81 84 Ta 0.64060543969197 0.62739043729208 0.88428063588709 180.948 > 81 85 Ta 0.85939456030803 0.37739043729208 0.36571936411291 180.948 > 85 86 Ta 0.85939456030803 0.87739043729208 0.36571936411291 180.948 > 85 87 Ta 0.85939456030803 0.37739043729208 0.86571936411291 180.948 > 85 88 Ta 0.85939456030803 0.87739043729208 0.86571936411291 180.948 > 85 89 Ta 0.85939456030803 0.12260956270792 0.11571936411291 180.948 > 89 90 Ta 0.85939456030803 0.62260956270792 0.11571936411291 180.948 > 89 91 Ta 0.85939456030803 0.12260956270792 0.61571936411291 180.948 > 89 92 Ta 0.85939456030803 0.62260956270792 0.61571936411291 180.948 > 89 93 Ta 0.64060543969197 0.37260956270792 0.13428063588709 180.948 > 93 94 Ta 0.64060543969197 0.87260956270792 0.13428063588709 180.948 > 93 95 Ta 0.64060543969197 0.37260956270792 0.63428063588709 180.948 > 93 96 Ta 0.64060543969197 0.87260956270792 0.63428063588709 180.948 > 93 97 Ta 0.14060543969197 0.37739043729208 0.38428063588709 180.948 > 81 98 Ta 0.14060543969197 0.87739043729208 0.38428063588709 180.948 > 81 99 Ta 0.14060543969197 0.37739043729208 0.88428063588709 180.948 > 81 100 Ta 0.14060543969197 0.87739043729208 0.88428063588709 180.948 > 81 101 Ta 0.35939456030803 0.12739043729208 0.36571936411291 180.948 > 85 102 Ta 0.35939456030803 0.62739043729208 0.36571936411291 180.948 > 85 103 Ta 0.35939456030803 0.12739043729208 0.86571936411291 180.948 > 85 104 Ta 0.35939456030803 0.62739043729208 0.86571936411291 180.948 > 85 105 Ta 0.35939456030803 0.37260956270792 0.11571936411291 180.948 > 89 106 Ta 0.35939456030803 0.87260956270792 0.11571936411291 180.948 > 89 107 Ta 0.35939456030803 0.37260956270792 0.61571936411291 180.948 > 89 108 Ta 0.35939456030803 0.87260956270792 0.61571936411291 180.948 > 89 109 Ta 0.14060543969197 0.12260956270792 0.13428063588709 180.948 > 93 110 Ta 0.14060543969197 0.62260956270792 0.13428063588709 180.948 > 93 111 Ta 0.14060543969197 0.12260956270792 0.63428063588709 180.948 > 93 112 Ta 0.14060543969197 0.62260956270792 0.63428063588709 180.948 > 93 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz". --------------------------- Dielectric constant ---------------------------- 5.8743453 0.0000000 -0.5398797 0.0000000 5.5364245 0.0000000 -0.5398793 0.0000000 5.8451296 -------------------------- Born effective charges -------------------------- 1 O -3.0079185 1.5107134 -0.0230027 1.2018920 -3.3322280 -1.4732397 0.2651407 -1.0259392 -2.7796607 2 O -3.0079185 -1.5107134 -0.0230027 -1.2018920 -3.3322280 1.4732397 0.2651407 1.0259392 -2.7796607 3 O -3.0079185 1.5107134 -0.0230027 1.2018920 -3.3322280 -1.4732397 0.2651407 -1.0259392 -2.7796607 4 O -3.0079185 -1.5107134 -0.0230027 -1.2018920 -3.3322280 1.4732397 0.2651407 1.0259392 -2.7796607 5 O -6.1301293 0.0000000 -0.1885348 0.0000000 -1.4194695 0.0000000 -0.1625051 0.0000000 -1.0983829 6 O -6.1301293 0.0000000 -0.1885348 0.0000000 -1.4194695 0.0000000 -0.1625051 0.0000000 -1.0983829 7 O -1.3241223 -0.8044454 0.8718623 -0.4463484 -2.9703687 2.0013520 0.6186108 2.5010179 -4.0031889 8 O -1.3241223 0.8044454 0.8718623 0.4463484 -2.9703687 -2.0013520 0.6186108 -2.5010179 -4.0031889 9 O -1.3241223 -0.8044454 0.8718623 -0.4463484 -2.9703687 2.0013520 0.6186108 2.5010179 -4.0031889 10 O -1.3241223 0.8044454 0.8718623 0.4463484 -2.9703687 -2.0013520 0.6186108 -2.5010179 -4.0031889 11 Ta 7.3971054 -0.3245454 -0.7545922 0.7567830 7.0123314 0.4084300 -0.8024990 -0.9231954 7.3320410 12 Ta 7.3971054 0.3245454 -0.7545922 -0.7567830 7.0123314 -0.4084300 -0.8024990 0.9231954 7.3320410 13 Ta 7.3971054 -0.3245454 -0.7545922 0.7567830 7.0123314 0.4084300 -0.8024990 -0.9231954 7.3320410 14 Ta 7.3971054 0.3245454 -0.7545922 -0.7567830 7.0123314 -0.4084300 -0.8024990 0.9231954 7.3320410 ---------------------------------------------------------------------------- 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] [-0.0024 0.0000 0.0097] [ 0.0024 0.0000 -0.0097] Computing fc3[ 17, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0024 0.0000 0.0097] [ 0.0024 0.0000 -0.0097] Computing fc3[ 25, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0024 0.0000 0.0097] [ 0.0024 0.0000 -0.0097] Computing fc3[ 81, 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] [-0.0024 0.0000 0.0097] [ 0.0024 0.0000 -0.0097] Expanding fc3. Symmetrizing fc3 by traditional approach (N=3). Symmetrizing fc2 by traditional approach (N=3). Max drift of fc3: 0.00000003 (xxx) 0.00000003 (xxx) 0.00000003 (xxx) fc3 was written into "fc3.hdf5". Max drift of fc2: 0.00000002 (yx) 0.00000002 (yx) fc2 was written into "fc2.hdf5". --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperatures: 0.0 300.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 ----------- None of ph-ph interaction calculation was performed. ----------- Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-07 23:41:41]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate LTC ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-07 23:41:41]------------------------- 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): [1 2 2] Primitive matrix: [0.5 0.5 0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/c (15) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 6.419051681957717 -2.435755900000001 0.000000000000000 b 6.419051681957717 2.435755900000001 0.000000000000000 c -1.308196550723201 0.000000000000000 5.371391032357877 Atomic positions (fractional): 1 O 0.72356242001422 0.86597008717783 0.87196470024572 15.999 2 O 0.13402991282217 0.27643757998578 0.62803529975428 15.999 3 O 0.27643757998578 0.13402991282217 0.12803529975428 15.999 4 O 0.86597008717783 0.72356242001422 0.37196470024572 15.999 5 O 0.89769674044291 0.10230325955709 0.25000000000000 15.999 6 O 0.10230325955709 0.89769674044291 0.75000000000000 15.999 7 O 0.33638948750944 0.44219600086212 0.02271642346095 15.999 8 O 0.55780399913788 0.66361051249056 0.47728357653905 15.999 9 O 0.66361051249056 0.55780399913788 0.97728357653905 15.999 10 O 0.44219600086212 0.33638948750944 0.52271642346095 15.999 11 Ta 0.38582456510781 0.89538631427613 0.76856127177417 180.948 12 Ta 0.10461368572387 0.61417543489219 0.73143872822583 180.948 13 Ta 0.61417543489219 0.10461368572387 0.23143872822583 180.948 14 Ta 0.89538631427613 0.38582456510781 0.26856127177417 180.948 -------------------------------- supercell --------------------------------- Lattice vectors: a 12.838103363915433 0.000000000000000 0.000000000000000 b 0.000000000000000 9.743023600000003 0.000000000000000 c -2.616393101446402 0.000000000000000 10.742782064715755 Atomic positions (fractional): 1 O 0.79476625359602 0.03560191679090 0.43598235012286 15.999 > 1 2 O 0.79476625359602 0.53560191679090 0.43598235012286 15.999 > 1 3 O 0.79476625359602 0.03560191679090 0.93598235012286 15.999 > 1 4 O 0.79476625359602 0.53560191679090 0.93598235012286 15.999 > 1 5 O 0.70523374640398 0.28560191679090 0.31401764987714 15.999 > 5 6 O 0.70523374640398 0.78560191679090 0.31401764987714 15.999 > 5 7 O 0.70523374640398 0.28560191679090 0.81401764987714 15.999 > 5 8 O 0.70523374640398 0.78560191679090 0.81401764987714 15.999 > 5 9 O 0.70523374640398 0.21439808320910 0.06401764987714 15.999 > 9 10 O 0.70523374640398 0.71439808320910 0.06401764987714 15.999 > 9 11 O 0.70523374640398 0.21439808320910 0.56401764987714 15.999 > 9 12 O 0.70523374640398 0.71439808320910 0.56401764987714 15.999 > 9 13 O 0.79476625359602 0.46439808320910 0.18598235012286 15.999 > 13 14 O 0.79476625359602 0.96439808320910 0.18598235012286 15.999 > 13 15 O 0.79476625359602 0.46439808320910 0.68598235012286 15.999 > 13 16 O 0.79476625359602 0.96439808320910 0.68598235012286 15.999 > 13 17 O 0.00000000000000 0.05115162977855 0.12500000000000 15.999 > 17 18 O 0.00000000000000 0.55115162977855 0.12500000000000 15.999 > 17 19 O 0.00000000000000 0.05115162977855 0.62500000000000 15.999 > 17 20 O 0.00000000000000 0.55115162977855 0.62500000000000 15.999 > 17 21 O 0.00000000000000 0.44884837022145 0.37500000000000 15.999 > 21 22 O 0.00000000000000 0.94884837022145 0.37500000000000 15.999 > 21 23 O 0.00000000000000 0.44884837022145 0.87500000000000 15.999 > 21 24 O 0.00000000000000 0.94884837022145 0.87500000000000 15.999 > 21 25 O 0.88929274418578 0.27645162833817 0.01135821173048 15.999 > 25 26 O 0.88929274418578 0.77645162833817 0.01135821173048 15.999 > 25 27 O 0.88929274418578 0.27645162833817 0.51135821173048 15.999 > 25 28 O 0.88929274418578 0.77645162833817 0.51135821173048 15.999 > 25 29 O 0.61070725581422 0.02645162833817 0.23864178826952 15.999 > 29 30 O 0.61070725581422 0.52645162833817 0.23864178826952 15.999 > 29 31 O 0.61070725581422 0.02645162833817 0.73864178826952 15.999 > 29 32 O 0.61070725581422 0.52645162833817 0.73864178826952 15.999 > 29 33 O 0.61070725581422 0.47354837166183 0.48864178826952 15.999 > 33 34 O 0.61070725581422 0.97354837166183 0.48864178826952 15.999 > 33 35 O 0.61070725581422 0.47354837166183 0.98864178826952 15.999 > 33 36 O 0.61070725581422 0.97354837166183 0.98864178826952 15.999 > 33 37 O 0.88929274418578 0.22354837166183 0.26135821173048 15.999 > 37 38 O 0.88929274418578 0.72354837166183 0.26135821173048 15.999 > 37 39 O 0.88929274418578 0.22354837166183 0.76135821173048 15.999 > 37 40 O 0.88929274418578 0.72354837166183 0.76135821173048 15.999 > 37 41 O 0.29476625359602 0.28560191679090 0.43598235012286 15.999 > 1 42 O 0.29476625359602 0.78560191679090 0.43598235012286 15.999 > 1 43 O 0.29476625359602 0.28560191679090 0.93598235012286 15.999 > 1 44 O 0.29476625359602 0.78560191679090 0.93598235012286 15.999 > 1 45 O 0.20523374640398 0.03560191679090 0.31401764987714 15.999 > 5 46 O 0.20523374640398 0.53560191679090 0.31401764987714 15.999 > 5 47 O 0.20523374640398 0.03560191679090 0.81401764987714 15.999 > 5 48 O 0.20523374640398 0.53560191679090 0.81401764987714 15.999 > 5 49 O 0.20523374640398 0.46439808320910 0.06401764987714 15.999 > 9 50 O 0.20523374640398 0.96439808320910 0.06401764987714 15.999 > 9 51 O 0.20523374640398 0.46439808320910 0.56401764987714 15.999 > 9 52 O 0.20523374640398 0.96439808320910 0.56401764987714 15.999 > 9 53 O 0.29476625359602 0.21439808320910 0.18598235012286 15.999 > 13 54 O 0.29476625359602 0.71439808320910 0.18598235012286 15.999 > 13 55 O 0.29476625359602 0.21439808320910 0.68598235012286 15.999 > 13 56 O 0.29476625359602 0.71439808320910 0.68598235012286 15.999 > 13 57 O 0.50000000000000 0.30115162977855 0.12500000000000 15.999 > 17 58 O 0.50000000000000 0.80115162977855 0.12500000000000 15.999 > 17 59 O 0.50000000000000 0.30115162977855 0.62500000000000 15.999 > 17 60 O 0.50000000000000 0.80115162977855 0.62500000000000 15.999 > 17 61 O 0.50000000000000 0.19884837022145 0.37500000000000 15.999 > 21 62 O 0.50000000000000 0.69884837022145 0.37500000000000 15.999 > 21 63 O 0.50000000000000 0.19884837022145 0.87500000000000 15.999 > 21 64 O 0.50000000000000 0.69884837022145 0.87500000000000 15.999 > 21 65 O 0.38929274418578 0.02645162833817 0.01135821173048 15.999 > 25 66 O 0.38929274418578 0.52645162833817 0.01135821173048 15.999 > 25 67 O 0.38929274418578 0.02645162833817 0.51135821173048 15.999 > 25 68 O 0.38929274418578 0.52645162833817 0.51135821173048 15.999 > 25 69 O 0.11070725581422 0.27645162833817 0.23864178826952 15.999 > 29 70 O 0.11070725581422 0.77645162833817 0.23864178826952 15.999 > 29 71 O 0.11070725581422 0.27645162833817 0.73864178826952 15.999 > 29 72 O 0.11070725581422 0.77645162833817 0.73864178826952 15.999 > 29 73 O 0.11070725581422 0.22354837166183 0.48864178826952 15.999 > 33 74 O 0.11070725581422 0.72354837166183 0.48864178826952 15.999 > 33 75 O 0.11070725581422 0.22354837166183 0.98864178826952 15.999 > 33 76 O 0.11070725581422 0.72354837166183 0.98864178826952 15.999 > 33 77 O 0.38929274418578 0.47354837166183 0.26135821173048 15.999 > 37 78 O 0.38929274418578 0.97354837166183 0.26135821173048 15.999 > 37 79 O 0.38929274418578 0.47354837166183 0.76135821173048 15.999 > 37 80 O 0.38929274418578 0.97354837166183 0.76135821173048 15.999 > 37 81 Ta 0.64060543969197 0.12739043729208 0.38428063588709 180.948 > 81 82 Ta 0.64060543969197 0.62739043729208 0.38428063588709 180.948 > 81 83 Ta 0.64060543969197 0.12739043729208 0.88428063588709 180.948 > 81 84 Ta 0.64060543969197 0.62739043729208 0.88428063588709 180.948 > 81 85 Ta 0.85939456030803 0.37739043729208 0.36571936411291 180.948 > 85 86 Ta 0.85939456030803 0.87739043729208 0.36571936411291 180.948 > 85 87 Ta 0.85939456030803 0.37739043729208 0.86571936411291 180.948 > 85 88 Ta 0.85939456030803 0.87739043729208 0.86571936411291 180.948 > 85 89 Ta 0.85939456030803 0.12260956270792 0.11571936411291 180.948 > 89 90 Ta 0.85939456030803 0.62260956270792 0.11571936411291 180.948 > 89 91 Ta 0.85939456030803 0.12260956270792 0.61571936411291 180.948 > 89 92 Ta 0.85939456030803 0.62260956270792 0.61571936411291 180.948 > 89 93 Ta 0.64060543969197 0.37260956270792 0.13428063588709 180.948 > 93 94 Ta 0.64060543969197 0.87260956270792 0.13428063588709 180.948 > 93 95 Ta 0.64060543969197 0.37260956270792 0.63428063588709 180.948 > 93 96 Ta 0.64060543969197 0.87260956270792 0.63428063588709 180.948 > 93 97 Ta 0.14060543969197 0.37739043729208 0.38428063588709 180.948 > 81 98 Ta 0.14060543969197 0.87739043729208 0.38428063588709 180.948 > 81 99 Ta 0.14060543969197 0.37739043729208 0.88428063588709 180.948 > 81 100 Ta 0.14060543969197 0.87739043729208 0.88428063588709 180.948 > 81 101 Ta 0.35939456030803 0.12739043729208 0.36571936411291 180.948 > 85 102 Ta 0.35939456030803 0.62739043729208 0.36571936411291 180.948 > 85 103 Ta 0.35939456030803 0.12739043729208 0.86571936411291 180.948 > 85 104 Ta 0.35939456030803 0.62739043729208 0.86571936411291 180.948 > 85 105 Ta 0.35939456030803 0.37260956270792 0.11571936411291 180.948 > 89 106 Ta 0.35939456030803 0.87260956270792 0.11571936411291 180.948 > 89 107 Ta 0.35939456030803 0.37260956270792 0.61571936411291 180.948 > 89 108 Ta 0.35939456030803 0.87260956270792 0.61571936411291 180.948 > 89 109 Ta 0.14060543969197 0.12260956270792 0.13428063588709 180.948 > 93 110 Ta 0.14060543969197 0.62260956270792 0.13428063588709 180.948 > 93 111 Ta 0.14060543969197 0.12260956270792 0.63428063588709 180.948 > 93 112 Ta 0.14060543969197 0.62260956270792 0.63428063588709 180.948 > 93 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py.yaml". --------------------------- Dielectric constant ---------------------------- 5.8743453 0.0000000 -0.5398797 0.0000000 5.5364245 0.0000000 -0.5398793 0.0000000 5.8451296 -------------------------- Born effective charges -------------------------- 1 O -3.0079185 1.5107134 -0.0230027 1.2018920 -3.3322280 -1.4732397 0.2651407 -1.0259392 -2.7796607 2 O -3.0079185 -1.5107134 -0.0230027 -1.2018920 -3.3322280 1.4732397 0.2651407 1.0259392 -2.7796607 3 O -3.0079185 1.5107134 -0.0230027 1.2018920 -3.3322280 -1.4732397 0.2651407 -1.0259392 -2.7796607 4 O -3.0079185 -1.5107134 -0.0230027 -1.2018920 -3.3322280 1.4732397 0.2651407 1.0259392 -2.7796607 5 O -6.1301293 0.0000000 -0.1885348 0.0000000 -1.4194695 0.0000000 -0.1625051 0.0000000 -1.0983829 6 O -6.1301293 0.0000000 -0.1885348 0.0000000 -1.4194695 0.0000000 -0.1625051 0.0000000 -1.0983829 7 O -1.3241223 -0.8044454 0.8718623 -0.4463484 -2.9703687 2.0013520 0.6186108 2.5010179 -4.0031889 8 O -1.3241223 0.8044454 0.8718623 0.4463484 -2.9703687 -2.0013520 0.6186108 -2.5010179 -4.0031889 9 O -1.3241223 -0.8044454 0.8718623 -0.4463484 -2.9703687 2.0013520 0.6186108 2.5010179 -4.0031889 10 O -1.3241223 0.8044454 0.8718623 0.4463484 -2.9703687 -2.0013520 0.6186108 -2.5010179 -4.0031889 11 Ta 7.3971054 -0.3245454 -0.7545922 0.7567830 7.0123314 0.4084300 -0.8024990 -0.9231954 7.3320410 12 Ta 7.3971054 0.3245454 -0.7545922 -0.7567830 7.0123314 -0.4084300 -0.8024990 0.9231954 7.3320410 13 Ta 7.3971054 -0.3245454 -0.7545922 0.7567830 7.0123314 0.4084300 -0.8024990 -0.9231954 7.3320410 14 Ta 7.3971054 0.3245454 -0.7545922 -0.7567830 7.0123314 -0.4084300 -0.8024990 0.9231954 7.3320410 ---------------------------------------------------------------------------- fc3 was read from "fc3.hdf5". fc2 was read from "fc2.hdf5". ----------------------------- Force constants ------------------------------ Max drift of fc3: 0.00000003 (xxx) 0.00000003 (xxx) 0.00000003 (xxx) 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 11 9 ] fc3-r2q-transformation over three atoms: True --------------------------- Phonon calculations ---------------------------- Use NAC by Gonze et al. (no real space sum in current implementation) PRB 50, 13035(R) (1994), PRB 55, 10355 (1997) G-cutoff distance: 0.75, Number of G-points: 301, Lambda: 0.19 Running harmonic phonon calculations... -------------------- Lattice thermal conductivity (RTA) -------------------- ======================= Grid point 0 (1/300) ======================= q-point: ( 0.00 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| -0.000 ( 0.000 0.000 0.000) 0.000 0.000 ( 0.000 0.000 0.000) 0.000 0.000 ( 0.000 0.000 0.000) 0.000 2.476 ( 0.000 0.000 0.000) 0.000 2.659 ( 0.000 0.000 0.000) 0.000 2.914 ( 0.000 0.000 0.000) 0.000 4.222 ( 0.000 0.000 0.000) 0.000 4.495 ( 0.000 0.000 0.000) 0.000 5.322 ( 0.000 0.000 0.000) 0.000 5.777 ( 0.000 0.000 0.000) 0.000 6.033 ( 0.000 0.000 0.000) 0.000 6.342 ( 0.000 0.000 0.000) 0.000 6.492 ( 0.000 0.000 0.000) 0.000 6.693 ( 0.000 0.000 0.000) 0.000 6.698 ( 0.000 0.000 0.000) 0.000 7.043 ( 0.000 0.000 0.000) 0.000 7.683 ( 0.000 0.000 0.000) 0.000 8.283 ( 0.000 0.000 0.000) 0.000 8.609 ( 0.000 0.000 0.000) 0.000 9.097 ( 0.000 0.000 0.000) 0.000 9.304 ( 0.000 0.000 0.000) 0.000 9.551 ( 0.000 0.000 0.000) 0.000 11.156 ( 0.000 0.000 0.000) 0.000 11.315 ( 0.000 0.000 0.000) 0.000 11.978 ( 0.000 0.000 0.000) 0.000 12.689 ( 0.000 0.000 0.000) 0.000 13.059 ( 0.000 0.000 0.000) 0.000 13.060 ( 0.000 0.000 0.000) 0.000 13.309 ( 0.000 0.000 0.000) 0.000 13.508 ( 0.000 0.000 0.000) 0.000 13.714 ( 0.000 0.000 0.000) 0.000 13.992 ( 0.000 0.000 0.000) 0.000 14.390 ( 0.000 0.000 0.000) 0.000 14.765 ( 0.000 0.000 0.000) 0.000 16.959 ( 0.000 0.000 0.000) 0.000 17.585 ( 0.000 0.000 0.000) 0.000 19.392 ( 0.000 0.000 0.000) 0.000 21.245 ( 0.000 0.000 0.000) 0.000 21.432 ( 0.000 0.000 0.000) 0.000 24.501 ( 0.000 0.000 0.000) 0.000 27.278 ( 0.000 0.000 0.000) 0.000 28.372 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 1 (2/300) ======================= q-point: ( 0.09 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.509 ( 17.990 -21.089 -4.300) 28.051 0.723 ( 9.407 -34.227 -4.885) 35.831 1.008 ( 13.818 -47.177 3.593) 49.290 2.575 ( -2.707 -9.346 -1.198) 9.804 2.688 ( 2.626 -4.149 3.075) 5.794 3.002 ( 1.312 -8.735 -1.589) 8.974 4.228 ( 0.447 -0.524 -1.519) 1.668 4.649 ( -7.872 -1.700 0.052) 8.053 5.295 ( -1.823 2.071 -0.521) 2.808 5.734 ( -0.683 4.198 -0.304) 4.264 6.073 ( 5.220 -0.152 -7.087) 8.804 6.335 ( -2.359 3.860 -2.021) 4.955 6.546 ( 23.802 11.685 -4.233) 26.852 6.690 ( 2.859 1.859 -2.513) 4.236 6.769 ( 0.992 -6.646 0.483) 6.737 7.101 ( -0.181 -6.372 0.821) 6.427 8.184 ( -6.784 6.409 1.775) 9.500 8.665 ( -3.778 -6.559 1.187) 7.661 9.065 ( -1.150 2.094 -0.357) 2.416 9.264 ( 5.826 -2.199 -5.635) 8.398 9.414 ( -31.833 -19.611 -40.242) 54.930 10.454 ( 20.274 11.813 39.742) 46.152 11.118 ( -3.044 2.385 0.692) 3.929 11.297 ( 2.226 2.646 1.714) 3.859 12.216 ( -8.001 4.904 1.262) 9.469 12.620 ( -4.823 5.143 0.666) 7.082 13.031 ( -3.139 1.596 -0.716) 3.594 13.291 ( -7.295 -5.611 -2.593) 9.562 13.322 ( 0.635 -0.886 1.463) 1.825 13.578 ( 12.026 2.557 3.294) 12.728 13.912 ( -7.972 2.277 4.582) 9.472 14.225 ( -13.468 -12.919 12.994) 22.740 14.518 ( 18.997 3.176 -10.936) 22.148 16.953 ( -7.793 -1.052 3.000) 8.416 17.462 ( 8.110 15.028 1.113) 17.113 19.309 ( -21.020 -3.340 -10.378) 23.679 20.738 ( 29.252 -15.917 -153.165) 156.744 21.249 ( 3.133 -1.917 -28.123) 28.362 21.480 ( -16.748 4.864 125.171) 126.380 24.747 ( 52.130 20.419 14.617) 57.863 28.389 ( -0.960 -2.192 -0.705) 2.495 29.021 ( -25.253 -9.322 -9.907) 28.684 ======================= Grid point 2 (3/300) ======================= q-point: ( 0.18 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.024 ( 16.937 -21.229 -1.882) 27.223 1.367 ( 9.151 -27.759 -2.556) 29.340 1.942 ( 11.921 -41.540 5.522) 43.568 2.690 ( -3.742 -9.026 -9.281) 13.476 2.949 ( 4.114 -17.200 9.212) 19.940 3.230 ( 1.668 -14.247 -2.140) 14.503 4.234 ( 1.585 0.800 -2.266) 2.879 4.617 ( -5.575 -0.639 -3.911) 6.840 5.222 ( -1.746 4.355 -0.348) 4.705 5.628 ( -1.007 6.175 1.725) 6.490 6.067 ( 0.432 2.744 1.132) 2.999 6.212 ( -3.538 6.194 -0.308) 7.140 6.507 ( 12.883 5.792 -4.304) 14.766 6.638 ( 3.581 5.787 -2.381) 7.210 6.937 ( 6.376 -7.712 -0.725) 10.033 7.290 ( 0.197 -14.029 0.136) 14.031 8.011 ( -8.164 5.891 3.754) 10.745 8.782 ( -6.643 -9.312 1.886) 11.593 9.007 ( -0.830 3.588 2.481) 4.441 9.253 ( 10.181 6.703 -5.838) 13.515 9.588 ( -12.229 -19.430 -23.573) 32.905 10.393 ( 7.467 11.341 17.484) 22.137 11.063 ( -3.571 0.703 2.761) 4.568 11.263 ( 4.798 3.876 3.706) 7.196 11.996 ( -3.357 13.904 -0.293) 14.307 12.455 ( -5.733 8.116 0.946) 9.981 12.965 ( -4.631 2.131 -1.198) 5.237 13.343 ( 1.565 0.164 2.025) 2.565 13.359 ( 0.335 -4.653 -4.239) 6.303 13.641 ( 9.340 -0.295 2.939) 9.796 13.845 ( -5.708 -0.441 0.667) 5.764 14.401 ( -4.972 -10.797 6.561) 13.577 14.604 ( 6.978 -3.824 -3.970) 8.893 16.794 ( -18.733 11.349 5.047) 22.477 17.292 ( 15.533 7.838 0.274) 17.401 19.267 ( -16.439 -8.539 -8.961) 20.578 20.913 ( 11.783 -3.941 -43.731) 45.462 21.257 ( 6.387 -1.411 -46.867) 47.321 21.530 ( -5.705 -1.587 67.004) 67.265 24.754 ( 21.565 9.120 6.932) 24.419 28.438 ( -1.684 -4.252 -1.017) 4.685 28.986 ( -8.131 -1.071 -5.223) 9.723 ======================= Grid point 3 (4/300) ======================= q-point: ( 0.27 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.519 ( 14.737 -19.337 0.901) 24.329 1.859 ( 10.112 -17.738 -0.325) 20.420 2.701 ( 4.531 -29.743 13.846) 33.119 2.890 ( 0.184 -17.143 -17.016) 24.155 3.333 ( 2.773 -18.400 6.059) 19.570 3.537 ( 2.136 -17.571 -0.891) 17.723 4.191 ( -0.045 4.559 -1.129) 4.697 4.605 ( -3.618 -3.472 -7.785) 9.260 5.097 ( -1.971 8.004 1.291) 8.343 5.516 ( 1.491 5.985 2.466) 6.642 6.010 ( 0.936 2.869 0.938) 3.160 6.069 ( -6.668 5.113 1.109) 8.476 6.472 ( 3.344 4.676 -1.860) 6.042 6.533 ( 8.899 8.379 -2.071) 12.397 7.099 ( 7.262 -3.968 -3.387) 8.942 7.615 ( 0.389 -19.528 -0.255) 19.533 7.890 ( -7.297 1.491 5.609) 9.324 8.902 ( -6.526 -5.306 5.364) 9.976 8.937 ( -1.658 0.959 -1.439) 2.395 9.184 ( 10.658 6.724 -7.269) 14.548 9.818 ( -2.675 -12.736 -13.615) 18.834 10.209 ( 1.763 13.125 9.670) 16.398 11.026 ( -3.605 2.180 3.291) 5.346 11.251 ( 4.420 1.465 4.240) 6.298 11.699 ( -2.987 13.446 -1.085) 13.816 12.255 ( -2.904 10.131 1.895) 10.708 12.891 ( -4.864 1.690 -1.201) 5.288 13.324 ( 1.946 3.621 -0.990) 4.229 13.451 ( 1.422 -5.106 -4.172) 6.745 13.696 ( -0.242 -1.260 0.964) 1.605 13.884 ( 4.168 -4.109 2.791) 6.485 14.568 ( -1.955 -8.410 2.563) 9.007 14.745 ( 2.835 -8.003 0.620) 8.513 16.370 ( -15.860 18.402 3.352) 24.524 17.368 ( 11.049 -3.791 0.568) 11.695 19.339 ( -5.938 -7.976 -6.178) 11.707 20.925 ( 1.008 1.345 -9.669) 9.814 21.220 ( 3.813 1.984 -26.137) 26.488 21.654 ( -0.990 -4.490 22.543) 23.007 24.725 ( 9.199 6.843 4.161) 12.197 28.517 ( -2.219 -5.618 -0.842) 6.099 28.930 ( -1.608 2.498 -3.596) 4.665 ======================= Grid point 4 (5/300) ======================= q-point: ( 0.36 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.938 ( 11.119 -14.831 2.981) 18.775 2.173 ( 8.961 -8.803 -0.144) 12.562 3.112 ( -9.121 -18.820 3.193) 21.156 3.261 ( 10.632 -14.386 -4.363) 18.413 3.648 ( -0.634 -12.697 2.644) 12.985 3.906 ( 4.052 -19.209 -1.578) 19.695 4.067 ( -3.489 6.516 0.119) 7.392 4.692 ( -0.315 -9.192 -7.605) 11.934 4.895 ( -3.160 11.994 3.485) 12.884 5.420 ( 4.439 8.107 -0.252) 9.246 5.937 ( -6.091 3.061 0.100) 6.817 6.007 ( -0.779 -1.615 3.676) 4.090 6.351 ( 4.026 9.031 -2.610) 10.226 6.486 ( 6.076 3.229 -0.256) 6.885 7.171 ( 3.987 -0.588 -3.781) 5.526 7.836 ( -0.527 -0.985 2.834) 3.046 8.016 ( -5.541 -20.383 3.439) 21.401 8.835 ( 2.927 5.767 -3.012) 7.134 8.995 ( -6.111 -4.341 0.755) 7.534 9.144 ( 8.161 3.634 -3.042) 9.437 9.908 ( -1.593 0.987 -6.920) 7.170 10.025 ( 1.649 7.999 8.148) 11.537 10.959 ( -1.533 1.762 0.505) 2.390 11.256 ( 2.512 2.097 0.600) 3.327 11.522 ( -6.455 0.562 0.740) 6.522 12.045 ( 2.084 12.368 2.583) 12.806 12.837 ( -4.018 0.461 -0.542) 4.080 13.240 ( 1.047 5.420 -3.251) 6.406 13.549 ( 2.089 -4.483 -3.347) 5.972 13.708 ( -3.733 -1.676 0.765) 4.163 14.021 ( 6.940 -4.499 3.839) 9.118 14.682 ( -0.980 -4.660 0.033) 4.762 14.936 ( 1.435 -9.884 2.508) 10.298 15.962 ( -10.643 14.796 1.291) 18.272 17.545 ( 6.925 -7.310 0.227) 10.072 19.425 ( 0.823 -3.461 -3.490) 4.984 20.878 ( -1.791 1.587 -2.849) 3.720 21.163 ( 1.997 2.420 -12.694) 13.076 21.738 ( -2.077 -2.856 8.196) 8.924 24.650 ( 2.579 5.779 2.406) 6.770 28.603 ( -2.802 -5.263 -0.404) 5.977 28.866 ( 1.676 3.487 -2.375) 4.540 ======================= Grid point 5 (6/300) ======================= q-point: ( 0.45 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.220 ( 5.407 -7.946 3.215) 10.135 2.304 ( 2.564 -0.599 -1.682) 3.124 3.349 ( -7.329 -11.852 0.649) 13.950 3.458 ( 9.196 0.391 -2.721) 9.598 3.800 ( -4.413 -6.092 5.259) 9.178 3.934 ( -0.310 5.350 -2.240) 5.808 4.281 ( 4.050 -17.878 -3.873) 18.736 4.619 ( -3.011 15.415 4.130) 16.240 4.922 ( -0.478 -15.125 -2.834) 15.396 5.233 ( 2.316 14.060 -0.677) 14.265 5.885 ( -3.058 -0.422 0.655) 3.156 6.063 ( -0.869 -3.472 3.611) 5.084 6.220 ( 3.624 6.470 -3.608) 8.247 6.478 ( 1.719 0.853 0.412) 1.963 7.185 ( 1.222 0.139 -1.681) 2.083 7.855 ( -0.397 -0.831 1.458) 1.725 8.308 ( -4.008 -11.353 3.149) 12.445 8.751 ( 3.916 4.477 -4.642) 7.545 9.003 ( -1.672 -0.182 -0.122) 1.686 9.140 ( 2.343 0.928 0.123) 2.523 9.846 ( 1.967 1.581 -4.550) 5.203 9.912 ( -2.829 5.137 6.621) 8.845 10.959 ( 1.587 -0.532 -0.852) 1.878 11.219 ( 0.660 1.887 -0.534) 2.069 11.567 ( -8.028 -8.386 0.459) 11.618 11.844 ( 5.322 11.189 1.692) 12.505 12.816 ( -1.650 -0.316 0.075) 1.681 13.156 ( 0.273 2.782 -1.888) 3.373 13.621 ( 1.598 -1.845 -1.573) 2.904 13.709 ( -2.158 -0.662 0.819) 2.401 14.128 ( 2.953 -1.981 1.633) 3.913 14.732 ( -0.403 -1.398 -0.257) 1.477 15.106 ( 0.789 -5.639 1.419) 5.868 15.700 ( -4.085 6.751 0.002) 7.891 17.695 ( 2.480 -3.867 -0.017) 4.594 19.461 ( 1.298 -0.263 -1.033) 1.680 20.844 ( -0.977 0.539 -0.976) 1.482 21.124 ( 0.633 1.046 -3.900) 4.087 21.769 ( -1.271 -1.022 2.401) 2.902 24.579 ( 0.210 2.475 0.808) 2.612 28.659 ( -1.869 -2.317 -0.067) 2.978 28.825 ( 1.699 1.730 -0.887) 2.582 ======================= Grid point 12 (7/300) ======================= q-point: ( 0.09 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.321 ( 24.388 0.000 -9.098) 26.029 0.358 ( 22.014 0.000 11.293) 24.742 0.778 ( 56.407 0.000 -10.976) 57.465 2.493 ( 1.135 0.000 5.611) 5.725 2.657 ( -0.360 -0.000 0.655) 0.747 2.928 ( 2.800 0.000 -2.541) 3.781 4.233 ( 1.810 0.000 -2.003) 2.700 4.504 ( 1.059 0.000 0.113) 1.065 5.300 ( -2.767 -0.000 -0.971) 2.933 5.769 ( -1.061 -0.000 -3.064) 3.243 6.131 ( 5.721 0.000 -16.000) 16.992 6.312 ( -4.079 -0.000 -0.192) 4.084 6.648 ( -5.291 -0.000 -6.180) 8.135 6.691 ( -0.237 -0.000 -0.392) 0.458 7.039 ( -1.106 -0.000 2.185) 2.449 7.699 ( 1.665 0.000 1.901) 2.527 7.748 ( 28.822 0.000 -102.368) 106.348 8.181 ( -13.217 -0.000 2.786) 13.507 8.578 ( -3.595 -0.000 -8.966) 9.660 9.095 ( -0.969 -0.000 2.891) 3.049 9.438 ( 17.598 0.000 -2.466) 17.770 10.946 ( -17.426 -0.000 54.611) 57.324 11.264 ( 5.185 0.000 27.340) 27.827 11.304 ( -2.236 -0.000 2.577) 3.412 11.996 ( 3.580 0.000 -3.968) 5.344 12.614 ( -9.865 -0.000 2.112) 10.088 13.034 ( -3.303 -0.000 -0.152) 3.306 13.088 ( 4.127 0.000 -6.213) 7.459 13.326 ( 2.209 0.000 2.371) 3.241 13.701 ( -2.085 -0.000 0.896) 2.269 13.838 ( -9.307 -0.000 22.524) 24.371 14.035 ( 4.107 0.000 5.311) 6.714 14.718 ( -6.550 -0.000 0.429) 6.564 16.975 ( 1.914 0.000 0.832) 2.087 17.560 ( -2.987 -0.000 -2.030) 3.612 19.418 ( 3.661 0.000 -0.146) 3.664 20.103 ( 86.994 0.000 -352.026) 362.616 21.234 ( -3.024 -0.000 6.197) 6.896 21.614 ( -33.724 -0.000 142.814) 146.741 27.120 ( 3.765 0.000 -17.631) 18.028 27.301 ( 3.267 0.000 0.137) 3.270 28.356 ( -1.880 -0.000 -1.893) 2.667 ======================= Grid point 13 (8/300) ======================= q-point: ( 0.18 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.726 ( 16.897 -23.840 -11.839) 31.528 0.945 ( 16.964 -27.170 6.015) 32.591 1.403 ( 38.334 -27.579 -2.828) 47.308 2.545 ( -0.887 -3.331 0.283) 3.458 2.743 ( 2.823 -9.401 7.287) 12.225 3.027 ( 3.738 -8.171 -4.584) 10.087 4.239 ( 2.406 -0.423 -3.784) 4.504 4.553 ( -4.338 -1.699 -1.536) 4.906 5.256 ( -2.897 1.712 -1.403) 3.646 5.712 ( -2.239 3.839 -0.300) 4.455 6.112 ( 2.131 1.694 -0.011) 2.722 6.269 ( -6.432 2.873 -1.629) 7.230 6.658 ( -0.091 2.185 -0.201) 2.196 6.687 ( -2.436 -4.485 -7.859) 9.371 7.070 ( 31.534 17.265 -10.608) 37.483 7.100 ( -0.283 -6.492 3.016) 7.164 8.040 ( -13.370 4.072 3.897) 14.510 8.567 ( -11.719 -9.294 4.562) 15.637 8.770 ( -19.852 -38.769 -41.511) 60.169 9.088 ( -1.794 -0.934 2.648) 3.332 9.498 ( 20.571 6.753 -3.335) 21.906 10.773 ( 6.010 16.109 30.964) 35.417 11.072 ( -2.922 5.365 0.232) 6.113 11.373 ( 6.484 2.013 6.732) 9.561 12.124 ( -3.049 0.107 -0.414) 3.079 12.503 ( -11.246 3.587 1.847) 11.948 12.973 ( -3.703 2.258 -1.289) 4.525 13.233 ( -0.768 -8.398 -5.518) 10.078 13.360 ( 4.055 -0.576 2.764) 4.941 13.702 ( 2.530 -1.856 0.683) 3.211 13.785 ( -9.995 1.595 8.908) 13.484 14.184 ( 0.486 -9.844 7.013) 12.097 14.623 ( -0.405 2.054 -2.255) 3.077 16.872 ( -3.398 8.904 0.727) 9.558 17.544 ( -0.224 4.712 5.657) 7.366 19.080 ( 4.679 9.275 -33.860) 35.418 20.648 ( 26.662 -26.538 -129.662) 135.009 21.213 ( -1.466 0.376 -2.989) 3.350 21.604 ( -14.853 1.517 79.686) 81.073 25.572 ( 45.107 57.738 10.289) 73.987 28.354 ( -3.631 -2.853 -1.426) 4.832 28.576 ( -23.805 -36.521 -12.645) 45.392 ======================= Grid point 14 (9/300) ======================= q-point: ( 0.27 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.264 ( 17.596 -21.750 -6.645) 28.755 1.549 ( 15.077 -24.034 3.339) 28.567 2.199 ( 19.841 -32.316 7.173) 38.593 2.620 ( -1.235 -7.902 -9.365) 12.316 3.047 ( 5.785 -16.362 9.961) 20.010 3.250 ( 2.578 -13.845 -4.200) 14.696 4.253 ( 2.135 1.229 -3.415) 4.210 4.516 ( -5.617 -0.527 -5.764) 8.065 5.190 ( -2.367 3.556 -0.707) 4.329 5.619 ( -1.021 4.469 2.311) 5.133 6.068 ( -3.065 3.888 2.567) 5.577 6.136 ( -5.490 5.037 -0.482) 7.466 6.591 ( 1.742 4.824 -0.472) 5.150 6.695 ( 4.187 3.163 -5.208) 7.393 7.132 ( 20.510 -0.148 -4.161) 20.928 7.291 ( -0.102 -13.919 -0.366) 13.924 7.892 ( -9.769 3.000 5.133) 11.436 8.665 ( -10.774 -9.977 3.332) 15.057 8.972 ( -6.339 -0.812 1.482) 6.561 9.248 ( -6.420 -16.182 -22.650) 28.567 9.524 ( 14.538 -0.066 -5.308) 15.477 10.537 ( 4.488 17.183 13.652) 22.400 11.021 ( -3.645 -0.380 4.197) 5.572 11.363 ( 5.943 5.052 6.511) 10.161 11.958 ( -0.898 13.913 -1.774) 14.054 12.360 ( -7.524 4.553 2.226) 9.072 12.899 ( -3.491 2.550 -0.977) 4.432 13.341 ( -0.769 -5.349 -4.520) 7.046 13.391 ( 3.962 1.251 -0.844) 4.240 13.700 ( -6.259 1.664 3.073) 7.169 13.812 ( 4.005 -6.640 1.642) 7.926 14.388 ( 0.057 -10.194 5.369) 11.521 14.644 ( -0.711 -4.432 0.460) 4.512 16.575 ( -13.253 16.335 1.696) 21.103 17.469 ( 7.085 4.455 5.390) 9.955 19.086 ( 0.929 -9.736 -19.923) 22.194 20.900 ( 6.237 -5.230 -39.137) 39.974 21.204 ( 4.000 -1.081 -27.622) 27.931 21.638 ( -6.044 -1.479 43.621) 44.063 25.119 ( 23.812 25.304 7.233) 35.491 28.398 ( -3.348 -4.804 -1.678) 6.091 28.834 ( -9.129 -10.344 -7.192) 15.558 ======================= Grid point 15 (10/300) ======================= q-point: ( 0.36 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.746 ( 16.628 -17.184 -1.847) 23.984 2.039 ( 13.905 -15.834 4.106) 21.469 2.717 ( -5.864 -15.751 4.467) 17.391 2.951 ( 11.535 -25.163 -4.557) 28.053 3.392 ( 3.652 -14.512 1.599) 15.050 3.575 ( 4.046 -18.741 0.041) 19.173 4.171 ( -2.671 6.529 -0.172) 7.056 4.530 ( -2.272 -5.599 -9.533) 11.287 5.072 ( -2.161 7.711 1.621) 8.171 5.550 ( 2.025 3.838 1.569) 4.614 5.932 ( -12.458 4.160 2.952) 13.462 6.046 ( 3.029 3.358 -1.869) 4.893 6.501 ( 1.821 6.023 -1.234) 6.412 6.639 ( 6.224 5.776 0.071) 8.492 7.226 ( 11.736 1.878 -6.045) 13.334 7.608 ( -1.546 -19.435 0.368) 19.500 7.827 ( -3.177 -0.090 4.666) 5.645 8.787 ( -10.672 -9.847 4.576) 15.225 8.916 ( -2.950 2.743 3.374) 5.255 9.322 ( 12.600 4.083 -13.638) 19.011 9.728 ( -2.938 -14.121 -9.300) 17.162 10.274 ( 2.213 14.700 9.081) 17.420 10.990 ( -3.145 2.375 3.269) 5.120 11.298 ( -0.927 4.437 5.997) 7.517 11.670 ( 0.330 14.343 -3.119) 14.682 12.234 ( -0.770 6.585 3.418) 7.459 12.833 ( -2.528 1.871 -0.093) 3.147 13.338 ( 0.789 4.815 -4.912) 6.923 13.441 ( -0.543 -6.367 -5.182) 8.227 13.665 ( -3.040 -0.858 2.408) 3.972 13.982 ( 6.195 -6.297 3.879) 9.647 14.567 ( 0.926 -7.623 1.194) 7.771 14.770 ( -0.776 -8.927 4.543) 10.047 16.154 ( -14.719 16.369 1.043) 22.038 17.510 ( 6.863 -2.055 3.170) 7.835 19.289 ( 4.872 -10.810 -12.156) 16.981 20.892 ( -1.764 1.420 -6.502) 6.885 21.190 ( 4.028 1.073 -23.475) 23.842 21.699 ( -2.772 -2.118 18.335) 18.664 24.876 ( 9.318 15.469 4.653) 18.648 28.476 ( -2.887 -5.939 -1.242) 6.720 28.888 ( -2.149 -1.759 -4.461) 5.255 ======================= Grid point 16 (11/300) ======================= q-point: ( 0.45 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.113 ( 11.913 -10.800 1.298) 16.132 2.314 ( 10.242 -3.496 2.077) 11.020 2.988 ( -7.814 -18.737 -1.645) 20.368 3.403 ( 7.056 -14.306 4.559) 16.590 3.629 ( -2.180 -9.734 -1.310) 10.060 3.933 ( 1.017 -10.896 -2.921) 11.326 4.057 ( 3.147 -1.701 1.084) 3.738 4.657 ( -1.066 -10.934 -6.057) 12.545 4.875 ( -1.676 12.286 3.322) 12.837 5.473 ( 3.475 8.343 -1.913) 9.238 5.788 ( -14.430 -0.134 2.782) 14.696 6.044 ( 3.997 -0.047 -0.828) 4.082 6.388 ( 2.960 7.440 -2.847) 8.498 6.578 ( 5.495 5.432 2.841) 8.233 7.228 ( 5.824 2.789 -4.928) 8.123 7.834 ( -1.424 -2.659 3.881) 4.915 7.970 ( -1.882 -18.108 0.902) 18.228 8.840 ( -1.883 2.385 1.511) 3.393 8.885 ( -7.987 -5.269 1.489) 9.684 9.303 ( 15.221 6.133 -7.840) 18.187 9.853 ( -2.903 -2.743 -5.153) 6.519 10.061 ( -1.159 11.004 8.411) 13.899 10.949 ( -0.063 -0.561 -0.881) 1.046 11.233 ( -6.770 -0.495 3.282) 7.540 11.459 ( -1.582 6.868 -1.795) 7.273 12.101 ( 4.038 9.957 2.865) 11.120 12.804 ( -0.469 0.069 1.493) 1.566 13.227 ( -0.796 5.135 -6.543) 8.355 13.550 ( 0.130 -5.668 -3.593) 6.712 13.680 ( -0.895 -1.535 2.095) 2.747 14.118 ( 4.325 -2.936 4.064) 6.622 14.686 ( 1.963 -4.144 -1.061) 4.706 14.962 ( 0.097 -10.036 5.749) 11.566 15.807 ( -10.927 10.374 -0.509) 15.076 17.623 ( 3.019 -4.906 1.070) 5.859 19.458 ( 6.573 -3.638 -6.519) 9.947 20.845 ( -1.445 0.866 -2.372) 2.910 21.151 ( 2.132 1.902 -11.309) 11.664 21.739 ( -1.755 -1.755 8.351) 8.712 24.684 ( 0.816 9.318 2.462) 9.672 28.563 ( -2.431 -5.341 -0.789) 5.921 28.877 ( 0.975 1.518 -2.311) 2.932 ======================= Grid point 17 (12/300) ======================= q-point: ( 0.55 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.295 ( 2.682 -1.503 1.028) 3.242 2.337 ( 3.755 5.068 -0.483) 6.326 3.250 ( -6.073 -12.988 -0.094) 14.338 3.549 ( 2.313 1.876 0.986) 3.137 3.782 ( -2.332 -9.545 5.700) 11.360 3.914 ( 2.602 3.876 -5.131) 6.937 4.351 ( 7.210 -15.349 -4.208) 17.472 4.592 ( -2.905 15.930 3.727) 16.616 4.908 ( -0.915 -15.025 -0.344) 15.057 5.254 ( 0.799 15.207 0.638) 15.241 5.776 ( -10.589 -7.216 -2.401) 13.037 6.067 ( -0.118 -0.017 1.850) 1.854 6.271 ( 4.868 6.909 -3.295) 9.072 6.525 ( 3.520 4.212 2.246) 5.931 7.204 ( 2.048 1.962 -1.306) 3.122 7.873 ( 2.731 -0.274 -0.287) 2.759 8.257 ( -5.088 -13.866 3.637) 15.212 8.761 ( 0.001 5.338 -2.959) 6.103 8.920 ( -6.837 -3.991 1.814) 8.122 9.274 ( 13.357 7.162 -3.070) 15.464 9.847 ( -2.188 1.912 2.730) 3.987 9.883 ( -2.069 3.113 -0.358) 3.755 10.952 ( -2.446 0.779 0.571) 2.630 11.238 ( 2.598 1.349 -1.255) 3.185 11.441 ( -9.120 -11.720 -0.344) 14.854 11.926 ( 4.950 12.151 0.945) 13.154 12.826 ( 2.470 -0.963 2.385) 3.566 13.141 ( -1.080 1.731 -4.095) 4.576 13.611 ( -1.567 -1.361 -0.398) 2.113 13.718 ( 2.184 -1.789 -0.034) 2.824 14.151 ( -0.466 1.586 1.638) 2.327 14.748 ( 2.765 -0.859 -0.396) 2.922 15.120 ( -0.181 -4.293 3.625) 5.622 15.640 ( -3.926 0.607 -1.271) 4.171 17.700 ( -1.640 -1.685 -0.009) 2.352 19.493 ( 3.780 2.221 -2.360) 4.979 20.840 ( 1.101 -0.643 -2.036) 2.402 21.122 ( 0.551 0.714 -2.206) 2.383 21.775 ( 0.584 -1.293 3.330) 3.620 24.568 ( -1.983 2.551 0.576) 3.282 28.635 ( -1.274 -4.036 -0.514) 4.264 28.842 ( 1.082 2.692 -0.409) 2.930 ======================= Grid point 18 (13/300) ======================= q-point: (-0.36 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.137 ( -4.459 12.716 -3.191) 13.848 2.271 ( -2.745 6.260 1.433) 6.984 3.330 ( -6.548 0.541 -0.047) 6.571 3.468 ( 6.406 10.376 3.923) 12.810 3.806 ( -3.412 4.290 -4.409) 7.035 3.967 ( 6.049 -5.112 -0.300) 7.925 4.250 ( -3.151 18.388 3.308) 18.947 4.652 ( 3.595 -12.931 -4.002) 14.005 4.946 ( 1.203 13.426 4.943) 14.357 5.192 ( -3.781 -12.278 0.844) 12.874 5.868 ( -3.057 -7.581 -3.023) 8.715 6.045 ( -1.925 0.469 -3.778) 4.266 6.211 ( 0.758 1.043 3.147) 3.401 6.475 ( 0.560 2.996 0.877) 3.172 7.182 ( -0.091 1.315 1.489) 1.989 7.870 ( 2.387 2.123 -2.390) 3.989 8.357 ( 4.585 7.102 -2.473) 8.808 8.671 ( -9.509 -3.281 5.379) 11.407 8.958 ( -3.685 -3.857 0.873) 5.406 9.218 ( 8.629 6.478 -1.712) 10.925 9.827 ( -2.816 -4.439 4.639) 7.011 9.917 ( 1.209 -3.413 -6.074) 7.071 10.929 ( -2.427 -1.456 1.331) 3.128 11.205 ( -1.819 1.037 -0.041) 2.094 11.651 ( 4.060 -3.158 -1.316) 5.309 11.784 ( -1.908 -3.369 -1.141) 4.037 12.866 ( 4.512 -0.097 1.582) 4.782 13.147 ( -1.381 -3.550 -0.401) 3.830 13.590 ( -2.569 1.735 1.169) 3.313 13.760 ( 4.253 0.026 -0.309) 4.264 14.063 ( -5.045 5.312 -1.129) 7.412 14.756 ( 2.443 2.035 0.149) 3.183 15.088 ( -1.438 6.608 0.236) 6.767 15.751 ( 3.211 -12.047 -0.606) 12.482 17.640 ( -4.585 5.659 0.050) 7.284 19.460 ( 0.665 1.926 -0.303) 2.060 20.869 ( 2.170 -1.301 -0.420) 2.565 21.130 ( -0.524 -1.428 4.146) 4.416 21.792 ( 2.465 1.340 -0.812) 2.921 24.559 ( -1.844 -2.565 -0.766) 3.250 28.687 ( 2.254 -0.272 -0.637) 2.358 28.801 ( -2.163 0.247 1.328) 2.550 ======================= Grid point 19 (14/300) ======================= q-point: (-0.27 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.796 ( -6.926 18.461 -2.625) 19.891 2.070 ( -5.614 11.658 1.016) 12.979 3.119 ( -3.705 17.738 -6.147) 19.135 3.258 ( 4.912 17.213 9.151) 20.103 3.623 ( -2.379 13.372 -3.684) 14.073 3.859 ( -2.416 18.147 -0.426) 18.312 4.112 ( 2.191 -4.175 0.916) 4.803 4.713 ( -0.457 5.331 5.195) 7.458 4.940 ( 3.872 -9.047 -1.614) 9.973 5.359 ( -3.697 -8.809 -0.368) 9.560 5.950 ( -1.612 -2.433 2.021) 3.551 6.065 ( 8.009 -1.571 -8.411) 11.720 6.274 ( -8.566 -10.159 4.619) 14.068 6.429 ( -2.316 1.148 1.285) 2.887 7.145 ( -1.273 2.976 1.817) 3.712 7.832 ( 0.028 3.174 -1.553) 3.534 8.092 ( 6.077 19.069 -3.660) 20.346 8.776 ( -6.500 -9.951 5.000) 12.894 9.007 ( -2.039 -3.347 1.367) 4.151 9.141 ( 4.167 6.688 -1.866) 8.097 9.933 ( -1.311 -0.695 4.526) 4.763 9.983 ( -0.086 -9.185 -4.713) 10.324 10.992 ( 3.440 -3.998 -1.331) 5.440 11.187 ( -6.193 -1.622 0.658) 6.435 11.604 ( 4.831 1.744 -1.270) 5.291 12.024 ( -0.248 -15.136 -1.204) 15.186 12.906 ( 4.570 -0.653 1.161) 4.760 13.227 ( -1.549 -5.276 0.579) 5.529 13.523 ( -2.231 3.633 1.691) 4.586 13.765 ( 3.849 3.501 0.746) 5.257 13.913 ( -6.147 4.344 -2.700) 7.997 14.706 ( 2.000 5.035 -0.314) 5.427 14.906 ( -1.947 10.522 -0.605) 10.717 16.085 ( 6.903 -19.317 -1.357) 20.558 17.451 ( -5.499 9.706 0.327) 11.160 19.440 ( 1.215 0.974 0.801) 1.751 20.910 ( 1.404 -1.404 1.613) 2.559 21.179 ( -1.226 -3.132 9.208) 9.803 21.741 ( 1.579 5.455 -5.228) 7.719 24.604 ( -2.461 -3.175 -1.544) 4.304 28.640 ( 2.198 5.757 -0.038) 6.162 28.848 ( -1.647 -5.448 1.656) 5.927 ======================= Grid point 20 (15/300) ======================= q-point: (-0.18 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.357 ( -6.354 22.651 -0.899) 23.542 1.763 ( -3.675 18.453 0.913) 18.837 2.602 ( -3.171 33.610 -3.901) 33.984 2.967 ( 2.644 16.500 6.914) 18.084 3.275 ( -2.203 20.066 -4.254) 20.630 3.518 ( -0.819 16.849 0.298) 16.871 4.191 ( -0.258 -3.111 0.641) 3.187 4.666 ( 1.720 1.348 3.141) 3.827 5.115 ( 0.849 -7.668 -0.472) 7.729 5.496 ( -0.473 -7.832 -1.101) 7.923 5.997 ( -0.491 -3.776 -0.200) 3.813 6.144 ( 4.551 -3.056 -2.053) 5.854 6.376 ( -8.211 -2.771 2.976) 9.163 6.475 ( -0.939 -9.154 0.387) 9.211 7.049 ( -1.507 6.377 0.808) 6.602 7.608 ( -0.409 18.583 0.118) 18.588 7.962 ( 3.800 -1.555 -2.592) 4.855 8.911 ( -0.724 -6.217 -0.632) 6.291 8.995 ( 3.142 8.709 0.836) 9.296 9.093 ( -3.974 -5.389 1.279) 6.818 9.875 ( 0.248 5.815 6.800) 8.951 10.170 ( -0.072 -9.250 -4.729) 10.389 11.069 ( 3.418 -0.915 -1.755) 3.950 11.171 ( -4.446 -1.970 -1.101) 4.986 11.741 ( 1.955 -12.907 0.027) 13.055 12.285 ( 1.492 -12.345 -0.520) 12.445 12.958 ( 3.074 -1.758 0.807) 3.632 13.302 ( -0.934 -3.373 -0.374) 3.519 13.438 ( -1.306 4.177 1.744) 4.712 13.655 ( -3.019 6.538 -0.970) 7.266 13.866 ( 0.693 -0.316 -0.396) 0.859 14.599 ( 2.924 7.750 -1.956) 8.511 14.696 ( -3.481 9.454 1.032) 10.127 16.542 ( 7.994 -23.546 -2.188) 24.962 17.236 ( -6.061 8.465 0.659) 10.432 19.442 ( 4.763 1.286 1.102) 5.055 20.934 ( -1.068 0.045 5.330) 5.436 21.256 ( -1.801 -3.856 15.295) 15.876 21.589 ( 0.005 9.260 -14.122) 16.887 24.614 ( -4.063 -0.395 -1.765) 4.448 28.541 ( 0.837 5.632 0.287) 5.701 28.955 ( 0.596 -5.676 1.396) 5.875 ======================= Grid point 21 (16/300) ======================= q-point: (-0.09 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.886 ( 0.000 24.321 0.000) 24.321 1.309 ( 0.000 28.907 0.000) 28.907 1.846 ( 0.000 44.577 0.000) 44.577 2.755 ( 0.000 7.733 0.000) 7.733 2.884 ( 0.000 19.066 0.000) 19.066 3.221 ( 0.000 14.385 0.000) 14.385 4.227 ( -0.000 -0.904 -0.000) 0.904 4.671 ( -0.000 -0.367 -0.000) 0.367 5.236 ( -0.000 -4.968 -0.000) 4.968 5.632 ( -0.000 -6.738 -0.000) 6.738 6.060 ( -0.000 -2.121 -0.000) 2.121 6.239 ( -0.000 -5.509 -0.000) 5.509 6.382 ( -0.000 -2.351 -0.000) 2.351 6.621 ( -0.000 -5.776 -0.000) 5.776 6.906 ( 0.000 7.820 0.000) 7.820 7.288 ( 0.000 14.051 0.000) 14.051 8.068 ( -0.000 -7.171 -0.000) 7.171 8.829 ( 0.000 9.295 0.000) 9.295 9.003 ( -0.000 -4.113 -0.000) 4.113 9.182 ( -0.000 -4.612 -0.000) 4.612 9.762 ( 0.000 7.873 0.000) 7.873 10.276 ( -0.000 -3.413 -0.000) 3.413 11.087 ( -0.000 -1.379 -0.000) 1.379 11.220 ( -0.000 -4.096 -0.000) 4.096 12.027 ( -0.000 -14.816 -0.000) 14.816 12.496 ( -0.000 -9.434 -0.000) 9.434 13.008 ( -0.000 -2.109 -0.000) 2.109 13.332 ( -0.000 -0.119 -0.000) 0.119 13.368 ( 0.000 2.769 0.000) 2.769 13.543 ( 0.000 3.126 0.000) 3.126 13.889 ( -0.000 -1.607 -0.000) 1.607 14.462 ( 0.000 8.645 0.000) 8.645 14.519 ( 0.000 7.031 0.000) 7.031 17.035 ( -0.000 -24.177 -0.000) 24.177 17.065 ( 0.000 6.141 0.000) 6.141 19.446 ( 0.000 1.630 0.000) 1.630 20.894 ( 0.000 4.502 0.000) 4.502 21.345 ( -0.000 -4.094 -0.000) 4.094 21.386 ( 0.000 8.843 0.000) 8.843 24.567 ( 0.000 2.411 0.000) 2.411 28.452 ( 0.000 4.131 0.000) 4.131 29.061 ( -0.000 -4.720 -0.000) 4.720 ======================= Grid point 24 (17/300) ======================= q-point: ( 0.18 0.18 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.621 ( 22.263 0.000 -9.090) 24.047 0.693 ( 19.564 0.000 10.504) 22.206 1.498 ( 49.639 0.000 -12.161) 51.107 2.558 ( 4.739 0.000 11.414) 12.359 2.657 ( -0.218 -0.000 3.148) 3.156 2.977 ( 6.223 0.000 -6.282) 8.842 4.254 ( 2.200 0.000 -3.352) 4.010 4.518 ( 0.531 0.000 0.204) 0.569 5.248 ( -3.715 -0.000 -0.847) 3.810 5.730 ( -2.783 -0.000 -3.254) 4.281 6.162 ( 1.326 0.000 2.169) 2.542 6.231 ( -7.040 -0.000 -0.254) 7.045 6.520 ( -7.218 -0.000 -12.476) 14.413 6.683 ( -0.638 -0.000 -0.474) 0.795 7.027 ( -1.852 -0.000 3.153) 3.656 7.741 ( 2.909 0.000 3.167) 4.300 7.820 ( 17.300 0.000 -46.828) 49.921 7.981 ( -15.385 -0.000 3.712) 15.826 8.462 ( -9.019 -0.000 -4.843) 10.237 9.089 ( -1.784 -0.000 4.900) 5.215 9.730 ( 23.689 0.000 -3.298) 23.918 10.913 ( -5.173 -0.000 19.076) 19.765 11.264 ( -5.219 -0.000 3.961) 6.552 11.445 ( 7.750 0.000 20.853) 22.246 12.045 ( 5.045 0.000 -5.471) 7.441 12.459 ( -11.861 -0.000 2.042) 12.035 12.983 ( -2.855 -0.000 -0.525) 2.902 13.105 ( 1.984 0.000 -8.929) 9.147 13.395 ( 5.793 0.000 3.694) 6.870 13.660 ( -4.174 -0.000 1.383) 4.397 13.766 ( -8.665 -0.000 9.759) 13.051 14.127 ( 6.014 0.000 4.264) 7.372 14.596 ( -10.308 -0.000 0.860) 10.343 17.015 ( 3.091 0.000 1.195) 3.314 17.491 ( -5.129 -0.000 -3.439) 6.175 19.487 ( 5.778 0.000 -0.209) 5.782 20.128 ( 42.624 0.000 -166.131) 171.511 21.205 ( -4.854 -0.000 9.784) 10.922 21.634 ( -13.425 -0.000 61.647) 63.092 27.110 ( 1.370 0.000 -9.306) 9.406 27.370 ( 6.243 0.000 0.487) 6.262 28.306 ( -3.912 -0.000 -3.438) 5.208 ======================= Grid point 25 (18/300) ======================= q-point: ( 0.27 0.18 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.940 ( 18.641 -20.583 -11.633) 30.107 1.187 ( 12.945 -26.292 9.902) 30.933 1.944 ( 36.753 -15.337 -7.358) 40.499 2.559 ( 2.414 1.566 3.666) 4.660 2.841 ( 7.741 -12.990 11.347) 18.906 3.074 ( 5.619 -6.460 -7.850) 11.616 4.261 ( 2.216 -0.433 -4.628) 5.149 4.499 ( -3.059 2.114 -1.475) 4.000 5.209 ( -2.887 1.163 -1.500) 3.455 5.674 ( -2.638 2.622 -0.930) 3.834 6.115 ( -7.372 4.580 -1.729) 8.849 6.159 ( -4.453 1.243 7.059) 8.438 6.613 ( -2.034 -10.568 -9.846) 14.586 6.656 ( -0.639 2.152 -0.000) 2.245 7.092 ( -1.307 -7.520 1.419) 7.763 7.425 ( 22.273 14.063 -6.894) 27.229 7.864 ( -12.702 1.520 3.976) 13.396 8.373 ( -12.816 -22.348 -4.257) 26.112 8.485 ( -9.323 -17.834 -20.020) 28.386 9.080 ( -1.605 0.077 4.760) 5.024 9.804 ( 23.382 8.663 -4.027) 25.258 10.889 ( 0.699 8.363 17.268) 19.199 11.032 ( -3.551 9.485 0.884) 10.167 11.507 ( 7.183 3.253 9.542) 12.378 12.120 ( 1.966 0.732 -1.681) 2.688 12.343 ( -11.224 2.569 1.677) 11.635 12.932 ( -1.073 2.766 -1.087) 3.160 13.202 ( -0.616 -7.663 -6.416) 10.013 13.447 ( 6.521 0.537 1.076) 6.631 13.622 ( -10.075 -1.203 4.440) 11.076 13.748 ( -2.524 -2.670 3.332) 4.960 14.245 ( 4.424 -6.825 4.460) 9.276 14.547 ( -8.499 -2.751 1.267) 9.022 16.853 ( 0.357 16.945 -1.581) 17.022 17.505 ( -6.454 -2.892 3.693) 7.978 19.163 ( 19.190 16.929 -26.896) 37.125 20.576 ( 13.788 -25.278 -79.990) 85.015 21.181 ( -2.981 0.382 2.723) 4.055 21.645 ( -8.615 -0.212 43.276) 44.125 26.073 ( 24.669 54.138 4.167) 59.639 28.242 ( -11.079 -22.116 -2.439) 24.856 28.340 ( -5.404 -19.767 -8.659) 22.246 ======================= Grid point 26 (19/300) ======================= q-point: ( 0.36 0.18 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.478 ( 16.562 -23.447 -8.742) 30.008 1.764 ( 10.979 -24.067 8.450) 27.770 2.504 ( 17.718 -18.405 8.441) 26.906 2.597 ( 2.414 -8.209 -8.382) 11.978 3.197 ( 9.993 -11.839 4.205) 16.053 3.279 ( 5.345 -15.756 -1.269) 16.686 4.254 ( -1.246 3.267 -2.349) 4.212 4.430 ( -3.300 -0.588 -6.800) 7.581 5.153 ( -2.324 2.946 -0.830) 3.843 5.615 ( -0.588 2.454 1.202) 2.795 5.931 ( -13.607 5.157 -0.779) 14.572 6.124 ( 0.707 2.863 4.211) 5.141 6.594 ( -0.646 3.631 -0.199) 3.693 6.726 ( 3.083 -1.445 -3.902) 5.179 7.265 ( -2.446 -10.612 0.565) 10.905 7.424 ( 20.456 3.033 -6.607) 21.710 7.795 ( -5.773 -1.032 4.956) 7.678 8.511 ( -12.428 -11.042 4.506) 17.225 8.811 ( -13.265 -16.463 -8.510) 22.790 9.140 ( -1.130 -11.012 -7.536) 13.391 9.761 ( 18.940 10.091 -4.631) 21.955 10.609 ( 0.447 17.903 8.541) 19.841 10.995 ( -2.115 -0.361 4.735) 5.198 11.445 ( 1.525 8.321 6.160) 10.464 11.961 ( 2.212 14.931 -2.920) 15.373 12.282 ( -4.259 -0.476 3.515) 5.543 12.871 ( 0.095 3.076 0.165) 3.082 13.306 ( -1.733 -5.877 -4.344) 7.511 13.411 ( -1.555 4.267 -5.144) 6.862 13.624 ( -2.900 -2.315 4.431) 5.780 13.866 ( 1.560 -9.288 1.947) 9.617 14.429 ( 3.207 -8.598 2.730) 9.574 14.596 ( -6.576 -7.739 4.554) 11.130 16.436 ( -6.552 22.962 -1.730) 23.942 17.517 ( -2.492 -1.830 5.814) 6.585 19.169 ( 19.173 -4.232 -20.185) 28.159 20.820 ( -1.818 -7.313 -24.763) 25.884 21.174 ( 2.483 -1.009 -17.225) 17.432 21.673 ( -5.471 -1.504 26.224) 26.831 25.440 ( 17.935 34.026 5.283) 38.824 28.334 ( -4.550 -6.249 -1.891) 7.958 28.698 ( -6.373 -15.517 -6.584) 18.021 ======================= Grid point 27 (20/300) ======================= q-point: ( 0.45 0.18 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.962 ( 14.913 -16.491 -3.665) 22.534 2.255 ( 11.879 -16.932 8.289) 22.282 2.653 ( -1.642 -7.428 -3.473) 8.362 3.076 ( 4.525 -23.723 5.973) 24.878 3.414 ( -0.788 -10.744 -6.642) 12.656 3.696 ( 12.875 -17.370 4.516) 22.088 4.122 ( -3.780 6.085 0.991) 7.232 4.476 ( -1.123 -6.489 -9.624) 11.661 5.049 ( -1.888 7.081 1.564) 7.494 5.563 ( -1.666 2.269 -3.017) 4.126 5.752 ( -12.450 4.866 4.956) 14.257 6.093 ( 4.284 1.968 -1.449) 4.932 6.513 ( 0.154 4.846 -0.440) 4.868 6.715 ( 4.290 4.353 0.986) 6.190 7.341 ( 5.467 2.713 -4.430) 7.541 7.599 ( 1.855 -12.473 -0.470) 12.619 7.835 ( 2.185 -3.590 1.889) 4.608 8.647 ( -11.059 -10.791 5.133) 16.281 8.871 ( -4.870 -1.051 3.354) 6.006 9.398 ( 4.659 -11.849 -16.197) 20.602 9.723 ( 5.876 1.250 -1.916) 6.305 10.319 ( -0.167 14.898 7.179) 16.539 10.959 ( -2.667 2.595 2.381) 4.418 11.268 ( -5.090 8.698 4.673) 11.108 11.681 ( 2.276 14.803 -3.212) 15.318 12.260 ( 2.324 3.747 3.589) 5.685 12.829 ( 1.610 1.974 2.174) 3.348 13.290 ( -4.307 4.473 -8.665) 10.660 13.414 ( -0.810 -7.423 -3.310) 8.167 13.655 ( 0.476 -1.163 2.798) 3.068 14.060 ( 2.753 -7.674 3.563) 8.898 14.599 ( 3.549 -6.943 -2.408) 8.161 14.757 ( -4.091 -11.838 9.238) 15.563 15.977 ( -9.774 17.996 -1.752) 20.554 17.567 ( -0.232 -3.411 3.578) 4.949 19.400 ( 15.990 -7.512 -13.313) 22.121 20.829 ( -4.982 -0.890 -1.936) 5.418 21.171 ( 3.196 0.513 -17.298) 17.599 21.706 ( -3.428 -1.849 12.587) 13.176 25.006 ( 6.678 23.164 3.855) 24.414 28.431 ( -2.669 -6.740 -1.263) 7.359 28.843 ( -2.041 -5.259 -3.930) 6.875 ======================= Grid point 28 (21/300) ======================= q-point: ( 0.55 0.18 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.260 ( 7.755 -6.590 -0.037) 10.177 2.476 ( 11.227 3.226 3.097) 12.085 2.893 ( -4.391 -20.072 -2.383) 20.684 3.435 ( -5.608 -11.972 5.776) 14.427 3.583 ( -2.304 -10.854 -2.408) 11.355 3.984 ( 7.167 0.261 -0.904) 7.228 4.138 ( 7.312 -12.311 0.065) 14.319 4.620 ( -1.582 -11.283 -4.464) 12.236 4.862 ( -1.867 11.507 2.645) 11.953 5.500 ( 1.869 6.294 -7.875) 10.253 5.581 ( -15.118 1.029 7.263) 16.804 6.100 ( 4.052 1.293 -0.878) 4.343 6.417 ( 2.385 5.869 -2.577) 6.839 6.651 ( 3.095 5.423 3.582) 7.198 7.291 ( 4.944 5.033 -4.154) 8.187 7.824 ( -1.703 -9.905 3.510) 10.645 7.966 ( 0.978 -9.291 -1.047) 9.401 8.758 ( -8.078 -7.385 4.401) 11.797 8.843 ( -0.754 2.160 -0.400) 2.322 9.496 ( 15.677 4.775 -9.762) 19.076 9.797 ( -3.399 -5.961 -0.818) 6.911 10.044 ( -4.954 14.562 6.956) 16.882 10.949 ( 0.884 -2.293 -2.121) 3.246 11.122 ( -9.354 -0.607 4.003) 10.192 11.451 ( 0.836 10.448 -1.989) 10.669 12.164 ( 3.305 9.267 1.677) 9.981 12.839 ( 3.890 -0.341 4.240) 5.764 13.168 ( -3.944 3.529 -8.089) 9.667 13.543 ( 0.485 -5.905 -2.177) 6.312 13.686 ( 0.496 -1.727 1.477) 2.326 14.166 ( 0.802 -1.395 3.133) 3.522 14.731 ( 4.989 -4.089 -2.634) 6.968 14.977 ( -1.575 -11.056 8.459) 14.009 15.662 ( -8.399 7.767 -2.570) 11.725 17.637 ( -1.072 -3.551 1.048) 3.854 19.555 ( 9.338 -0.375 -6.561) 11.419 20.823 ( -0.930 -1.329 -0.914) 1.862 21.145 ( 1.639 1.521 -7.597) 7.919 21.745 ( -1.041 -2.495 6.210) 6.773 24.690 ( -0.718 12.909 1.829) 13.058 28.531 ( -1.594 -5.655 -0.753) 5.923 28.879 ( 0.356 -0.154 -1.664) 1.709 ======================= Grid point 29 (22/300) ======================= q-point: (-0.36 0.18 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.300 ( -0.631 5.246 -0.650) 5.324 2.404 ( 4.263 8.770 0.464) 9.762 3.186 ( -3.033 -11.941 0.486) 12.330 3.548 ( -1.577 -5.610 0.809) 5.884 3.729 ( -5.051 -4.677 2.668) 7.383 4.008 ( 9.114 1.076 -2.863) 9.613 4.437 ( 6.182 -12.241 -2.661) 13.969 4.558 ( -3.248 15.076 1.725) 15.518 4.892 ( -1.373 -14.156 1.178) 14.271 5.263 ( 0.004 15.456 2.033) 15.589 5.616 ( -8.930 -10.840 -3.615) 14.502 6.068 ( -0.278 3.466 0.782) 3.564 6.327 ( 4.018 5.883 -2.371) 7.509 6.572 ( 1.746 5.408 2.141) 6.073 7.229 ( 1.640 3.375 -0.698) 3.816 7.926 ( 4.840 0.520 -1.601) 5.124 8.187 ( -6.244 -15.678 3.391) 17.213 8.747 ( -0.323 7.053 -1.571) 7.233 8.851 ( -3.619 -5.510 1.325) 6.724 9.454 ( 13.011 10.281 -3.911) 17.038 9.782 ( -8.426 3.940 6.993) 11.637 9.873 ( 1.008 -2.036 -3.924) 4.535 10.910 ( -2.991 2.408 0.880) 3.939 11.274 ( 2.420 1.818 -0.981) 3.182 11.327 ( -6.011 -14.374 -0.480) 15.588 11.980 ( 2.393 12.120 0.167) 12.355 12.897 ( 5.497 -0.845 4.318) 7.041 13.091 ( -3.740 -0.074 -5.289) 6.478 13.596 ( -0.437 -0.125 0.153) 0.479 13.747 ( 1.702 -3.397 -0.354) 3.816 14.136 ( -1.756 4.365 1.046) 4.820 14.797 ( 3.719 0.047 -0.547) 3.760 15.123 ( -1.164 -2.900 3.827) 4.941 15.587 ( -2.423 -4.910 -1.685) 5.729 17.664 ( -2.611 -0.086 -0.060) 2.613 19.538 ( 3.203 4.803 -1.959) 6.096 20.854 ( 1.559 -1.649 -1.722) 2.849 21.123 ( 0.306 0.494 -0.712) 0.919 21.801 ( 1.298 -2.051 2.486) 3.475 24.536 ( -2.241 2.738 0.266) 3.549 28.620 ( -0.635 -5.058 -0.447) 5.117 28.853 ( 0.510 3.086 -0.122) 3.131 ======================= Grid point 30 (23/300) ======================= q-point: (-0.27 0.18 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.081 ( -1.841 15.281 -1.375) 15.453 2.244 ( -1.218 9.782 0.594) 9.876 3.267 ( -2.329 1.507 0.599) 2.838 3.570 ( 5.826 9.033 2.328) 10.998 3.714 ( -5.960 -0.291 -2.359) 6.416 4.064 ( 6.316 -0.713 -2.253) 6.743 4.204 ( -4.139 17.985 2.723) 18.655 4.682 ( 1.679 -9.185 -1.954) 9.539 4.987 ( 1.786 11.401 3.223) 11.982 5.140 ( -2.925 -11.603 -0.029) 11.966 5.816 ( -1.942 -13.798 -1.966) 14.072 6.008 ( -1.309 0.497 -1.035) 1.742 6.237 ( 1.084 5.418 0.907) 5.599 6.484 ( 0.210 4.772 0.491) 4.802 7.188 ( 0.192 1.995 0.596) 2.091 7.894 ( 1.458 3.799 -1.271) 4.263 8.427 ( 6.432 -2.353 -2.281) 7.218 8.545 ( -9.358 4.122 3.713) 10.879 8.930 ( -0.876 -4.203 0.309) 4.305 9.310 ( 4.008 9.090 -0.721) 9.960 9.805 ( -1.581 -7.443 1.924) 7.848 9.911 ( 0.247 -1.645 -2.354) 2.882 10.910 ( -0.746 -4.174 0.584) 4.280 11.176 ( -1.597 3.773 -0.125) 4.099 11.679 ( 0.883 -18.121 -0.799) 18.160 11.775 ( 0.188 9.183 -0.229) 9.188 12.935 ( 3.461 0.640 1.418) 3.795 13.117 ( -1.930 -5.006 -1.062) 5.469 13.568 ( -0.819 2.254 0.458) 2.441 13.811 ( 2.450 -1.721 -0.049) 2.994 13.997 ( -3.099 8.248 -0.397) 8.819 14.788 ( 1.511 2.658 0.030) 3.058 15.070 ( -0.932 7.082 0.357) 7.152 15.783 ( 1.271 -15.204 -0.314) 15.260 17.587 ( -2.189 6.492 0.019) 6.851 19.469 ( 0.477 2.803 -0.335) 2.863 20.893 ( 1.084 -1.579 -0.501) 1.980 21.136 ( -0.213 -1.712 1.824) 2.511 21.821 ( 1.347 1.753 -0.020) 2.211 24.534 ( -1.091 -2.698 -0.327) 2.928 28.715 ( 1.625 -4.434 -0.772) 4.785 28.776 ( -1.601 4.093 1.021) 4.512 ======================= Grid point 31 (24/300) ======================= q-point: (-0.18 0.18 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.740 ( 0.000 19.988 0.000) 19.988 2.030 ( 0.000 12.520 0.000) 12.520 3.080 ( 0.000 18.102 0.000) 18.102 3.322 ( 0.000 18.025 0.000) 18.025 3.588 ( 0.000 12.770 0.000) 12.770 3.841 ( 0.000 18.131 0.000) 18.131 4.130 ( -0.000 -3.153 -0.000) 3.153 4.718 ( 0.000 3.462 0.000) 3.462 4.970 ( -0.000 -7.133 -0.000) 7.133 5.328 ( -0.000 -9.616 -0.000) 9.616 5.940 ( -0.000 -2.018 -0.000) 2.018 6.160 ( 0.000 2.402 0.000) 2.402 6.163 ( -0.000 -14.432 -0.000) 14.432 6.417 ( 0.000 1.826 0.000) 1.826 7.140 ( 0.000 3.655 0.000) 3.655 7.829 ( 0.000 4.278 0.000) 4.278 8.135 ( 0.000 18.966 0.000) 18.966 8.729 ( -0.000 -12.293 -0.000) 12.293 8.995 ( -0.000 -3.482 -0.000) 3.482 9.172 ( 0.000 7.970 0.000) 7.970 9.923 ( 0.000 0.334 0.000) 0.334 9.981 ( -0.000 -10.645 -0.000) 10.645 11.028 ( -0.000 -6.346 -0.000) 6.346 11.127 ( 0.000 0.414 0.000) 0.414 11.638 ( 0.000 2.070 0.000) 2.070 12.022 ( -0.000 -16.287 -0.000) 16.287 12.947 ( -0.000 -0.633 -0.000) 0.633 13.213 ( -0.000 -5.428 -0.000) 5.428 13.509 ( 0.000 3.666 0.000) 3.666 13.806 ( 0.000 9.661 0.000) 9.661 13.851 ( -0.000 -1.178 -0.000) 1.178 14.723 ( 0.000 4.934 0.000) 4.934 14.888 ( 0.000 11.135 0.000) 11.135 16.134 ( -0.000 -21.304 -0.000) 21.304 17.410 ( 0.000 10.695 0.000) 10.695 19.452 ( -0.000 -0.419 -0.000) 0.419 20.924 ( -0.000 -1.260 -0.000) 1.260 21.187 ( -0.000 -3.557 -0.000) 3.557 21.744 ( 0.000 6.961 0.000) 6.961 24.582 ( -0.000 -2.197 -0.000) 2.197 28.657 ( 0.000 6.309 0.000) 6.309 28.838 ( -0.000 -6.523 -0.000) 6.523 ======================= Grid point 36 (25/300) ======================= q-point: ( 0.27 0.27 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.881 ( 18.405 0.000 -8.244) 20.167 0.974 ( 15.072 0.000 8.864) 17.486 2.040 ( 30.100 0.000 -11.634) 32.270 2.681 ( 1.443 0.000 5.993) 6.164 2.752 ( 18.284 0.000 14.342) 23.238 3.055 ( 8.218 0.000 -9.483) 12.549 4.260 ( -0.028 -0.000 -3.886) 3.886 4.513 ( -1.442 -0.000 0.345) 1.483 5.198 ( -2.843 -0.000 -0.198) 2.850 5.675 ( -2.872 -0.000 -4.140) 5.039 6.122 ( -7.790 -0.000 -0.153) 7.792 6.138 ( -10.014 -0.000 11.239) 15.053 6.412 ( 1.326 0.000 -16.235) 16.289 6.670 ( -0.972 -0.000 -0.274) 1.010 7.009 ( -1.993 -0.000 2.710) 3.364 7.773 ( -6.642 -0.000 1.189) 6.748 7.816 ( -2.793 -0.000 5.832) 6.466 7.904 ( 12.291 0.000 -27.876) 30.465 8.301 ( -11.353 -0.000 -2.280) 11.580 9.078 ( -2.181 -0.000 5.430) 5.852 10.061 ( 24.156 0.000 -3.704) 24.439 10.927 ( 0.063 0.000 9.258) 9.258 11.183 ( -8.097 -0.000 4.245) 9.143 11.607 ( 5.831 0.000 14.956) 16.052 12.062 ( -2.656 -0.000 -2.814) 3.869 12.335 ( -4.310 -0.000 -0.260) 4.318 12.969 ( 1.708 0.000 -0.677) 1.837 13.100 ( 2.460 0.000 -9.080) 9.407 13.499 ( 5.735 0.000 5.590) 8.009 13.595 ( -4.897 -0.000 -0.355) 4.910 13.660 ( -10.081 -0.000 5.895) 11.678 14.224 ( 5.721 0.000 2.869) 6.400 14.447 ( -10.714 -0.000 1.117) 10.772 17.065 ( 3.258 0.000 1.050) 3.423 17.399 ( -5.751 -0.000 -3.783) 6.884 19.571 ( 5.813 0.000 -0.183) 5.816 20.161 ( 26.049 0.000 -96.907) 100.347 21.168 ( -5.172 -0.000 10.254) 11.484 21.656 ( -6.372 -0.000 32.452) 33.072 27.096 ( 0.497 0.000 -6.092) 6.112 27.479 ( 8.591 0.000 1.157) 8.668 28.221 ( -6.057 -0.000 -4.364) 7.465 ======================= Grid point 37 (26/300) ======================= q-point: ( 0.36 0.27 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.156 ( 16.542 -18.440 -10.050) 26.733 1.370 ( 7.871 -24.114 9.567) 27.110 2.301 ( 15.815 -11.897 -6.355) 20.786 2.654 ( 7.923 3.426 6.802) 10.990 3.075 ( 19.469 -12.752 9.218) 25.033 3.129 ( 7.097 -3.673 -8.050) 11.343 4.253 ( -1.589 -0.700 -4.512) 4.835 4.450 ( -3.339 4.511 -0.927) 5.688 5.168 ( -2.145 1.116 -1.305) 2.748 5.639 ( -1.510 0.956 -1.686) 2.457 5.927 ( -14.577 5.949 -1.348) 15.802 6.164 ( -1.915 -0.656 9.577) 9.788 6.571 ( 1.258 -12.072 -10.248) 15.885 6.647 ( -0.805 0.905 0.449) 1.291 7.071 ( -2.184 -7.294 0.817) 7.658 7.670 ( 15.211 8.105 -3.671) 17.622 7.724 ( -8.374 -1.744 3.535) 9.255 8.217 ( -7.311 -16.780 -5.108) 19.003 8.296 ( -10.348 -11.950 -9.793) 18.595 9.074 ( -1.461 -0.452 4.392) 4.651 10.114 ( 22.074 10.536 -4.351) 24.844 10.935 ( -2.600 13.179 8.757) 16.035 10.979 ( -2.299 1.252 2.657) 3.731 11.605 ( 1.599 5.931 7.192) 9.458 12.124 ( -3.177 -6.111 1.904) 7.146 12.242 ( -1.426 6.967 -1.445) 7.257 12.947 ( 3.786 3.472 -0.416) 5.153 13.183 ( 1.214 -5.859 -5.871) 8.382 13.462 ( -8.195 5.388 -1.189) 9.879 13.570 ( 3.653 -3.197 6.009) 7.725 13.702 ( -4.478 -6.874 0.878) 8.251 14.323 ( 4.523 -5.663 2.309) 7.606 14.422 ( -9.300 -4.869 2.538) 10.800 16.861 ( 1.670 21.513 -2.497) 21.721 17.414 ( -7.074 -4.738 1.611) 8.665 19.380 ( 20.299 12.553 -15.911) 28.684 20.483 ( 4.160 -20.379 -47.416) 51.777 21.150 ( -2.686 -0.197 3.056) 4.073 21.666 ( -4.588 -0.062 23.204) 23.653 26.352 ( 14.386 46.962 1.834) 49.150 28.108 ( -6.323 -23.139 -1.849) 24.059 28.256 ( -3.755 -15.195 -6.121) 16.806 ======================= Grid point 38 (27/300) ======================= q-point: ( 0.45 0.27 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.669 ( 14.206 -24.107 -8.285) 29.182 1.893 ( 2.766 -24.828 9.041) 26.567 2.622 ( 3.882 -9.095 -4.648) 10.927 2.743 ( 12.216 -9.655 9.029) 18.000 3.226 ( -0.529 -6.529 -9.568) 11.595 3.509 ( 19.124 -15.430 9.230) 26.249 4.206 ( -3.747 4.503 -0.704) 5.900 4.367 ( -2.982 -1.110 -7.418) 8.072 5.121 ( -1.748 2.437 -0.599) 3.058 5.587 ( -4.912 3.866 -2.142) 6.607 5.752 ( -8.985 2.136 1.787) 9.407 6.156 ( 1.447 1.922 3.839) 4.530 6.579 ( -1.258 3.160 -0.321) 3.416 6.758 ( 2.836 -3.829 -2.635) 5.445 7.216 ( -4.185 -9.769 0.132) 10.629 7.659 ( 15.535 5.085 -7.364) 17.928 7.769 ( -0.642 -4.581 5.855) 7.462 8.358 ( -10.841 -11.742 4.831) 16.695 8.593 ( -12.212 -22.532 -8.460) 26.989 9.124 ( 0.218 -6.787 -1.599) 6.976 10.001 ( 16.439 14.367 -4.433) 22.278 10.612 ( -3.175 15.900 5.095) 16.995 10.994 ( -0.367 1.337 4.094) 4.322 11.442 ( -3.663 10.761 3.407) 11.867 11.990 ( 2.768 15.707 -2.347) 16.120 12.267 ( -0.106 -5.037 3.429) 6.094 12.906 ( 4.235 3.693 1.972) 5.955 13.266 ( -2.180 -3.955 -4.500) 6.375 13.318 ( -6.992 2.497 -3.878) 8.376 13.651 ( 3.238 -1.332 2.280) 4.178 13.873 ( -1.041 -12.700 1.594) 12.842 14.477 ( 2.222 -7.638 -4.930) 9.359 14.518 ( -5.985 -10.308 10.774) 16.067 16.368 ( -2.318 27.824 -2.679) 28.049 17.471 ( -5.087 -5.568 3.319) 8.239 19.428 ( 23.214 -1.270 -13.854) 27.063 20.684 ( -7.814 -9.250 -12.240) 17.218 21.154 ( 1.427 -1.122 -9.963) 10.127 21.676 ( -3.595 -0.753 14.068) 14.539 25.660 ( 11.080 38.185 3.282) 39.895 28.264 ( -4.187 -8.419 -1.610) 9.540 28.611 ( -3.382 -16.910 -4.461) 17.813 ======================= Grid point 39 (28/300) ======================= q-point: ( 0.55 0.27 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.133 ( 10.487 -14.651 -3.073) 18.277 2.370 ( -0.072 -24.754 6.589) 25.615 2.695 ( 9.366 2.189 -3.857) 10.363 3.124 ( -1.006 -18.442 9.441) 20.742 3.333 ( -5.352 -10.256 -9.314) 14.852 3.925 ( 13.529 -14.591 6.358) 20.889 4.094 ( 0.419 4.374 1.160) 4.544 4.415 ( -3.358 -7.705 -8.999) 12.313 5.029 ( -1.637 6.943 1.248) 7.241 5.447 ( -9.596 2.384 -3.575) 10.514 5.681 ( -1.590 4.779 3.977) 6.417 6.150 ( 3.846 0.930 -0.905) 4.059 6.505 ( -0.970 3.630 0.082) 3.758 6.766 ( 2.322 3.749 0.661) 4.459 7.353 ( -0.931 -5.124 -0.909) 5.287 7.655 ( 5.013 0.091 -2.094) 5.434 7.883 ( 3.330 -5.315 0.187) 6.275 8.523 ( -8.024 -11.619 3.967) 14.667 8.812 ( -4.080 -6.824 1.586) 8.107 9.380 ( 0.267 -19.740 -8.381) 21.448 9.835 ( 8.418 11.274 -1.671) 14.169 10.318 ( -2.418 15.319 4.500) 16.148 10.933 ( -1.740 3.142 1.241) 3.800 11.210 ( -4.059 10.614 2.294) 11.593 11.701 ( 1.600 15.299 -1.783) 15.485 12.306 ( 2.247 2.914 1.983) 4.180 12.891 ( 4.946 1.772 4.560) 6.957 13.179 ( -6.347 3.158 -8.144) 10.798 13.394 ( -0.678 -8.458 -1.603) 8.635 13.682 ( 1.724 -0.091 1.212) 2.109 14.088 ( 0.242 -8.483 2.277) 8.787 14.644 ( 5.001 -8.417 -7.448) 12.302 14.725 ( -5.587 -13.727 12.243) 19.224 15.869 ( -4.529 20.856 -2.199) 21.455 17.552 ( -2.311 -5.030 1.949) 5.869 19.597 ( 14.863 -2.136 -8.812) 17.411 20.747 ( -5.620 -5.140 0.635) 7.643 21.161 ( 1.728 0.129 -9.181) 9.343 21.697 ( -2.299 -2.085 6.517) 7.219 25.088 ( 3.332 28.541 2.199) 28.818 28.396 ( -1.605 -7.673 -0.802) 7.880 28.808 ( -1.250 -7.340 -2.283) 7.788 ======================= Grid point 40 (29/300) ======================= q-point: ( 0.64 0.27 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.327 ( 2.065 -2.597 -0.045) 3.318 2.626 ( 6.759 8.979 1.651) 11.359 2.848 ( -1.149 -22.076 -1.542) 22.160 3.341 ( -6.096 -10.543 1.568) 12.280 3.561 ( -0.531 -13.180 -0.162) 13.191 4.066 ( 3.144 0.825 -0.134) 3.253 4.251 ( 6.453 -12.244 0.756) 13.861 4.583 ( -1.564 -12.138 -2.717) 12.536 4.840 ( -1.704 11.127 1.392) 11.343 5.403 ( -5.875 -4.646 -2.530) 7.906 5.526 ( -0.347 11.608 2.005) 11.785 6.142 ( 1.708 2.934 -0.301) 3.408 6.435 ( 0.956 3.862 -1.111) 4.131 6.688 ( 0.876 5.457 1.601) 5.754 7.331 ( 1.913 5.656 -1.610) 6.184 7.814 ( -0.726 -14.503 1.353) 14.584 7.979 ( 0.866 -2.644 -0.727) 2.876 8.685 ( -3.261 -9.355 1.803) 10.070 8.835 ( -0.303 1.951 0.040) 1.975 9.661 ( 11.674 -1.345 -10.578) 15.811 9.750 ( -4.885 -3.996 6.164) 8.822 9.986 ( -4.336 17.813 3.058) 18.586 10.963 ( 2.478 -5.120 -2.878) 6.374 11.022 ( -6.067 2.686 3.529) 7.515 11.458 ( 0.538 11.295 -0.764) 11.333 12.199 ( 1.112 9.445 0.443) 9.521 12.929 ( 5.465 -0.842 5.568) 7.847 13.071 ( -5.240 2.517 -6.855) 8.988 13.546 ( 0.375 -6.424 -0.778) 6.482 13.697 ( 0.407 -1.276 0.497) 1.429 14.174 ( -0.313 -0.528 1.175) 1.326 14.791 ( 3.625 -4.008 -2.363) 5.898 14.974 ( -1.848 -12.545 5.398) 13.781 15.568 ( -3.229 7.061 -1.783) 7.966 17.619 ( -1.056 -3.051 0.381) 3.251 19.643 ( 4.346 3.279 -2.758) 6.103 20.812 ( -0.326 -3.618 -0.092) 3.634 21.144 ( 0.620 1.275 -2.682) 3.033 21.750 ( -0.309 -3.704 2.316) 4.379 24.684 ( -0.572 15.294 0.678) 15.319 28.514 ( -0.549 -5.889 -0.305) 5.923 28.878 ( 0.065 -1.142 -0.607) 1.295 ======================= Grid point 41 (30/300) ======================= q-point: (-0.27 0.27 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.293 ( 0.000 6.801 0.000) 6.801 2.438 ( 0.000 11.670 0.000) 11.670 3.166 ( -0.000 -11.337 -0.000) 11.337 3.534 ( -0.000 -11.487 -0.000) 11.487 3.695 ( -0.000 -0.811 -0.000) 0.811 4.078 ( -0.000 -0.256 -0.000) 0.256 4.492 ( -0.000 -11.334 -0.000) 11.334 4.522 ( 0.000 15.879 0.000) 15.879 4.883 ( -0.000 -13.681 -0.000) 13.681 5.268 ( 0.000 15.392 0.000) 15.392 5.539 ( -0.000 -12.234 -0.000) 12.234 6.067 ( 0.000 4.729 0.000) 4.729 6.354 ( 0.000 5.511 0.000) 5.511 6.588 ( 0.000 5.705 0.000) 5.705 7.240 ( 0.000 3.884 0.000) 3.884 7.970 ( 0.000 2.804 0.000) 2.804 8.135 ( -0.000 -18.124 -0.000) 18.124 8.744 ( 0.000 8.154 0.000) 8.154 8.826 ( -0.000 -6.678 -0.000) 6.678 9.572 ( 0.000 16.995 0.000) 16.995 9.702 ( -0.000 -2.231 -0.000) 2.231 9.874 ( -0.000 -2.758 -0.000) 2.758 10.889 ( 0.000 2.754 0.000) 2.754 11.276 ( -0.000 -0.173 -0.000) 0.173 11.296 ( -0.000 -12.827 -0.000) 12.827 11.997 ( 0.000 12.073 0.000) 12.073 12.984 ( 0.000 2.511 0.000) 2.511 13.016 ( -0.000 -4.097 -0.000) 4.097 13.594 ( 0.000 0.422 0.000) 0.422 13.759 ( -0.000 -4.131 -0.000) 4.131 14.123 ( 0.000 5.441 0.000) 5.441 14.827 ( 0.000 0.701 0.000) 0.701 15.119 ( -0.000 -2.336 -0.000) 2.336 15.566 ( -0.000 -7.292 -0.000) 7.292 17.643 ( 0.000 0.472 0.000) 0.472 19.559 ( 0.000 5.920 0.000) 5.920 20.864 ( -0.000 -2.001 -0.000) 2.001 21.124 ( 0.000 0.419 0.000) 0.419 21.817 ( -0.000 -2.487 -0.000) 2.487 24.519 ( 0.000 2.842 0.000) 2.842 28.615 ( -0.000 -5.398 -0.000) 5.398 28.856 ( 0.000 3.185 0.000) 3.185 ======================= Grid point 48 (31/300) ======================= q-point: ( 0.36 0.36 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.077 ( 12.448 0.000 -5.949) 13.797 1.173 ( 9.175 0.000 6.034) 10.981 2.273 ( 9.574 0.000 -4.616) 10.629 2.735 ( 2.614 0.000 6.699) 7.190 3.136 ( 7.498 0.000 -9.570) 12.158 3.152 ( 28.896 0.000 8.973) 30.257 4.214 ( -4.837 -0.000 -3.855) 6.185 4.481 ( -2.983 -0.000 0.493) 3.023 5.168 ( -1.414 -0.000 0.098) 1.417 5.629 ( -1.477 -0.000 -4.113) 4.371 5.979 ( -14.198 -0.000 6.388) 15.569 6.022 ( -5.906 -0.000 -0.017) 5.906 6.437 ( 6.009 0.000 -7.829) 9.870 6.655 ( -0.930 -0.000 -0.057) 0.932 6.991 ( -1.496 -0.000 1.564) 2.164 7.648 ( -7.848 -0.000 1.843) 8.062 7.856 ( 2.103 0.000 3.449) 4.039 7.960 ( 5.839 0.000 -17.389) 18.343 8.150 ( -8.231 -0.000 0.481) 8.245 9.066 ( -1.856 -0.000 4.254) 4.641 10.377 ( 21.981 0.000 -4.132) 22.366 10.968 ( 1.902 0.000 4.587) 4.966 11.066 ( -10.478 -0.000 4.358) 11.349 11.704 ( 2.123 0.000 9.012) 9.259 11.957 ( -9.140 -0.000 -0.068) 9.140 12.329 ( 2.010 0.000 -1.766) 2.676 13.035 ( 7.645 0.000 -0.342) 7.653 13.127 ( 5.832 0.000 -8.016) 9.913 13.488 ( -8.380 -0.000 6.219) 10.436 13.523 ( -11.477 -0.000 3.379) 11.964 13.618 ( 6.657 0.000 -1.161) 6.757 14.302 ( 3.963 0.000 1.682) 4.306 14.312 ( -8.510 -0.000 0.998) 8.568 17.109 ( 2.453 0.000 0.648) 2.537 17.313 ( -4.531 -0.000 -2.924) 5.393 19.642 ( 4.148 0.000 -0.115) 4.150 20.193 ( 15.006 0.000 -53.570) 55.632 21.133 ( -3.998 -0.000 7.839) 8.800 21.675 ( -2.936 -0.000 16.430) 16.691 27.084 ( 0.129 0.000 -3.650) 3.652 27.617 ( 9.847 0.000 2.051) 10.058 28.106 ( -7.913 -0.000 -4.496) 9.101 ======================= Grid point 49 (32/300) ======================= q-point: ( 0.45 0.36 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.323 ( 10.716 -18.355 -7.361) 22.493 1.472 ( 2.434 -21.523 7.161) 22.813 2.410 ( 4.053 -9.716 -1.924) 10.702 2.781 ( 5.514 -1.773 6.514) 8.716 3.163 ( 4.249 -0.045 -9.234) 10.165 3.446 ( 22.690 -8.442 7.710) 25.408 4.181 ( -6.260 -1.484 -4.048) 7.601 4.401 ( -2.933 5.498 -0.441) 6.247 5.141 ( -1.121 1.518 -0.819) 2.057 5.622 ( 0.235 0.899 -2.994) 3.135 5.734 ( -11.473 5.726 1.311) 12.889 6.162 ( -1.935 -4.671 5.951) 7.809 6.577 ( 3.427 -10.080 -6.924) 12.700 6.635 ( -1.345 -0.115 1.019) 1.691 7.040 ( -2.133 -5.851 0.396) 6.240 7.647 ( -3.310 -4.649 0.904) 5.779 7.847 ( 10.225 1.932 1.228) 10.478 8.112 ( -5.816 -13.064 -7.798) 16.288 8.139 ( -7.526 -6.087 -0.965) 9.727 9.069 ( -0.875 -1.102 2.600) 2.957 10.385 ( 17.621 12.886 -4.137) 22.219 10.851 ( -8.912 12.457 3.555) 15.724 11.012 ( 2.142 -0.900 3.647) 4.324 11.603 ( -3.237 8.836 3.010) 9.880 12.079 ( -2.849 -12.653 2.681) 13.244 12.253 ( 1.824 9.211 -1.657) 9.535 13.033 ( 8.069 4.884 0.339) 9.438 13.199 ( 3.055 -2.488 -3.866) 5.520 13.322 ( -10.263 4.976 -0.200) 11.407 13.610 ( -3.898 -10.349 4.990) 12.132 13.673 ( 3.089 -1.807 -1.998) 4.099 14.315 ( -5.901 -5.650 0.811) 8.210 14.382 ( 2.384 -5.474 2.032) 6.307 16.877 ( 1.459 23.921 -1.931) 24.043 17.332 ( -4.565 -4.833 0.718) 6.687 19.594 ( 14.157 4.392 -6.460) 16.169 20.376 ( -1.432 -13.744 -23.009) 26.840 21.128 ( -1.484 -0.824 1.649) 2.367 21.677 ( -1.990 0.389 10.248) 10.447 26.508 ( 7.172 42.023 0.790) 42.638 28.044 ( -2.530 -13.992 -0.334) 14.223 28.191 ( -2.656 -20.898 -3.955) 21.435 ======================= Grid point 50 (33/300) ======================= q-point: ( 0.55 0.36 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.809 ( 8.370 -25.822 -6.126) 27.828 1.914 ( -2.798 -22.521 6.411) 23.583 2.654 ( 1.647 -12.858 -1.377) 13.036 2.918 ( 7.417 -6.943 7.318) 12.521 3.160 ( -3.329 -1.431 -7.839) 8.636 3.773 ( 10.993 -11.493 5.731) 16.905 4.176 ( 0.705 -0.673 -0.015) 0.975 4.279 ( -5.691 2.099 -5.093) 7.920 5.102 ( -0.707 2.212 -0.168) 2.328 5.483 ( -5.301 7.102 -1.440) 8.979 5.705 ( -0.805 -1.492 1.197) 2.075 6.183 ( 0.831 0.744 1.586) 1.939 6.562 ( -0.664 3.489 -0.207) 3.558 6.782 ( 1.292 -4.677 -0.988) 4.952 7.166 ( -2.154 -9.341 0.061) 9.586 7.770 ( 3.110 -7.140 -3.984) 8.748 7.826 ( 4.537 7.495 3.217) 9.333 8.256 ( -4.707 -11.627 2.768) 12.845 8.435 ( -5.871 -25.443 -3.797) 26.386 9.124 ( 0.148 -5.952 -0.239) 5.958 10.171 ( 7.924 17.527 -2.358) 19.379 10.571 ( -3.205 13.023 2.238) 13.597 11.006 ( 0.324 3.486 1.695) 3.889 11.396 ( -2.573 10.795 0.932) 11.136 12.014 ( 1.139 16.141 -0.832) 16.203 12.282 ( 0.475 -7.399 1.355) 7.537 12.991 ( 5.250 4.508 2.830) 7.476 13.177 ( -5.953 2.774 -4.296) 7.848 13.262 ( -0.801 -4.043 -0.652) 4.173 13.696 ( 1.782 -0.157 0.516) 1.862 13.861 ( -0.820 -14.941 0.644) 14.977 14.439 ( -2.335 -10.686 -0.247) 10.941 14.529 ( 0.640 -8.209 2.483) 8.600 16.343 ( -0.470 30.224 -1.214) 30.252 17.422 ( -2.267 -6.820 1.014) 7.258 19.662 ( 11.792 -0.445 -5.159) 12.879 20.546 ( -5.952 -10.763 -3.264) 12.725 21.145 ( 0.470 -1.204 -3.299) 3.543 21.673 ( -1.223 -0.106 4.436) 4.603 25.774 ( 3.807 40.095 1.145) 40.292 28.216 ( -1.724 -10.027 -0.657) 10.196 28.570 ( -1.036 -16.942 -1.562) 17.045 ======================= Grid point 51 (34/300) ======================= q-point: ( 0.64 0.36 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.213 ( -0.000 -11.370 -0.000) 11.370 2.361 ( -0.000 -27.920 -0.000) 27.920 2.786 ( 0.000 2.181 0.000) 2.181 3.126 ( -0.000 -9.880 -0.000) 9.880 3.263 ( -0.000 -15.084 -0.000) 15.084 4.021 ( -0.000 -9.920 -0.000) 9.920 4.151 ( 0.000 1.995 0.000) 1.995 4.346 ( -0.000 -10.788 -0.000) 10.788 5.017 ( 0.000 7.256 0.000) 7.256 5.363 ( 0.000 2.621 0.000) 2.621 5.681 ( 0.000 4.664 0.000) 4.664 6.179 ( 0.000 0.556 0.000) 0.556 6.496 ( 0.000 3.138 0.000) 3.138 6.783 ( 0.000 3.639 0.000) 3.639 7.342 ( -0.000 -7.811 -0.000) 7.811 7.691 ( 0.000 4.403 0.000) 4.403 7.911 ( -0.000 -5.613 -0.000) 5.613 8.469 ( -0.000 -12.099 -0.000) 12.099 8.783 ( -0.000 -9.755 -0.000) 9.755 9.366 ( -0.000 -20.204 -0.000) 20.204 9.900 ( 0.000 13.005 0.000) 13.005 10.303 ( 0.000 15.664 0.000) 15.664 10.922 ( 0.000 3.527 0.000) 3.527 11.184 ( 0.000 10.868 0.000) 10.868 11.710 ( 0.000 15.503 0.000) 15.503 12.327 ( 0.000 2.925 0.000) 2.925 12.958 ( 0.000 1.399 0.000) 1.399 13.096 ( 0.000 2.958 0.000) 2.958 13.386 ( -0.000 -8.970 -0.000) 8.970 13.699 ( 0.000 0.411 0.000) 0.411 14.092 ( -0.000 -8.643 -0.000) 8.643 14.685 ( -0.000 -15.996 -0.000) 15.996 14.687 ( -0.000 -7.808 -0.000) 7.808 15.833 ( 0.000 22.184 0.000) 22.184 17.536 ( -0.000 -5.582 -0.000) 5.582 19.698 ( 0.000 0.847 0.000) 0.847 20.702 ( -0.000 -7.897 -0.000) 7.897 21.157 ( -0.000 -0.009 -0.000) 0.009 21.691 ( -0.000 -2.182 -0.000) 2.182 25.115 ( 0.000 30.511 0.000) 30.511 28.383 ( -0.000 -8.096 -0.000) 8.096 28.794 ( -0.000 -8.008 -0.000) 8.008 ======================= Grid point 61 (35/300) ======================= q-point: ( 0.45 0.45 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.185 ( 4.452 0.000 -2.195) 4.964 1.273 ( 3.023 0.000 2.146) 3.707 2.340 ( 2.167 0.000 -0.849) 2.328 2.784 ( 1.310 0.000 3.102) 3.367 3.190 ( 3.220 0.000 -4.266) 5.345 3.528 ( 17.113 0.000 3.904) 17.552 4.106 ( -6.946 -0.000 -2.596) 7.416 4.446 ( -1.687 -0.000 0.285) 1.711 5.156 ( -0.405 -0.000 0.024) 0.405 5.607 ( -0.069 -0.000 -2.153) 2.154 5.837 ( -6.512 -0.000 2.484) 6.970 5.963 ( -2.163 -0.000 0.018) 2.163 6.488 ( 2.833 0.000 -2.171) 3.569 6.645 ( -0.390 -0.000 0.009) 0.391 6.980 ( -0.549 -0.000 0.468) 0.721 7.577 ( -2.700 -0.000 0.724) 2.795 7.885 ( 0.757 0.000 1.260) 1.470 7.942 ( -1.084 -0.000 -5.141) 5.254 8.097 ( -0.501 -0.000 -0.427) 0.658 9.057 ( -0.740 -0.000 1.617) 1.779 10.638 ( 15.481 0.000 -3.737) 15.926 10.921 ( -11.081 -0.000 3.806) 11.717 11.002 ( 1.034 0.000 1.414) 1.752 11.738 ( 0.201 0.000 2.974) 2.980 11.854 ( -4.234 -0.000 0.099) 4.235 12.347 ( 0.812 0.000 -0.711) 1.079 13.168 ( 10.079 0.000 -0.270) 10.083 13.199 ( 6.124 0.000 -4.860) 7.819 13.366 ( -10.938 -0.000 1.339) 11.020 13.389 ( -6.731 -0.000 3.830) 7.744 13.689 ( 2.965 0.000 -0.097) 2.967 14.226 ( -3.533 -0.000 0.418) 3.557 14.345 ( 1.407 0.000 0.561) 1.515 17.135 ( 0.911 0.000 0.210) 0.935 17.260 ( -1.724 -0.000 -1.099) 2.045 19.683 ( 1.488 0.000 -0.038) 1.489 20.213 ( 4.994 0.000 -17.401) 18.104 21.112 ( -1.520 -0.000 2.967) 3.334 21.685 ( -0.857 -0.000 5.069) 5.141 27.076 ( 0.015 0.000 -1.231) 1.231 27.759 ( 7.977 0.000 2.317) 8.307 27.977 ( -7.257 -0.000 -3.228) 7.942 ======================= Grid point 62 (36/300) ======================= q-point: ( 0.55 0.45 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.390 ( -0.000 -18.989 -0.000) 18.989 1.498 ( -0.000 -19.976 -0.000) 19.976 2.433 ( -0.000 -9.087 -0.000) 9.087 2.834 ( -0.000 -4.560 -0.000) 4.560 3.177 ( 0.000 2.149 0.000) 2.149 3.658 ( -0.000 -6.333 -0.000) 6.333 4.101 ( -0.000 -2.793 -0.000) 2.793 4.377 ( 0.000 6.096 0.000) 6.096 5.131 ( 0.000 1.745 0.000) 1.745 5.623 ( 0.000 10.140 0.000) 10.140 5.645 ( -0.000 -3.566 -0.000) 3.566 6.158 ( -0.000 -6.653 -0.000) 6.653 6.600 ( -0.000 -11.754 -0.000) 11.754 6.620 ( 0.000 2.491 0.000) 2.491 7.024 ( -0.000 -4.893 -0.000) 4.893 7.627 ( -0.000 -6.313 -0.000) 6.313 7.958 ( 0.000 0.681 0.000) 0.681 8.012 ( -0.000 -13.872 -0.000) 13.872 8.090 ( -0.000 -2.575 -0.000) 2.575 9.068 ( -0.000 -1.387 -0.000) 1.387 10.533 ( 0.000 15.834 0.000) 15.834 10.766 ( 0.000 9.344 0.000) 9.344 11.036 ( -0.000 -0.907 -0.000) 0.907 11.577 ( 0.000 9.810 0.000) 9.810 12.065 ( -0.000 -14.438 -0.000) 14.438 12.264 ( 0.000 9.232 0.000) 9.232 13.146 ( 0.000 8.874 0.000) 8.874 13.192 ( 0.000 2.072 0.000) 2.072 13.225 ( -0.000 -0.470 -0.000) 0.470 13.577 ( -0.000 -13.916 -0.000) 13.916 13.701 ( -0.000 -0.122 -0.000) 0.122 14.272 ( -0.000 -6.022 -0.000) 6.022 14.403 ( -0.000 -5.388 -0.000) 5.388 16.885 ( 0.000 24.721 0.000) 24.721 17.299 ( -0.000 -4.790 -0.000) 4.790 19.693 ( -0.000 -0.452 -0.000) 0.452 20.317 ( -0.000 -9.620 -0.000) 9.620 21.120 ( -0.000 -1.090 -0.000) 1.090 21.680 ( 0.000 0.584 0.000) 0.584 26.561 ( 0.000 40.230 0.000) 40.230 28.027 ( -0.000 -8.216 -0.000) 8.216 28.164 ( -0.000 -25.273 -0.000) 25.273 ======================= Grid point 125 (37/300) ======================= q-point: ( 0.00 0.00 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.478 ( -13.024 -0.000 24.751) 27.968 0.768 ( -0.440 -0.000 36.218) 36.221 1.031 ( -21.700 -0.000 49.045) 53.631 2.692 ( -2.686 -0.000 1.186) 2.936 2.709 ( 2.262 0.000 20.592) 20.716 3.001 ( -3.066 -0.000 10.207) 10.657 4.251 ( -4.761 -0.000 2.690) 5.468 4.522 ( -0.546 -0.000 2.405) 2.466 5.274 ( 0.694 0.000 -4.216) 4.273 5.881 ( -3.379 -0.000 2.088) 3.972 6.209 ( 2.931 0.000 -11.689) 12.051 6.466 ( 5.449 0.000 0.552) 5.477 6.627 ( 1.016 0.000 -6.657) 6.735 6.735 ( -3.135 -0.000 3.537) 4.726 7.110 ( 1.620 0.000 5.784) 6.007 7.726 ( -79.219 -0.000 1.242) 79.228 7.763 ( 1.027 0.000 7.134) 7.207 8.264 ( 6.189 0.000 -1.853) 6.460 8.713 ( -12.446 -0.000 -6.849) 14.207 9.205 ( -2.655 -0.000 -9.318) 9.689 9.405 ( -11.159 -0.000 23.393) 25.918 11.124 ( 2.129 0.000 -2.518) 3.298 11.290 ( 4.651 0.000 -2.368) 5.219 11.922 ( 74.742 0.000 1.741) 74.763 11.952 ( -5.431 -0.000 -2.354) 5.919 12.612 ( 4.983 0.000 -6.840) 8.462 13.016 ( -6.497 -0.000 -4.021) 7.640 13.046 ( -2.710 -0.000 -1.262) 2.989 13.322 ( 0.750 0.000 0.802) 1.098 13.522 ( 40.592 0.000 -7.843) 41.343 13.759 ( 0.609 0.000 4.427) 4.469 14.067 ( 3.121 0.000 5.887) 6.664 14.786 ( -0.101 -0.000 2.151) 2.153 15.917 (-125.145 -0.000 -4.803) 125.238 17.039 ( -0.450 -0.000 7.347) 7.361 17.656 ( -8.675 -0.000 6.122) 10.617 19.422 ( -0.762 -0.000 2.854) 2.954 21.111 ( 8.828 0.000 -12.046) 14.934 24.616 ( -40.942 -0.000 19.729) 45.447 27.239 ( 1.343 0.000 -3.563) 3.807 27.420 ( -26.308 -0.000 -0.335) 26.310 28.363 ( -2.684 -0.000 -1.276) 2.972 ======================= Grid point 126 (38/300) ======================= q-point: ( 0.09 0.00 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.709 ( 7.635 -10.295 23.778) 27.012 0.731 ( 0.001 -18.943 15.052) 24.195 1.538 ( 0.239 -33.659 33.084) 47.196 2.649 ( -5.325 -0.028 6.777) 8.619 2.855 ( 2.622 -8.380 10.062) 13.354 3.126 ( -2.778 -11.706 14.446) 18.800 4.208 ( -4.688 0.284 0.755) 4.757 4.560 ( -2.442 -2.356 -1.406) 3.672 5.199 ( -0.781 5.417 -6.077) 8.178 5.815 ( -2.623 4.121 0.670) 4.930 6.184 ( 2.361 2.497 -8.762) 9.412 6.344 ( -24.979 5.467 11.465) 28.023 6.600 ( 3.775 2.404 -5.485) 7.079 6.627 ( 13.209 12.218 8.234) 19.788 6.938 ( -10.055 1.391 16.296) 19.199 7.194 ( -2.153 -5.194 8.795) 10.439 8.191 ( -1.481 7.110 -1.162) 7.355 8.445 ( -11.673 -31.753 -17.333) 38.012 8.764 ( -9.884 -12.904 -5.631) 17.201 9.162 ( 6.537 4.975 -9.873) 12.843 9.399 ( -7.297 -1.563 22.216) 23.436 11.081 ( 0.149 11.779 3.473) 12.282 11.197 ( 3.508 20.399 15.149) 25.650 11.319 ( 12.228 7.346 1.880) 14.388 12.219 ( -2.565 5.178 -1.211) 5.904 12.562 ( -1.697 5.778 -5.946) 8.463 13.006 ( -4.390 1.098 -1.752) 4.852 13.144 ( -1.728 -7.744 -10.066) 12.818 13.348 ( -0.246 -1.398 -0.178) 1.430 13.597 ( 15.772 4.903 -1.104) 16.554 14.005 ( 4.502 9.969 3.695) 11.545 14.186 ( 25.045 -12.295 -12.886) 30.732 14.533 ( -15.276 0.941 10.507) 18.564 16.667 ( 5.901 -51.718 -67.853) 85.520 17.062 ( -2.184 -1.108 7.291) 7.691 17.840 ( -21.003 -38.156 -10.385) 44.775 19.461 ( 5.020 -3.220 1.004) 6.048 21.137 ( 8.625 1.791 -10.833) 13.962 24.062 ( -71.749 23.845 59.560) 96.250 25.548 ( 28.108 61.766 51.624) 85.266 28.303 ( -2.110 -7.982 -11.510) 14.165 28.508 ( -12.989 -26.292 -21.801) 36.542 ======================= Grid point 127 (39/300) ======================= q-point: ( 0.18 0.00 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.092 ( 4.864 -23.112 6.759) 24.567 1.294 ( 18.243 -25.392 2.225) 31.345 2.167 ( 8.602 -22.733 9.638) 26.147 2.717 ( -8.916 -13.763 13.598) 21.304 3.069 ( 2.880 -11.080 1.208) 11.511 3.408 ( -1.575 -16.191 18.587) 24.700 4.183 ( -0.908 0.497 -2.016) 2.266 4.541 ( -6.409 0.067 -1.546) 6.593 5.086 ( 0.950 5.268 -9.927) 11.279 5.716 ( -1.405 4.844 2.929) 5.832 6.105 ( 0.834 5.343 -8.686) 10.232 6.207 ( -8.157 0.902 9.444) 12.512 6.523 ( 7.231 8.659 5.837) 12.702 6.578 ( 3.946 2.770 -2.772) 5.561 6.978 ( 1.459 -3.363 4.975) 6.180 7.360 ( -1.621 -12.502 6.581) 14.221 8.046 ( -3.056 5.565 -0.657) 6.383 8.767 ( -4.436 -13.567 -4.273) 14.900 8.969 ( -11.627 -13.661 -12.570) 21.905 9.086 ( 10.109 5.701 -4.059) 12.295 9.451 ( -3.855 -6.191 13.526) 15.367 10.724 ( 1.060 19.610 12.885) 23.488 11.136 ( -1.188 -0.299 4.333) 4.503 11.305 ( 10.126 4.562 0.468) 11.116 12.008 ( -4.621 13.691 0.929) 14.480 12.395 ( -2.794 8.231 -6.318) 10.746 12.945 ( -4.733 1.509 -0.890) 5.047 13.241 ( 1.942 -4.674 -7.091) 8.712 13.346 ( -1.358 1.195 -2.227) 2.869 13.672 ( 11.646 -1.794 -0.209) 11.786 13.869 ( -4.379 2.766 2.527) 5.763 14.470 ( 10.249 -8.389 -5.137) 14.206 14.545 ( -2.443 -4.815 3.445) 6.405 16.753 ( -5.874 14.154 -17.302) 23.113 17.174 ( 18.463 -1.108 -7.311) 19.889 18.541 ( -23.492 -45.250 -46.313) 68.879 19.629 ( 16.507 -6.535 -12.770) 21.869 21.134 ( 7.527 2.548 -9.872) 12.673 23.313 ( -43.155 20.446 75.072) 88.973 25.162 ( 17.795 17.888 30.777) 39.798 28.359 ( -1.339 -3.965 -6.881) 8.054 28.703 ( -5.857 -7.723 -19.475) 21.754 ======================= Grid point 128 (40/300) ======================= q-point: ( 0.27 0.00 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.578 ( 8.192 -21.902 3.077) 23.586 1.854 ( 18.925 -18.025 1.910) 26.205 2.522 ( 6.289 -14.817 -14.458) 21.637 3.089 ( -3.750 -22.748 18.979) 29.862 3.302 ( 1.805 -12.483 -6.458) 14.170 3.727 ( -1.617 -14.579 15.058) 21.021 4.152 ( 1.315 3.318 -2.579) 4.403 4.509 ( -5.831 -3.585 -0.452) 6.860 4.966 ( 1.762 7.076 -11.004) 13.201 5.629 ( 0.073 5.264 6.253) 8.174 5.992 ( -1.757 4.573 -7.726) 9.148 6.140 ( -5.582 2.553 9.101) 10.977 6.436 ( 2.281 5.232 -0.939) 5.784 6.541 ( 8.038 5.061 3.386) 10.084 7.062 ( 2.939 -3.101 0.718) 4.332 7.650 ( -0.598 -17.555 3.493) 17.909 7.958 ( -3.864 0.664 0.711) 3.984 8.891 ( 7.519 8.483 -9.121) 14.550 8.951 ( -4.438 -7.061 1.080) 8.410 9.160 ( -5.354 -5.028 6.821) 10.024 9.651 ( 0.314 -13.910 0.150) 13.915 10.414 ( -0.250 15.916 9.928) 18.760 11.114 ( -3.822 3.057 4.659) 6.757 11.288 ( 8.356 4.489 0.195) 9.488 11.706 ( -6.293 12.098 0.947) 13.669 12.209 ( 0.695 9.846 -5.897) 11.498 12.888 ( -3.881 1.150 0.493) 4.078 13.258 ( -0.702 4.282 -4.716) 6.408 13.349 ( -0.293 -5.753 -5.706) 8.108 13.748 ( 1.243 -0.481 3.795) 4.022 13.916 ( 5.489 -6.276 0.122) 8.339 14.603 ( -2.740 -4.729 1.337) 5.626 14.698 ( 8.946 -7.712 -5.378) 12.979 16.335 ( -8.730 20.113 -7.798) 23.271 17.315 ( 14.759 -3.144 -5.972) 16.229 18.974 ( -15.954 -26.185 -34.880) 46.442 19.812 ( 17.654 -2.230 -28.843) 33.890 21.126 ( 6.552 1.708 -9.004) 11.266 22.919 ( -27.526 9.890 66.260) 72.428 25.049 ( 6.196 10.011 25.791) 28.351 28.422 ( -1.535 -5.143 -8.275) 9.863 28.719 ( 0.647 -0.390 -15.990) 16.007 ======================= Grid point 129 (41/300) ======================= q-point: ( 0.36 0.00 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.002 ( 8.124 -16.002 2.217) 18.083 2.191 ( 12.389 -5.795 2.531) 13.910 2.869 ( 4.981 -20.624 -16.728) 27.019 3.387 ( 2.631 -5.310 5.104) 7.821 3.574 ( -0.087 -17.756 -10.537) 20.648 3.943 ( -3.579 -7.485 5.677) 10.053 4.051 ( -0.210 5.755 -1.413) 5.930 4.648 ( 1.849 -11.207 2.623) 11.658 4.803 ( -0.050 8.573 -8.364) 11.977 5.514 ( -0.422 8.741 7.926) 11.807 5.892 ( -4.428 2.209 -3.913) 6.308 6.114 ( -2.019 -1.990 4.770) 5.549 6.324 ( -0.382 7.525 1.209) 7.632 6.540 ( 7.481 2.001 5.215) 9.337 7.135 ( 1.572 -2.900 1.135) 3.488 7.872 ( 0.266 -2.002 0.848) 2.191 8.076 ( -5.853 -19.086 1.377) 20.010 8.734 ( 11.087 11.868 -7.684) 17.967 9.034 ( -4.912 -3.644 3.958) 7.285 9.203 ( -3.695 -2.222 7.929) 9.026 9.855 ( -1.033 -4.505 1.869) 4.985 10.196 ( 2.016 8.568 8.383) 12.155 10.979 ( -3.911 6.320 0.803) 7.476 11.253 ( 3.793 3.596 0.217) 5.232 11.546 ( -8.517 -0.125 0.667) 8.544 12.012 ( 5.155 12.548 -5.332) 14.575 12.852 ( -1.797 0.687 1.455) 2.412 13.167 ( -2.919 2.248 -3.003) 4.753 13.460 ( 1.199 -6.332 -5.442) 8.435 13.761 ( -2.103 -0.719 4.039) 4.610 14.075 ( 7.807 -3.931 0.877) 8.785 14.657 ( -1.898 -3.110 -2.121) 4.216 14.888 ( 7.375 -7.141 -6.715) 12.267 15.912 ( -7.225 16.786 -5.963) 19.223 17.478 ( 10.703 -5.379 -6.838) 13.793 19.232 ( -6.808 -16.293 -24.575) 30.262 19.856 ( 14.041 2.412 -37.261) 39.892 21.128 ( 5.466 1.233 -8.668) 10.322 22.735 ( -20.325 4.001 59.846) 63.330 24.946 ( -1.165 7.562 24.459) 25.628 28.488 ( -1.924 -4.611 -10.734) 11.840 28.701 ( 5.127 1.217 -13.066) 14.089 ======================= Grid point 130 (42/300) ======================= q-point: ( 0.45 0.00 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.253 ( 3.246 -1.808 -1.923) 4.184 2.294 ( 2.993 -3.637 2.266) 5.227 3.246 ( 2.632 -17.146 -8.956) 19.523 3.403 ( 7.254 5.768 -4.894) 10.480 3.770 ( -3.254 0.870 -13.183) 13.607 3.930 ( 3.133 -3.763 -0.208) 4.900 4.115 ( -1.155 -8.867 -5.450) 10.472 4.558 ( 0.617 12.645 -6.205) 14.099 4.960 ( 2.403 -14.634 5.198) 15.714 5.329 ( -1.727 10.856 8.555) 13.929 5.850 ( -4.982 -1.534 -1.940) 5.562 6.148 ( 3.332 5.168 -2.561) 6.661 6.212 ( -4.680 -2.472 9.465) 10.844 6.566 ( 2.254 0.595 6.774) 7.163 7.201 ( 0.474 -3.054 3.491) 4.662 7.868 ( -2.054 1.067 -0.284) 2.332 8.341 ( -1.399 -5.240 -0.827) 5.486 8.651 ( 6.758 -1.921 -5.413) 8.869 9.048 ( -1.416 -0.130 5.168) 5.360 9.214 ( -3.459 -0.261 6.494) 7.362 9.822 ( 0.481 4.451 3.483) 5.672 10.104 ( -3.655 4.508 10.258) 11.786 10.932 ( 3.325 -1.213 -1.872) 4.004 11.222 ( -1.381 0.337 0.862) 1.662 11.548 ( -9.630 -6.378 -2.678) 11.857 11.801 ( 7.755 13.323 -5.024) 16.214 12.838 ( 1.357 0.955 1.834) 2.473 13.145 ( -3.715 -2.742 0.926) 4.709 13.570 ( 1.626 -4.888 -3.849) 6.431 13.754 ( -2.021 0.710 3.171) 3.827 14.143 ( 3.720 1.417 -0.338) 3.995 14.689 ( -0.209 -1.569 -3.799) 4.116 15.017 ( 6.500 -1.576 -9.430) 11.561 15.628 ( -2.988 7.176 -6.287) 9.997 17.611 ( 5.111 -3.122 -7.657) 9.722 19.402 ( -2.243 -8.556 -12.908) 15.648 19.846 ( 13.197 -0.079 -44.998) 46.893 21.117 ( 3.922 2.041 -10.080) 11.007 22.675 ( -15.419 -0.003 58.595) 60.589 24.850 ( -4.941 4.208 23.340) 24.226 28.522 ( 0.258 -1.997 -13.002) 13.157 28.711 ( 4.811 -0.453 -9.918) 11.032 ======================= Grid point 131 (43/300) ======================= q-point: (-0.45 0.00 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.149 ( -5.358 8.167 -3.618) 10.416 2.338 ( -3.695 2.027 1.284) 4.406 3.211 ( 1.750 14.073 -11.875) 18.497 3.476 ( 5.222 0.590 -4.537) 6.943 3.696 ( 4.314 -0.088 -5.223) 6.775 3.985 ( -2.399 -0.167 3.299) 4.082 4.216 ( -1.335 5.354 -10.595) 11.946 4.426 ( 3.967 -7.161 -8.487) 11.792 5.058 ( -0.602 9.363 8.121) 12.409 5.308 ( -0.535 -11.209 4.689) 12.162 5.836 ( 0.077 1.821 -1.454) 2.332 6.062 ( -3.052 0.418 2.835) 4.186 6.301 ( -2.377 -5.806 4.809) 7.905 6.564 ( -2.219 0.661 7.677) 8.019 7.257 ( -2.278 -2.347 4.954) 5.936 7.806 ( -0.921 3.668 -3.248) 4.986 8.235 ( 5.368 13.098 -4.042) 14.721 8.837 ( -3.503 -10.994 2.544) 11.816 9.044 ( 5.371 3.630 4.394) 7.831 9.206 ( -8.718 -3.472 5.984) 11.130 9.792 ( 4.135 -0.013 -1.729) 4.482 10.048 ( -5.461 -1.499 11.553) 12.866 10.973 ( 0.500 -0.353 0.674) 0.910 11.231 ( -1.234 -1.569 0.196) 2.006 11.548 ( 6.564 7.363 -0.935) 9.908 11.723 ( -3.165 -8.269 -9.579) 13.044 12.845 ( 3.849 0.592 2.974) 4.900 13.205 ( -4.627 -5.797 2.295) 7.764 13.637 ( -1.369 -1.692 -0.653) 2.272 13.727 ( 1.894 1.762 2.296) 3.459 14.079 ( -1.669 5.489 -2.913) 6.434 14.690 ( 1.398 1.497 -4.874) 5.287 14.970 ( 4.513 7.950 -10.287) 13.762 15.622 ( 3.600 -6.782 -7.198) 10.525 17.614 ( -1.039 2.969 -7.242) 7.895 19.473 ( -2.805 -2.795 -3.959) 5.599 19.913 ( 14.684 -4.604 -48.432) 50.818 21.075 ( 2.800 2.561 -13.388) 13.915 22.717 ( -12.244 -3.832 62.312) 63.619 24.812 ( -6.208 -0.261 21.135) 22.029 28.527 ( 3.964 0.728 -12.612) 13.241 28.745 ( 1.278 -2.567 -8.471) 8.943 ======================= Grid point 132 (44/300) ======================= q-point: (-0.36 0.00 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.898 ( -10.645 11.657 -0.833) 15.808 2.165 ( -9.496 11.046 -1.677) 14.663 2.871 ( 2.849 20.458 -13.999) 24.952 3.369 ( 6.179 11.687 -3.841) 13.766 3.640 ( -5.671 9.375 6.525) 12.753 3.939 ( -5.852 8.976 -0.551) 10.730 4.087 ( 4.912 -1.055 4.400) 6.679 4.669 ( 4.441 -13.672 -15.300) 20.994 4.895 ( -1.921 7.173 8.958) 11.635 5.467 ( -3.613 -4.786 2.279) 6.415 5.819 ( 7.614 -0.071 -5.839) 9.595 6.104 ( -5.014 -5.341 8.961) 11.574 6.397 ( -2.119 -5.635 1.946) 6.326 6.561 ( -5.057 -2.483 6.915) 8.919 7.259 ( -6.929 -0.138 4.233) 8.121 7.735 ( 4.049 3.432 -6.536) 8.420 7.972 ( 1.923 16.747 -1.083) 16.892 8.916 ( 0.386 2.679 4.512) 5.261 9.023 ( 6.191 2.110 3.974) 7.653 9.252 ( -14.063 -8.184 6.389) 17.481 9.862 ( 1.669 -4.992 -7.179) 8.902 10.123 ( -1.301 -5.365 12.843) 13.979 10.968 ( -0.832 -0.198 1.087) 1.383 11.202 ( 2.979 5.394 -3.855) 7.268 11.545 ( 2.858 -5.267 2.641) 6.549 11.910 ( 1.955 -12.090 -9.970) 15.792 12.881 ( 4.856 -0.368 3.554) 6.029 13.276 ( -5.334 -4.829 0.130) 7.196 13.599 ( -4.619 2.350 1.033) 5.284 13.739 ( 5.116 1.484 3.314) 6.273 13.930 ( -4.569 6.338 -4.484) 9.009 14.617 ( 3.136 7.270 -8.092) 11.321 14.824 ( 2.047 7.100 -5.557) 9.246 15.853 ( 8.930 -13.810 -9.215) 18.851 17.485 ( -5.180 6.280 -5.098) 9.605 19.459 ( -1.774 1.896 -2.872) 3.871 20.019 ( 11.644 -4.108 -45.189) 46.845 21.027 ( 2.684 1.572 -16.752) 17.039 22.861 ( -11.958 -8.622 70.587) 72.110 24.834 ( -7.914 -3.257 18.205) 20.116 28.503 ( 4.962 3.173 -10.216) 11.792 28.798 ( -0.134 -4.264 -8.461) 9.476 ======================= Grid point 133 (45/300) ======================= q-point: (-0.27 0.00 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.570 ( -15.473 14.004 5.752) 21.647 1.803 ( -10.021 19.388 -5.788) 22.579 2.471 ( -0.336 20.786 -8.174) 22.338 3.151 ( 5.552 14.997 0.631) 16.004 3.337 ( -10.800 17.618 15.265) 25.691 3.656 ( -4.430 15.253 8.021) 17.794 4.195 ( 0.356 -5.061 -0.336) 5.084 4.768 ( -4.519 3.622 5.895) 8.264 4.930 ( 5.989 -10.029 -11.161) 16.156 5.505 ( 1.513 -2.987 -1.355) 3.612 5.921 ( 4.667 -5.690 -5.293) 9.065 6.183 ( -1.099 -3.587 10.315) 10.976 6.484 ( -1.354 -4.544 -0.552) 4.774 6.629 ( -8.872 -8.860 7.268) 14.492 7.162 ( -10.505 4.654 2.227) 11.704 7.647 ( 2.115 16.971 1.519) 17.170 7.756 ( 5.569 -1.970 -5.628) 8.159 8.834 ( 7.157 8.059 -0.634) 10.797 9.037 ( 2.137 0.871 6.169) 6.587 9.309 ( -14.446 -7.192 5.797) 17.147 9.913 ( -8.143 -2.431 -9.246) 12.558 10.236 ( 6.410 -2.637 16.112) 17.539 10.994 ( 3.360 -0.710 0.272) 3.445 11.126 ( 1.338 1.416 -6.443) 6.731 11.752 ( 0.519 -13.717 3.421) 14.147 12.141 ( 6.994 -10.622 -8.453) 15.271 12.934 ( 4.837 -0.959 2.663) 5.605 13.296 ( -4.687 -1.265 -3.141) 5.782 13.518 ( -4.222 2.761 1.748) 5.339 13.685 ( -3.879 5.449 -0.901) 6.749 13.830 ( 2.773 2.307 -1.452) 3.888 14.450 ( 4.486 11.057 -9.313) 15.137 14.731 ( -0.771 3.254 0.578) 3.394 16.207 ( 12.555 -17.195 -12.514) 24.696 17.329 ( -7.106 4.206 -2.379) 8.594 19.373 ( 4.217 7.235 -5.322) 9.923 20.020 ( 0.186 1.938 -43.587) 43.631 21.005 ( 3.420 -0.169 -17.787) 18.114 23.133 ( -13.180 -16.975 84.469) 87.160 24.863 ( -12.624 -4.059 15.810) 20.635 28.451 ( 3.745 3.815 -7.549) 9.250 28.862 ( 1.238 -3.303 -9.469) 10.104 ======================= Grid point 134 (46/300) ======================= q-point: (-0.18 0.00 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.176 ( -20.507 16.071 11.804) 28.603 1.295 ( -10.031 25.480 -3.924) 27.663 2.054 ( -6.977 22.663 10.454) 25.915 2.895 ( -1.153 15.646 6.410) 16.947 2.975 ( -5.579 13.300 15.720) 21.334 3.368 ( -3.869 13.987 9.849) 17.539 4.254 ( -2.872 -2.403 -0.121) 3.747 4.676 ( -1.733 4.473 2.872) 5.591 5.105 ( 2.507 -7.172 -8.861) 11.672 5.637 ( 6.036 -7.899 -1.792) 10.102 6.045 ( 2.362 -5.348 -2.410) 6.323 6.275 ( 3.139 -4.210 7.376) 9.055 6.547 ( -1.344 -3.844 -2.180) 4.619 6.754 ( -19.427 -11.856 8.151) 24.175 6.979 ( -5.178 6.880 3.570) 9.321 7.369 ( -3.266 11.790 8.139) 14.694 7.901 ( 11.729 -6.795 -6.586) 15.070 8.724 ( 7.916 9.343 -2.218) 12.445 9.042 ( 0.205 0.507 0.401) 0.679 9.325 ( -13.646 -4.026 3.620) 14.681 9.786 ( -16.504 4.310 -8.771) 19.181 10.386 ( 13.984 -3.083 21.566) 25.887 11.025 ( 5.842 -0.344 -0.700) 5.894 11.167 ( 0.096 -4.703 -4.950) 6.828 12.022 ( 1.468 -12.295 1.729) 12.502 12.363 ( 8.848 -8.343 -7.269) 14.168 12.990 ( 4.060 -1.162 0.994) 4.339 13.251 ( -2.854 1.878 -6.267) 7.138 13.442 ( -2.318 3.611 3.255) 5.386 13.555 ( -7.167 2.535 -5.226) 9.225 13.824 ( 6.565 2.195 -1.095) 7.008 14.259 ( 3.944 10.795 -6.382) 13.146 14.685 ( -3.441 0.648 4.249) 5.506 16.586 ( 12.768 -14.907 -16.362) 25.553 17.243 ( -7.902 -1.384 -1.832) 8.228 19.207 ( 9.198 16.880 -22.019) 29.229 19.749 ( -20.188 11.442 -34.714) 41.756 21.020 ( 5.188 -1.232 -16.049) 16.911 23.687 ( -9.500 -37.536 103.947) 110.924 24.854 ( -22.944 -5.755 14.827) 27.917 28.395 ( 2.187 3.075 -5.762) 6.887 28.881 ( 4.044 2.224 -13.543) 14.308 ======================= Grid point 135 (47/300) ======================= q-point: (-0.09 0.00 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.727 ( -19.361 16.042 15.221) 29.392 0.812 ( -16.306 14.262 18.783) 28.672 1.522 ( -15.678 29.067 33.824) 47.273 2.688 ( -2.432 4.720 10.521) 11.785 2.796 ( -0.318 7.919 10.330) 13.020 3.124 ( -3.395 10.638 9.748) 14.823 4.260 ( -3.394 -0.925 2.326) 4.218 4.584 ( -0.427 4.751 -0.302) 4.780 5.217 ( 1.073 -5.082 -5.670) 7.689 5.821 ( 1.665 -6.985 1.224) 7.284 6.153 ( 5.027 -4.149 -5.594) 8.590 6.393 ( 9.665 -1.403 3.758) 10.464 6.603 ( 0.283 -2.869 -5.086) 5.846 6.744 ( -21.266 -5.387 3.548) 22.223 7.012 ( -6.759 -12.232 13.196) 19.221 7.234 ( -12.324 -4.144 18.236) 22.396 8.117 ( 12.350 -7.097 -4.810) 15.034 8.558 ( 2.809 14.843 -6.960) 16.633 8.965 ( -9.220 6.489 -16.013) 19.584 9.271 ( -13.281 -0.672 -4.808) 14.140 9.533 ( -22.222 4.851 4.195) 23.129 10.756 ( 35.780 -19.243 36.688) 54.741 11.092 ( 2.324 -3.279 -1.316) 4.229 11.244 ( 2.375 -3.048 -3.167) 4.996 12.178 ( 6.115 0.008 -2.285) 6.528 12.537 ( 8.391 -4.543 -6.929) 11.793 13.033 ( 1.940 -0.953 -0.608) 2.245 13.176 ( 0.835 4.538 -8.927) 10.049 13.368 ( 0.729 4.045 2.201) 4.662 13.466 ( -5.273 1.399 -6.540) 8.516 13.831 ( 11.090 4.637 -1.731) 12.144 14.093 ( 0.065 6.836 0.259) 6.841 14.683 ( -7.037 -4.316 5.897) 10.145 16.808 ( 0.002 -3.848 -22.070) 22.403 17.221 ( -11.989 0.689 -12.071) 17.028 18.396 ( -40.355 54.376 -45.405) 81.528 19.458 ( -7.099 2.947 0.799) 7.728 21.063 ( 7.356 -1.157 -13.722) 15.612 24.723 ( 17.412 -1.855 32.181) 36.637 25.073 ( -52.127 -99.455 87.722) 142.491 28.342 ( 1.213 3.814 -7.549) 8.545 28.690 ( 3.159 23.271 -25.131) 34.396 ======================= Grid point 137 (48/300) ======================= q-point: ( 0.09 0.09 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.626 ( 13.645 0.000 19.629) 23.906 0.944 ( 6.986 0.000 34.334) 35.037 1.105 ( 11.526 0.000 40.025) 41.651 2.677 ( 1.353 0.000 -1.459) 1.990 2.803 ( 0.967 0.000 23.405) 23.424 2.995 ( -3.384 -0.000 11.466) 11.955 4.170 ( -4.857 -0.000 -0.111) 4.858 4.531 ( 0.421 0.000 2.225) 2.264 5.246 ( -2.495 -0.000 -4.335) 5.002 5.823 ( -4.725 -0.000 -1.264) 4.891 6.188 ( -0.275 -0.000 -10.776) 10.780 6.251 ( -21.400 -0.000 11.800) 24.438 6.618 ( 0.980 0.000 -6.855) 6.925 6.854 ( -9.077 -0.000 16.950) 19.227 7.020 ( 0.260 0.000 2.172) 2.188 7.137 ( -1.025 -0.000 6.629) 6.707 7.812 ( 1.837 0.000 8.296) 8.497 8.217 ( -11.065 -0.000 0.836) 11.097 8.601 ( -6.525 -0.000 0.444) 6.540 9.299 ( 19.084 0.000 -10.770) 21.913 9.384 ( -5.626 -0.000 24.193) 24.838 11.104 ( -3.107 -0.000 -1.369) 3.396 11.337 ( 1.762 0.000 0.564) 1.850 11.892 ( -0.382 -0.000 -5.862) 5.875 12.090 ( -18.913 -0.000 16.312) 24.976 12.583 ( -6.011 -0.000 -5.172) 7.930 12.946 ( -0.923 -0.000 -6.760) 6.822 12.997 ( -2.543 -0.000 -3.281) 4.151 13.345 ( 2.803 0.000 -0.985) 2.971 13.770 ( -1.592 -0.000 5.835) 6.048 14.030 ( 1.888 0.000 1.712) 2.548 14.438 ( -5.677 -0.000 8.066) 9.864 14.748 ( -6.191 -0.000 2.505) 6.679 15.363 ( 93.853 0.000 -70.359) 117.298 17.070 ( 0.941 0.000 8.066) 8.121 17.634 ( 2.059 0.000 1.944) 2.832 19.449 ( 3.039 0.000 3.153) 4.379 21.201 ( 8.707 0.000 -9.440) 12.842 23.854 ( -68.744 -0.000 59.047) 90.622 27.146 ( -11.805 -0.000 6.524) 13.488 27.271 ( 4.741 0.000 -2.686) 5.449 28.305 ( -4.262 -0.000 -3.448) 5.482 ======================= Grid point 138 (49/300) ======================= q-point: ( 0.18 0.09 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.795 ( 5.195 -10.142 18.457) 21.692 1.102 ( 27.873 -12.757 13.228) 33.386 1.732 ( 11.788 -31.226 28.237) 43.719 2.626 ( -0.079 3.424 5.248) 6.266 2.928 ( 3.309 -6.713 7.267) 10.432 3.142 ( -2.658 -13.553 19.283) 23.719 4.159 ( -0.834 -1.088 -2.381) 2.748 4.525 ( -2.007 1.374 0.589) 2.502 5.159 ( -1.447 4.533 -6.617) 8.151 5.762 ( -4.558 2.195 -0.240) 5.064 6.147 ( -7.908 2.021 -1.798) 8.357 6.183 ( 0.908 -0.892 -0.458) 1.353 6.590 ( 0.334 1.334 -6.212) 6.362 6.776 ( -8.977 3.751 14.250) 17.255 6.991 ( 19.164 3.472 3.240) 19.744 7.199 ( -0.930 -4.927 6.310) 8.059 8.081 ( -12.482 2.706 -0.145) 12.773 8.244 ( -7.382 -30.206 -10.312) 32.760 8.633 ( -9.158 -8.327 1.811) 12.510 9.340 ( 14.557 7.809 -0.905) 16.544 9.408 ( 2.158 -0.770 14.568) 14.747 11.065 ( -2.211 4.319 -0.520) 4.880 11.195 ( -5.655 14.896 10.415) 19.035 11.514 ( 11.565 12.557 4.936) 17.770 12.143 ( -5.441 1.958 1.821) 6.063 12.466 ( -8.471 4.848 -5.390) 11.150 12.938 ( -3.324 0.848 -1.849) 3.897 13.095 ( -0.887 -9.836 -8.131) 12.792 13.364 ( 2.684 0.525 -2.451) 3.672 13.725 ( 3.217 1.340 2.282) 4.166 13.968 ( -9.005 8.517 8.219) 14.872 14.368 ( -5.389 -4.074 7.914) 10.406 14.549 ( 14.527 2.870 -5.254) 15.713 16.634 ( 16.876 -27.610 -57.339) 65.839 17.240 ( 30.786 -20.876 -30.807) 48.298 17.644 ( -6.427 -6.702 3.127) 9.798 19.566 ( 9.303 -7.940 -3.249) 12.655 21.222 ( 7.726 2.353 -8.433) 11.676 23.399 ( -53.323 11.168 69.965) 88.674 26.012 ( 19.211 51.774 26.751) 61.362 28.188 ( -6.192 -30.724 -18.388) 36.337 28.302 ( -7.852 -7.865 -6.073) 12.665 ======================= Grid point 139 (50/300) ======================= q-point: ( 0.27 0.09 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.214 ( 10.466 -23.386 2.139) 25.710 1.638 ( 24.645 -20.368 6.769) 32.681 2.347 ( 12.139 -15.648 5.232) 20.484 2.680 ( -2.554 -14.604 14.813) 20.958 3.108 ( 2.487 -9.597 -0.734) 9.941 3.460 ( -0.017 -16.188 20.544) 26.156 4.180 ( 1.564 -0.949 -3.059) 3.565 4.453 ( -5.588 2.514 0.182) 6.130 5.062 ( 0.520 4.357 -9.923) 10.850 5.698 ( -2.292 2.193 3.061) 4.408 6.026 ( -8.154 3.670 -6.847) 11.262 6.186 ( 1.013 2.955 4.457) 5.443 6.551 ( 0.934 3.296 -3.942) 5.223 6.680 ( 3.029 4.605 5.240) 7.605 7.094 ( 13.707 0.916 2.209) 13.914 7.352 ( -2.702 -12.604 5.948) 14.197 7.957 ( -8.112 2.070 0.636) 8.396 8.654 ( -7.476 -18.905 -8.704) 22.114 8.793 ( -9.472 -17.145 -3.662) 19.927 9.239 ( 9.349 11.631 3.556) 15.340 9.494 ( 4.991 -4.157 9.370) 11.401 10.756 ( -1.332 19.171 8.122) 20.863 11.114 ( -3.500 -0.631 4.635) 5.843 11.453 ( 8.962 6.413 1.893) 11.182 11.939 ( -4.452 14.734 -0.482) 15.400 12.321 ( -3.982 4.379 -5.641) 8.176 12.894 ( -1.857 1.521 0.436) 2.440 13.232 ( 0.005 -6.290 -6.041) 8.721 13.324 ( -0.239 4.150 -5.558) 6.941 13.790 ( -4.502 4.369 5.330) 8.232 13.814 ( 4.665 -7.076 -0.789) 8.512 14.478 ( -2.715 -6.905 3.317) 8.127 14.649 ( 9.108 -4.172 -0.998) 10.067 16.549 ( -13.750 12.973 -7.550) 20.356 17.484 ( 23.829 7.106 -8.317) 26.220 18.178 ( -2.007 -40.632 -47.929) 62.867 19.803 ( 14.718 -7.764 -17.660) 24.264 21.204 ( 6.583 3.085 -7.863) 10.709 23.004 ( -34.933 9.704 67.508) 76.627 25.493 ( 14.319 26.321 26.713) 40.142 28.305 ( -2.852 -4.307 -7.328) 8.965 28.563 ( -4.063 -13.589 -17.414) 22.459 ======================= Grid point 140 (51/300) ======================= q-point: ( 0.36 0.09 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.728 ( 12.125 -21.367 -0.533) 24.574 2.159 ( 20.618 -13.874 7.225) 25.880 2.540 ( 2.326 -9.961 -11.229) 15.190 3.148 ( 3.281 -24.374 10.980) 26.934 3.303 ( 1.411 -9.633 -3.765) 10.438 3.756 ( 0.060 -10.984 12.528) 16.661 4.162 ( 0.235 4.697 -0.985) 4.804 4.444 ( -3.722 -7.892 2.108) 8.977 4.951 ( 1.542 6.841 -11.272) 13.275 5.637 ( -2.655 4.475 6.127) 8.038 5.899 ( -7.282 2.385 -6.953) 10.347 6.115 ( -1.481 3.603 7.429) 8.388 6.460 ( 2.052 6.636 -2.092) 7.254 6.664 ( 6.547 2.633 2.206) 7.394 7.144 ( 8.131 1.399 -0.074) 8.251 7.643 ( -2.322 -18.638 3.228) 19.057 7.895 ( -4.154 0.241 1.197) 4.329 8.846 ( -7.970 -10.162 1.173) 12.967 9.027 ( 11.270 0.479 -11.551) 16.145 9.094 ( -5.821 -0.175 9.176) 10.868 9.680 ( 2.336 -10.869 4.923) 12.158 10.443 ( -0.312 14.859 7.762) 16.767 11.062 ( -5.376 4.714 3.156) 7.815 11.373 ( 2.047 6.492 1.580) 6.988 11.624 ( -3.750 13.038 -1.573) 13.657 12.210 ( 2.222 6.532 -5.328) 8.717 12.864 ( 0.151 1.086 2.781) 2.989 13.200 ( -3.860 4.494 -7.323) 9.420 13.341 ( 1.243 -5.778 -4.986) 7.733 13.746 ( -2.455 -0.279 5.168) 5.728 14.012 ( 6.779 -8.475 -1.250) 10.925 14.569 ( -2.534 -4.592 -0.281) 5.252 14.810 ( 8.218 -6.323 -1.327) 10.453 16.140 ( -14.984 16.733 -2.835) 22.639 17.522 ( 13.723 1.745 -3.217) 14.202 18.729 ( 2.694 -27.559 -42.671) 50.868 19.941 ( 13.551 0.077 -25.966) 29.290 21.184 ( 5.599 2.134 -7.654) 9.720 22.770 ( -24.313 5.178 61.541) 66.372 25.213 ( 3.799 16.775 26.131) 31.284 28.364 ( -2.008 -5.222 -9.661) 11.164 28.685 ( 1.944 -4.324 -14.435) 15.193 ======================= Grid point 141 (52/300) ======================= q-point: ( 0.45 0.09 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.135 ( 9.594 -12.905 0.481) 16.088 2.361 ( 10.158 2.386 1.453) 10.536 2.865 ( 0.914 -21.925 -7.718) 23.262 3.446 ( -0.204 -5.981 -7.446) 9.552 3.573 ( 8.459 -15.116 -2.497) 17.501 3.892 ( -4.555 -3.437 2.738) 6.330 4.063 ( 2.127 3.060 -0.978) 3.853 4.685 ( 0.263 -15.989 7.632) 17.719 4.779 ( 1.653 10.803 -10.477) 15.140 5.500 ( -5.763 7.557 4.900) 10.693 5.795 ( -6.759 2.195 -2.109) 7.413 6.122 ( 0.561 -3.002 6.631) 7.300 6.326 ( 0.941 8.540 -1.474) 8.717 6.659 ( 6.377 3.580 4.098) 8.383 7.180 ( 3.964 -0.762 1.316) 4.246 7.874 ( -0.006 0.275 0.461) 0.537 7.999 ( -5.259 -20.422 0.965) 21.110 8.857 ( 6.693 10.773 -1.419) 12.762 8.965 ( -6.281 -4.160 3.520) 8.315 9.208 ( 3.032 -3.965 2.004) 5.379 9.855 ( -0.586 -3.669 5.167) 6.365 10.230 ( -1.812 9.518 7.808) 12.444 10.930 ( -2.799 2.274 -1.404) 3.870 11.264 ( -3.229 4.159 0.468) 5.286 11.437 ( -5.043 4.064 -0.839) 6.530 12.073 ( 5.606 10.318 -4.902) 12.725 12.869 ( 2.867 0.332 4.256) 5.143 13.102 ( -4.114 1.331 -5.094) 6.682 13.461 ( 1.623 -6.594 -5.241) 8.578 13.751 ( -1.546 -0.480 4.626) 4.901 14.168 ( 4.561 -2.743 0.156) 5.325 14.628 ( -0.529 -3.930 -4.121) 5.719 14.979 ( 7.883 -5.607 -3.924) 10.439 15.759 ( -11.583 12.333 -3.688) 17.317 17.590 ( 6.412 -1.485 -4.398) 7.916 19.123 ( 7.383 -18.066 -34.469) 39.610 19.925 ( 11.630 4.676 -30.420) 32.902 21.169 ( 4.276 2.077 -8.243) 9.516 22.668 ( -17.809 1.026 58.283) 60.952 24.994 ( -4.311 11.087 25.506) 28.143 28.429 ( -0.604 -4.646 -12.159) 13.030 28.730 ( 4.767 -0.669 -11.469) 12.438 ======================= Grid point 142 (53/300) ======================= q-point: ( 0.55 0.09 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.276 ( 1.327 5.501 -2.182) 6.065 2.346 ( 3.476 0.481 0.340) 3.526 3.191 ( -3.315 -12.054 -6.101) 13.911 3.510 ( 3.725 -1.698 -5.673) 6.995 3.754 ( 8.565 2.635 -11.297) 14.420 3.913 ( -5.057 -6.091 5.752) 9.786 4.130 ( 7.691 -6.301 -14.077) 17.235 4.545 ( 0.157 12.509 -5.299) 13.586 5.005 ( 1.004 -15.024 7.401) 16.778 5.303 ( -5.914 9.431 4.471) 11.996 5.756 ( -6.665 -3.738 1.011) 7.708 6.156 ( -2.628 7.623 2.549) 8.457 6.215 ( 2.820 -2.995 3.270) 5.255 6.628 ( 2.703 4.248 6.217) 8.000 7.227 ( 1.166 -1.418 3.494) 3.947 7.856 ( 0.969 2.149 -1.205) 2.648 8.300 ( -4.336 -12.803 -0.111) 13.518 8.712 ( 3.902 6.322 -3.013) 8.017 9.000 ( -6.605 -3.874 5.717) 9.556 9.268 ( 7.237 2.246 3.401) 8.305 9.853 ( 1.870 2.688 4.384) 5.472 10.053 ( -8.133 5.969 9.785) 14.054 10.957 ( -0.161 -2.182 -0.301) 2.208 11.214 ( 1.138 0.047 -1.059) 1.555 11.395 ( -9.317 -7.358 -4.068) 12.550 11.890 ( 6.352 12.675 -3.758) 14.667 12.897 ( 5.171 0.795 4.185) 6.700 13.085 ( -4.556 -3.372 -1.433) 5.847 13.570 ( 0.569 -4.347 -3.815) 5.812 13.756 ( 0.379 -0.088 3.452) 3.474 14.164 ( -0.547 4.224 -0.569) 4.297 14.692 ( 2.704 -2.197 -5.182) 6.244 15.079 ( 5.713 0.780 -7.083) 9.133 15.550 ( -4.461 1.185 -6.528) 7.995 17.624 ( 0.333 0.076 -6.816) 6.825 19.374 ( 6.443 -7.902 -18.883) 21.460 19.887 ( 12.619 0.648 -39.521) 41.492 21.130 ( 2.886 3.110 -10.207) 11.054 22.674 ( -13.461 -2.434 58.431) 60.010 24.842 ( -7.522 4.886 23.704) 25.344 28.488 ( 1.499 -3.796 -13.540) 14.142 28.741 ( 3.994 0.890 -9.246) 10.112 ======================= Grid point 143 (54/300) ======================= q-point: (-0.36 0.09 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.082 ( -2.239 12.652 -2.070) 13.014 2.278 ( -4.513 7.066 -1.073) 8.453 3.169 ( -0.689 9.854 -13.326) 16.588 3.544 ( 5.923 2.287 -2.090) 6.684 3.726 ( 0.170 2.846 -2.865) 4.042 3.957 ( -1.094 -0.142 -0.727) 1.321 4.215 ( 4.804 6.071 -7.478) 10.764 4.447 ( 3.478 -8.058 -9.358) 12.830 5.053 ( -3.637 9.753 4.419) 11.308 5.296 ( -3.321 -10.896 6.281) 13.007 5.832 ( 0.236 -5.467 1.750) 5.745 6.024 ( -3.148 2.868 1.494) 4.513 6.294 ( -1.150 -3.686 5.258) 6.523 6.563 ( -1.894 3.797 6.940) 8.134 7.242 ( -2.094 0.525 3.965) 4.514 7.808 ( 2.746 3.459 -3.438) 5.597 8.297 ( 5.342 12.142 -3.449) 13.706 8.746 ( -9.987 -10.487 0.793) 14.503 9.054 ( -4.390 -4.832 8.106) 10.408 9.229 ( 6.579 7.231 3.214) 10.291 9.850 ( 4.514 0.695 0.248) 4.574 9.995 ( -7.258 -4.578 10.447) 13.519 10.958 ( -2.475 -0.444 1.563) 2.960 11.211 ( -2.196 -0.114 0.334) 2.224 11.582 ( 1.650 -10.792 -6.439) 12.675 11.719 ( 4.409 5.048 -3.415) 7.523 12.925 ( 4.942 0.664 4.120) 6.468 13.141 ( -4.378 -5.494 -0.548) 7.046 13.595 ( -2.776 0.302 -1.112) 3.005 13.786 ( 3.970 -0.703 2.550) 4.770 14.028 ( -3.883 7.669 -2.158) 8.862 14.711 ( 3.591 1.815 -5.109) 6.503 14.988 ( 2.200 8.730 -8.616) 12.462 15.646 ( 3.919 -11.308 -9.197) 15.094 17.554 ( -3.034 4.882 -7.603) 9.531 19.453 ( 1.724 -0.878 -4.446) 4.848 19.949 ( 13.371 -3.973 -47.558) 49.561 21.068 ( 2.683 3.195 -13.093) 13.742 22.760 ( -12.488 -5.349 62.188) 63.655 24.788 ( -7.010 -0.124 20.802) 21.952 28.541 ( 4.412 -1.608 -13.361) 14.162 28.729 ( 0.462 -0.178 -8.117) 8.132 ======================= Grid point 144 (55/300) ======================= q-point: (-0.27 0.09 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.791 ( -4.090 15.798 1.961) 16.436 2.036 ( -6.711 13.508 -4.199) 15.657 2.857 ( 2.384 19.973 -15.220) 25.224 3.454 ( 7.187 12.025 -3.574) 14.457 3.572 ( -7.514 11.274 8.166) 15.819 3.879 ( -1.970 8.295 -0.208) 8.528 4.147 ( 1.042 0.718 4.269) 4.452 4.661 ( 1.280 -10.347 -12.188) 16.039 4.894 ( -1.000 3.682 1.355) 4.049 5.435 ( -2.179 -5.694 5.035) 7.907 5.897 ( 6.625 -0.041 -5.769) 8.784 6.073 ( -3.416 -7.780 9.011) 12.385 6.368 ( -3.456 -5.760 3.792) 7.714 6.503 ( -6.212 0.475 6.480) 8.989 7.187 ( -4.443 3.326 2.258) 5.992 7.777 ( 4.218 1.437 -4.075) 6.038 8.020 ( 5.618 19.202 -2.693) 20.187 8.854 ( -9.820 -7.561 1.907) 12.539 9.131 ( -3.591 -4.329 10.623) 12.020 9.137 ( 3.874 6.584 1.120) 7.721 9.858 ( 0.961 0.975 -4.460) 4.665 10.133 ( -3.121 -10.384 11.396) 15.730 10.977 ( 2.328 -1.791 -0.434) 2.969 11.188 ( -3.079 1.259 0.072) 3.327 11.608 ( 4.421 -1.130 1.412) 4.776 11.925 ( 3.827 -14.869 -7.808) 17.224 12.957 ( 3.211 -0.276 3.557) 4.800 13.206 ( -3.301 -4.414 -2.314) 5.978 13.537 ( -3.824 2.750 -0.688) 4.760 13.796 ( 1.038 6.258 0.993) 6.420 13.871 ( -1.392 2.336 -0.411) 2.750 14.650 ( 4.832 7.026 -6.593) 10.779 14.819 ( -0.120 7.588 -5.421) 9.327 15.942 ( 8.582 -17.008 -12.256) 22.652 17.395 ( -4.261 7.356 -5.099) 9.914 19.457 ( 1.964 0.752 -1.445) 2.551 19.988 ( 6.777 0.431 -49.035) 49.503 21.018 ( 3.988 1.693 -15.016) 15.629 22.912 ( -15.540 -9.715 70.192) 72.545 24.796 ( -5.841 -1.267 18.400) 19.347 28.536 ( 4.744 3.466 -10.388) 11.935 28.757 ( -1.183 -4.818 -9.793) 10.978 ======================= Grid point 145 (56/300) ======================= q-point: (-0.18 0.09 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.440 ( -5.492 19.330 8.523) 21.828 1.674 ( -4.129 20.356 -7.724) 22.160 2.455 ( 2.331 21.471 -8.632) 23.258 3.211 ( -2.787 17.657 3.650) 18.245 3.253 ( -3.694 16.451 12.252) 20.842 3.645 ( -1.242 14.934 9.949) 17.987 4.181 ( -1.542 -3.109 -1.032) 3.620 4.700 ( -6.110 0.627 -0.089) 6.142 4.967 ( 3.960 -7.596 -10.029) 13.190 5.547 ( 3.391 -6.004 2.360) 7.288 5.965 ( 4.831 -4.029 -5.620) 8.435 6.197 ( -2.431 -5.634 10.883) 12.493 6.455 ( -4.007 -2.519 1.133) 4.867 6.505 ( -8.691 -7.436 5.367) 12.635 7.070 ( -3.704 5.840 1.350) 7.046 7.648 ( -1.451 16.666 3.421) 17.075 7.867 ( 10.308 -2.023 -5.996) 12.095 8.889 ( 0.309 0.836 -0.903) 1.269 9.048 ( -2.819 2.807 0.561) 4.017 9.192 ( -4.628 -3.018 9.731) 11.190 9.772 ( -6.611 5.658 -9.103) 12.593 10.342 ( 1.206 -10.349 14.492) 17.849 11.052 ( 5.656 -2.539 -1.108) 6.298 11.138 ( 1.309 1.771 -0.162) 2.208 11.775 ( 0.648 -13.003 2.640) 13.284 12.201 ( 4.701 -12.474 -7.105) 15.106 12.989 ( 0.621 -1.062 1.812) 2.190 13.242 ( -0.370 -1.283 -4.708) 4.894 13.452 ( -4.616 2.440 -1.175) 5.352 13.635 ( -0.668 7.829 -0.616) 7.882 13.871 ( 1.781 0.437 0.828) 2.012 14.501 ( 6.944 11.149 -8.099) 15.431 14.703 ( -3.374 3.637 0.890) 5.041 16.337 ( 12.367 -19.316 -17.108) 28.614 17.231 ( -5.279 5.505 -0.642) 7.654 19.455 ( 8.053 2.819 -3.434) 9.197 19.787 ( -8.404 13.194 -52.153) 54.449 21.017 ( 5.948 -0.463 -14.483) 15.663 23.173 ( -22.389 -19.767 82.486) 87.726 24.800 ( -3.758 0.597 18.441) 18.830 28.467 ( 2.234 4.342 -7.719) 9.134 28.829 ( -0.315 -4.630 -12.597) 13.425 ======================= Grid point 146 (57/300) ======================= q-point: (-0.09 0.09 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.031 ( -4.258 21.993 12.831) 25.816 1.189 ( -1.706 27.072 -3.416) 27.340 2.055 ( 1.444 25.037 11.778) 27.707 2.819 ( -10.918 14.537 12.388) 22.000 3.016 ( 2.812 12.199 5.801) 13.798 3.372 ( -1.560 15.040 14.025) 20.624 4.214 ( -2.519 -1.826 -0.684) 3.185 4.632 ( -4.886 1.959 -1.310) 5.424 5.102 ( 1.563 -6.269 -9.414) 11.417 5.704 ( 2.524 -7.082 1.477) 7.663 6.086 ( 4.920 -5.669 -6.308) 9.805 6.313 ( -6.488 -8.124 14.883) 18.155 6.446 ( -8.017 -2.216 4.653) 9.530 6.582 ( -1.731 -2.996 -3.682) 5.052 6.966 ( -1.267 3.054 5.708) 6.596 7.360 ( -1.923 12.554 7.144) 14.572 8.025 ( 7.041 -7.695 -4.100) 11.207 8.794 ( 2.460 10.002 -2.062) 10.504 9.024 ( 0.571 0.176 -4.437) 4.477 9.170 ( -10.576 1.996 -4.501) 11.666 9.535 ( -12.938 8.654 -0.033) 15.565 10.618 ( 6.947 -14.794 19.857) 25.718 11.101 ( 4.437 0.172 1.515) 4.692 11.195 ( 5.257 -4.089 -1.985) 6.950 12.042 ( -0.269 -13.341 1.005) 13.382 12.423 ( 2.545 -9.628 -6.568) 11.930 13.008 ( -2.427 -1.417 -0.300) 2.826 13.230 ( 2.621 2.245 -7.468) 8.227 13.389 ( -4.369 0.855 -0.602) 4.493 13.530 ( 6.126 4.529 -1.154) 7.706 13.885 ( 1.712 -1.414 0.184) 2.228 14.331 ( 9.776 11.755 -7.544) 17.049 14.618 ( -7.469 2.274 5.299) 9.436 16.732 ( 16.872 -13.743 -26.866) 34.573 17.124 ( -7.836 1.304 3.852) 8.828 19.078 ( -18.911 42.737 -61.977) 77.622 19.472 ( 3.306 1.718 1.595) 4.053 21.064 ( 7.494 -1.807 -12.616) 14.785 23.659 ( -41.442 -39.604 90.750) 107.338 24.833 ( 10.225 -1.985 26.027) 28.034 28.390 ( 0.187 3.424 -6.414) 7.273 28.835 ( -2.510 2.063 -18.636) 18.917 ======================= Grid point 149 (58/300) ======================= q-point: ( 0.18 0.18 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.852 ( 8.978 0.000 23.083) 24.767 1.172 ( 8.444 0.000 30.515) 31.662 1.561 ( 32.686 0.000 20.016) 38.328 2.730 ( 7.030 0.000 -1.330) 7.155 2.921 ( 4.803 0.000 23.453) 23.939 2.982 ( -4.076 -0.000 11.478) 12.180 4.149 ( 2.203 0.000 -3.904) 4.483 4.542 ( -0.064 -0.000 1.992) 1.993 5.190 ( -2.767 -0.000 -4.776) 5.520 5.743 ( -5.500 -0.000 -1.706) 5.759 6.129 ( -3.049 -0.000 -9.073) 9.571 6.137 ( -1.908 -0.000 1.844) 2.653 6.608 ( 0.964 0.000 -6.895) 6.962 6.654 ( -18.599 -0.000 20.907) 27.983 7.126 ( -3.489 -0.000 6.154) 7.074 7.283 ( 23.223 0.000 -8.143) 24.609 7.857 ( -0.614 -0.000 6.410) 6.439 8.034 ( -12.515 -0.000 2.310) 12.727 8.493 ( -9.568 -0.000 2.846) 9.983 9.388 ( -5.687 -0.000 23.439) 24.119 9.598 ( 25.992 0.000 -9.175) 27.564 11.047 ( -3.926 -0.000 0.511) 3.959 11.327 ( -4.028 -0.000 2.298) 4.637 11.913 ( 6.249 0.000 -7.156) 9.500 11.956 ( -8.657 -0.000 19.107) 20.977 12.437 ( -10.922 -0.000 -4.536) 11.827 12.923 ( 0.864 0.000 -7.870) 7.917 12.950 ( -1.877 -0.000 -2.630) 3.231 13.394 ( 4.940 0.000 -3.409) 6.002 13.755 ( -3.514 -0.000 7.268) 8.073 13.977 ( -11.087 -0.000 8.810) 14.161 14.312 ( -5.811 -0.000 13.748) 14.926 14.641 ( -9.786 -0.000 3.465) 10.381 16.437 ( 78.599 0.000 -103.204) 129.726 17.116 ( 1.347 0.000 8.257) 8.366 17.760 ( 20.791 0.000 -13.417) 24.744 19.522 ( 5.227 0.000 3.640) 6.369 21.285 ( 7.090 0.000 -7.308) 10.182 23.249 ( -48.757 -0.000 70.246) 85.509 27.070 ( -3.035 -0.000 3.167) 4.387 27.355 ( 8.016 0.000 -1.506) 8.156 28.220 ( -5.536 -0.000 -5.321) 7.678 ======================= Grid point 150 (59/300) ======================= q-point: ( 0.27 0.18 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.974 ( 10.936 -8.730 14.823) 20.385 1.483 ( 16.861 -16.033 16.812) 28.705 2.051 ( 20.437 -21.961 18.551) 35.271 2.691 ( 6.747 6.555 5.830) 11.067 2.983 ( 1.320 -4.986 3.048) 5.991 3.215 ( 3.964 -14.812 22.509) 27.235 4.165 ( 2.299 -0.622 -3.746) 4.439 4.500 ( -2.383 4.130 1.710) 5.065 5.117 ( -1.114 3.627 -6.820) 7.804 5.696 ( -4.175 0.336 -0.598) 4.231 6.015 ( -9.653 3.926 -4.317) 11.279 6.230 ( 5.795 -2.958 -3.484) 7.380 6.564 ( -2.695 -0.090 -2.087) 3.410 6.666 ( -9.652 -4.490 9.378) 14.187 7.154 ( -2.127 -5.401 5.810) 8.213 7.335 ( 19.917 7.208 -0.896) 21.200 7.890 ( -12.486 -1.917 -1.153) 12.685 8.155 ( -3.237 -19.924 -2.598) 20.352 8.501 ( -10.924 -7.801 4.410) 14.129 9.384 ( -5.724 0.720 22.563) 23.289 9.674 ( 24.648 8.601 -7.933) 27.285 11.028 ( -2.552 2.690 -0.323) 3.722 11.141 ( -6.199 12.140 7.527) 15.571 11.668 ( 7.122 10.647 3.939) 13.401 12.109 ( 0.009 1.890 0.523) 1.961 12.309 ( -10.278 2.225 -5.206) 11.734 12.912 ( 0.545 0.723 -0.384) 0.984 13.061 ( 0.045 -10.165 -7.304) 12.517 13.393 ( 2.709 3.228 -5.471) 6.906 13.735 ( -3.121 -0.814 5.695) 6.545 13.855 ( -9.511 4.477 6.943) 12.598 14.350 ( -0.872 -4.800 4.806) 6.848 14.618 ( -2.538 -3.770 5.166) 6.880 16.670 ( 9.633 7.861 -31.710) 34.061 17.421 ( 2.722 -26.130 -19.460) 32.694 17.847 ( 43.082 4.511 -36.305) 56.520 19.681 ( 8.357 -10.339 -4.925) 14.178 21.294 ( 6.131 2.621 -6.831) 9.545 23.003 ( -37.811 5.217 69.169) 79.001 26.308 ( 12.870 43.659 16.601) 48.449 28.063 ( -3.214 -33.496 -12.191) 35.790 28.197 ( -4.960 -2.925 -6.618) 8.772 ======================= Grid point 151 (60/300) ======================= q-point: ( 0.36 0.18 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.393 ( 13.457 -22.437 0.566) 26.169 1.967 ( 15.532 -19.698 10.547) 27.212 2.516 ( 9.469 -4.158 4.080) 11.118 2.762 ( 7.333 -16.216 11.926) 21.423 3.126 ( -0.150 -9.004 -0.410) 9.014 3.577 ( 7.428 -14.169 19.828) 25.477 4.193 ( 1.050 -1.358 -2.837) 3.316 4.380 ( -5.359 4.502 1.522) 7.162 5.036 ( 0.687 3.725 -9.550) 10.273 5.674 ( -2.896 0.769 3.502) 4.609 5.856 ( -11.539 2.694 -6.091) 13.323 6.231 ( 2.576 5.627 3.811) 7.269 6.549 ( 0.603 1.556 -4.074) 4.402 6.696 ( -0.804 -2.259 2.168) 3.233 7.302 ( 2.446 0.121 0.959) 2.630 7.341 ( 8.805 -5.958 3.136) 11.084 7.860 ( -4.596 -1.583 0.658) 4.905 8.517 ( -7.741 -19.962 -7.031) 22.535 8.659 ( -9.406 -18.066 2.887) 20.571 9.331 ( -0.722 6.807 15.946) 17.353 9.666 ( 16.265 4.847 -1.976) 17.087 10.744 ( -3.618 16.941 5.128) 18.066 11.078 ( -3.309 0.323 3.263) 4.658 11.537 ( 0.751 9.137 2.467) 9.494 11.897 ( 0.277 15.996 -3.576) 16.393 12.260 ( -1.837 -0.440 -5.078) 5.418 12.904 ( 2.706 1.447 2.863) 4.197 13.205 ( -0.969 -4.107 -5.369) 6.829 13.290 ( -1.709 3.928 -6.708) 7.959 13.725 ( -4.701 -0.395 5.476) 7.228 13.872 ( 2.231 -8.310 -0.994) 8.662 14.450 ( -2.530 -5.860 0.550) 6.407 14.737 ( 2.026 -7.125 6.585) 9.912 16.358 ( -8.692 18.381 -7.301) 21.604 17.610 ( -5.071 -2.562 2.980) 6.415 18.273 ( 39.384 -19.969 -56.484) 71.696 19.914 ( 9.165 -7.888 -17.021) 20.879 21.263 ( 5.304 3.377 -7.124) 9.502 22.788 ( -27.962 4.791 64.634) 70.586 25.745 ( 9.253 30.555 22.609) 39.121 28.229 ( -3.706 -5.532 -8.422) 10.736 28.480 ( -0.110 -16.220 -13.516) 21.114 ======================= Grid point 152 (61/300) ======================= q-point: ( 0.45 0.18 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.906 ( 13.246 -20.499 -2.587) 24.543 2.445 ( 10.918 -19.094 7.907) 23.373 2.533 ( 5.218 2.746 -3.208) 6.713 3.189 ( 0.506 -16.622 -7.333) 18.174 3.331 ( 0.144 -15.184 10.151) 18.265 3.848 ( 8.674 -4.891 7.123) 12.244 4.146 ( -2.223 5.255 0.908) 5.778 4.416 ( -2.153 -12.082 5.058) 13.274 4.935 ( 2.022 6.507 -11.632) 13.481 5.560 ( -11.136 5.923 3.485) 13.086 5.790 ( -4.108 -0.231 -2.759) 4.954 6.144 ( 1.886 3.806 5.750) 7.149 6.479 ( 1.499 6.235 -2.323) 6.820 6.737 ( 3.366 -0.203 0.993) 3.516 7.262 ( 7.470 4.664 -1.125) 8.878 7.611 ( -2.736 -16.942 2.104) 17.290 7.872 ( 0.498 -0.946 0.754) 1.308 8.725 ( -9.519 -11.684 2.025) 15.207 8.985 ( -7.367 -14.825 3.096) 16.841 9.204 ( 11.339 8.419 -0.747) 14.142 9.749 ( 4.691 -4.977 5.868) 9.012 10.446 ( -2.901 13.520 5.581) 14.911 10.989 ( -5.550 6.106 0.417) 8.262 11.342 ( -6.262 8.723 2.347) 10.992 11.614 ( 2.933 13.782 -3.317) 14.476 12.231 ( 3.061 3.828 -5.727) 7.538 12.913 ( 4.321 0.877 5.272) 6.873 13.112 ( -4.326 4.124 -7.942) 9.940 13.346 ( 1.561 -5.893 -3.303) 6.934 13.731 ( -1.878 -1.190 4.530) 5.046 14.078 ( 3.088 -9.720 -2.368) 10.470 14.527 ( -2.413 -4.974 -3.399) 6.490 14.911 ( 4.752 -7.372 4.269) 9.755 15.927 ( -12.521 17.141 -2.836) 21.416 17.613 ( -0.262 -0.187 0.622) 0.700 18.797 ( 27.736 -19.414 -46.572) 57.577 20.010 ( 7.802 0.274 -22.552) 23.865 21.228 ( 4.211 2.621 -8.107) 9.504 22.660 ( -20.799 1.820 60.600) 64.096 25.328 ( -0.359 22.408 25.238) 33.752 28.307 ( -0.739 -5.895 -10.763) 12.294 28.675 ( 2.999 -6.794 -11.707) 13.864 ======================= Grid point 153 (62/300) ======================= q-point: ( 0.55 0.18 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.260 ( 7.319 -8.055 -0.475) 10.894 2.485 ( 7.808 6.402 -2.791) 10.475 2.863 ( 1.048 -19.207 0.194) 19.237 3.352 ( -5.964 -9.159 -11.806) 16.089 3.681 ( -0.611 -16.036 7.726) 17.811 3.905 ( 10.075 4.722 -5.845) 12.569 4.097 ( 3.256 -1.436 -1.805) 3.990 4.688 ( -2.996 -9.351 5.472) 11.241 4.796 ( 4.897 3.215 -6.006) 8.390 5.371 ( -12.415 5.065 -0.282) 13.412 5.721 ( -3.735 3.391 3.323) 6.041 6.168 ( 2.142 -1.907 6.806) 7.386 6.339 ( 1.952 8.731 -3.093) 9.467 6.738 ( 2.711 3.096 3.898) 5.668 7.248 ( 4.844 1.632 0.697) 5.159 7.872 ( -1.681 -5.248 1.296) 5.661 7.944 ( -1.497 -13.512 -1.340) 13.661 8.845 ( -7.512 -7.013 4.118) 11.071 8.936 ( -1.031 9.246 6.641) 11.430 9.313 ( 11.983 -4.072 -6.004) 14.008 9.877 ( 0.549 -3.384 8.055) 8.755 10.188 ( -7.668 12.323 6.754) 16.008 10.892 ( -1.238 -2.111 -3.650) 4.395 11.174 ( -8.216 2.997 1.285) 8.840 11.415 ( 1.453 9.167 -1.599) 9.419 12.126 ( 3.933 9.006 -4.906) 10.984 12.955 ( 5.354 -0.588 6.280) 8.273 13.021 ( -3.561 1.377 -5.739) 6.893 13.475 ( 2.654 -6.298 -4.121) 7.981 13.747 ( -1.283 -0.982 4.236) 4.534 14.197 ( -0.324 -1.212 -0.794) 1.485 14.619 ( 2.044 -6.229 -7.574) 10.017 15.070 ( 4.877 -4.758 0.007) 6.814 15.582 ( -10.170 9.329 -4.214) 14.430 17.615 ( -0.378 -0.197 -3.065) 3.094 19.211 ( 21.055 -13.416 -36.098) 43.891 19.966 ( 7.966 4.445 -27.075) 28.570 21.189 ( 2.640 2.777 -9.588) 10.325 22.634 ( -15.525 -1.584 58.545) 60.590 25.000 ( -7.214 13.993 25.671) 30.114 28.391 ( 1.375 -4.984 -12.630) 13.647 28.756 ( 4.233 -1.459 -9.895) 10.861 ======================= Grid point 154 (63/300) ======================= q-point: (-0.36 0.18 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.285 ( 0.846 7.143 -0.636) 7.221 2.390 ( 2.958 7.703 -2.168) 8.531 3.132 ( -1.985 -8.789 -6.368) 11.034 3.483 ( -1.368 -10.088 -8.379) 13.185 3.774 ( -4.608 2.480 -0.106) 5.234 3.967 ( 10.024 -1.470 -0.510) 10.144 4.212 ( 10.926 -6.569 -15.610) 20.154 4.519 ( -1.717 11.820 -4.232) 12.672 5.045 ( 0.543 -13.774 9.373) 16.670 5.187 ( -9.716 6.462 -2.284) 11.890 5.702 ( -2.685 -4.210 6.905) 8.521 6.127 ( -2.647 7.320 3.943) 8.726 6.276 ( 4.099 -0.055 0.751) 4.167 6.670 ( -0.047 5.961 5.921) 8.401 7.254 ( 1.024 0.859 2.902) 3.195 7.887 ( 4.065 2.355 -1.793) 5.028 8.217 ( -6.942 -16.212 -0.877) 17.658 8.748 ( 2.220 11.115 0.122) 11.335 8.932 ( -5.531 -6.165 6.386) 10.459 9.400 ( 9.544 3.334 -0.156) 10.111 9.890 ( -1.722 2.411 5.634) 6.366 9.961 ( -6.732 4.050 9.260) 12.144 10.926 ( -3.397 -0.080 0.587) 3.448 11.242 ( 2.272 -10.400 -3.626) 11.246 11.283 ( -3.512 0.321 -2.116) 4.113 11.948 ( 3.441 11.515 -3.011) 12.389 12.980 ( -0.383 0.822 -0.703) 1.148 13.029 ( 2.036 -3.184 3.387) 5.075 13.568 ( 0.874 -2.204 -2.894) 3.741 13.778 ( 0.799 -2.236 3.163) 3.955 14.132 ( -2.754 5.671 -1.662) 6.519 14.723 ( 4.263 -2.694 -6.757) 8.431 15.104 ( -0.206 3.329 -5.002) 6.012 15.482 ( -0.572 -4.763 -7.814) 9.169 17.590 ( -0.971 1.904 -6.609) 6.946 19.441 ( 10.716 -3.588 -16.464) 19.969 19.921 ( 11.252 0.302 -39.750) 41.313 21.127 ( 1.927 3.396 -11.313) 11.968 22.688 ( -13.329 -3.897 58.457) 60.084 24.810 ( -8.106 4.914 23.844) 25.659 28.473 ( 2.971 -4.694 -13.481) 14.581 28.759 ( 2.971 2.083 -8.866) 9.579 ======================= Grid point 155 (64/300) ======================= q-point: (-0.27 0.18 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.079 ( 2.071 14.576 1.128) 14.765 2.217 ( -2.486 10.411 -3.139) 11.155 3.113 ( -0.076 7.542 -14.061) 15.957 3.625 ( 6.008 -1.471 -4.673) 7.752 3.673 ( -5.245 4.844 1.603) 7.317 3.962 ( 3.252 4.477 -8.645) 10.264 4.254 ( 0.168 8.031 2.391) 8.381 4.475 ( 6.509 -9.255 -12.024) 16.510 4.984 ( -6.094 7.818 -1.246) 9.991 5.277 ( -2.579 -10.115 9.010) 13.789 5.865 ( 1.908 -11.033 6.122) 12.761 5.996 ( -0.608 4.824 0.168) 4.865 6.296 ( -1.425 -0.366 5.182) 5.386 6.552 ( -2.713 6.037 5.878) 8.852 7.225 ( -1.962 2.516 2.822) 4.259 7.852 ( 4.558 3.671 -2.666) 6.431 8.362 ( 5.325 5.906 -3.863) 8.841 8.592 ( -10.385 -3.341 -0.158) 10.911 9.031 ( -3.257 -5.759 9.147) 11.289 9.322 ( 4.076 8.332 2.244) 9.543 9.917 ( -4.059 -1.163 6.708) 7.926 9.927 ( 1.434 -4.745 5.133) 7.136 10.929 ( -2.262 -3.485 1.223) 4.331 11.182 ( -1.336 3.053 0.726) 3.411 11.596 ( 3.679 -17.766 -7.129) 19.494 11.765 ( 2.125 8.420 -0.510) 8.699 12.970 ( -1.752 -0.356 0.733) 1.933 13.111 ( 1.574 -3.532 1.478) 4.140 13.561 ( -1.447 1.804 -1.391) 2.699 13.842 ( 2.156 -2.272 2.750) 4.168 13.971 ( -2.155 8.750 -2.223) 9.281 14.745 ( 3.070 1.798 -4.618) 5.830 14.972 ( 0.168 8.258 -8.643) 11.956 15.669 ( 3.986 -14.079 -10.336) 17.915 17.498 ( -0.491 6.027 -7.912) 9.958 19.479 ( 2.881 1.033 -1.411) 3.370 19.953 ( 10.620 -1.508 -50.333) 51.463 21.063 ( 3.126 2.722 -12.737) 13.394 22.780 ( -15.078 -5.545 61.162) 63.237 24.770 ( -5.440 -0.759 21.152) 21.853 28.561 ( 4.970 -3.781 -13.659) 15.019 28.701 ( -0.259 2.773 -8.307) 8.761 ======================= Grid point 156 (65/300) ======================= q-point: (-0.18 0.18 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.801 ( 3.270 17.829 5.843) 19.045 1.966 ( 0.032 14.329 -5.577) 15.376 2.841 ( 3.674 18.685 -17.326) 25.746 3.474 ( -6.899 11.996 3.089) 14.180 3.543 ( 4.039 13.093 0.454) 13.709 3.887 ( 2.630 7.295 1.322) 7.867 4.142 ( -3.475 1.586 3.212) 4.990 4.633 ( 0.199 -3.682 -7.598) 8.445 4.872 ( -1.035 -1.614 -5.110) 5.458 5.443 ( -0.011 -7.748 7.588) 10.845 5.954 ( 2.477 0.039 -3.276) 4.107 6.084 ( 2.049 -7.526 4.587) 9.049 6.326 ( -4.639 -5.948 7.425) 10.585 6.448 ( -3.500 3.413 4.313) 6.519 7.147 ( -2.248 4.355 0.971) 4.996 7.821 ( 3.188 2.892 -1.176) 4.462 8.099 ( 5.960 18.894 -2.903) 20.024 8.708 ( -8.543 -11.664 -2.586) 14.688 9.101 ( -3.587 -1.146 8.924) 9.686 9.212 ( 2.134 5.275 4.699) 7.380 9.861 ( 1.095 5.802 -2.560) 6.436 10.123 ( -2.738 -12.806 9.955) 16.450 11.026 ( 3.744 -5.394 -0.426) 6.580 11.144 ( -2.438 -0.075 2.240) 3.312 11.658 ( 1.255 0.676 1.357) 1.968 11.950 ( 2.963 -15.983 -6.458) 17.491 12.965 ( -3.374 -0.810 0.939) 3.594 13.186 ( 1.312 -3.515 -1.641) 4.095 13.490 ( -2.054 3.900 -2.060) 4.866 13.792 ( -0.324 8.262 -0.753) 8.303 13.887 ( 2.402 0.082 2.516) 3.479 14.696 ( 3.183 4.989 -3.539) 6.896 14.795 ( 0.719 8.919 -7.285) 11.538 16.000 ( 5.322 -19.599 -12.800) 24.006 17.346 ( 0.278 8.330 -5.673) 10.082 19.482 ( -0.082 -0.048 2.699) 2.700 19.883 ( 5.359 6.386 -56.490) 57.102 21.037 ( 5.401 0.800 -12.730) 13.852 22.898 ( -19.922 -8.880 67.221) 70.672 24.806 ( -2.073 -1.694 20.201) 20.378 28.561 ( 3.259 5.071 -9.568) 11.308 28.705 ( -0.341 -5.508 -12.225) 13.413 ======================= Grid point 157 (66/300) ======================= q-point: (-0.09 0.18 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.470 ( 4.053 21.756 9.137) 23.943 1.663 ( 7.478 20.630 -6.266) 22.821 2.478 ( 5.642 19.120 -11.717) 23.123 3.128 ( -9.887 20.916 17.572) 29.051 3.287 ( 2.809 14.235 -3.271) 14.874 3.684 ( 0.267 15.312 13.801) 20.615 4.156 ( -0.745 -2.818 -2.311) 3.720 4.604 ( -6.656 0.923 -1.702) 6.932 4.975 ( 2.370 -7.118 -10.631) 13.011 5.598 ( 1.586 -6.676 5.250) 8.640 6.008 ( 3.077 -4.219 -6.761) 8.543 6.184 ( -4.647 -4.433 10.154) 12.015 6.401 ( -0.485 -0.171 3.457) 3.495 6.473 ( 0.437 -7.912 1.462) 8.058 7.046 ( -0.649 4.923 1.019) 5.069 7.645 ( -0.593 16.637 3.462) 17.004 7.963 ( 4.208 -1.251 -2.344) 4.976 8.860 ( -0.153 -8.519 -5.849) 10.335 9.006 ( -3.251 7.361 0.937) 8.101 9.188 ( -2.642 1.613 9.151) 9.660 9.677 ( -2.844 12.297 -5.921) 13.942 10.385 ( -0.863 -14.787 12.116) 19.137 11.131 ( 0.926 -1.127 3.201) 3.517 11.167 ( 6.470 -3.005 -0.070) 7.134 11.770 ( -3.008 -12.276 2.035) 12.801 12.219 ( 1.415 -12.196 -6.457) 13.872 12.955 ( -4.855 -1.189 0.005) 4.998 13.252 ( 2.881 -2.068 -4.555) 5.773 13.391 ( -3.014 3.679 -3.118) 5.687 13.676 ( 5.663 5.728 1.022) 8.120 13.883 ( 0.017 1.372 1.195) 1.820 14.585 ( 7.922 9.566 -6.124) 13.848 14.654 ( -3.129 4.787 0.300) 5.727 16.409 ( 4.439 -22.095 -15.605) 27.412 17.200 ( 2.784 6.813 -2.120) 7.659 19.354 ( -20.748 14.293 -21.458) 33.094 19.661 ( 18.129 9.488 -38.711) 43.786 21.065 ( 6.882 -1.167 -11.447) 13.407 23.078 ( -28.245 -15.818 74.358) 81.099 24.882 ( 4.375 -2.905 23.163) 23.751 28.459 ( 0.296 5.017 -7.720) 9.212 28.773 ( -0.485 -3.279 -15.233) 15.590 ======================= Grid point 161 (67/300) ======================= q-point: ( 0.27 0.27 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.060 ( 9.209 0.000 22.186) 24.021 1.369 ( 4.915 0.000 26.181) 26.638 2.056 ( 26.726 0.000 13.292) 29.848 2.868 ( 12.421 0.000 -0.615) 12.436 2.961 ( -4.584 -0.000 12.555) 13.366 3.115 ( 12.381 0.000 20.898) 24.291 4.172 ( 1.735 0.000 -3.559) 3.959 4.536 ( -1.932 -0.000 1.757) 2.611 5.140 ( -1.676 -0.000 -5.636) 5.880 5.667 ( -4.362 -0.000 -0.458) 4.386 6.047 ( -4.230 -0.000 -7.040) 8.213 6.120 ( -1.099 -0.000 -6.568) 6.660 6.497 ( -12.777 -0.000 20.017) 23.747 6.597 ( 0.911 0.000 -6.772) 6.833 7.085 ( -4.720 -0.000 4.635) 6.615 7.564 ( 19.324 0.000 -4.610) 19.866 7.768 ( -10.705 -0.000 -2.111) 10.911 7.969 ( -1.324 -0.000 8.656) 8.757 8.357 ( -11.161 -0.000 5.124) 12.281 9.380 ( -6.759 -0.000 22.825) 23.805 9.939 ( 25.648 0.000 -7.817) 26.812 11.010 ( -1.502 -0.000 0.663) 1.642 11.247 ( -7.867 -0.000 2.120) 8.148 11.920 ( -5.580 -0.000 11.961) 13.199 11.977 ( 2.942 0.000 -4.911) 5.725 12.285 ( -5.761 -0.000 -5.407) 7.901 12.920 ( 2.813 0.000 -7.274) 7.799 12.949 ( 3.261 0.000 -0.920) 3.388 13.445 ( 3.953 0.000 -6.400) 7.522 13.729 ( -3.569 -0.000 8.718) 9.420 13.817 ( -14.955 -0.000 8.684) 17.294 14.329 ( 1.180 0.000 7.418) 7.511 14.509 ( -10.494 -0.000 4.879) 11.573 16.869 ( 28.616 0.000 -61.332) 67.679 17.162 ( 1.037 0.000 8.031) 8.098 18.131 ( 42.816 0.000 -45.925) 62.788 19.612 ( 5.173 0.000 4.136) 6.623 21.350 ( 5.247 0.000 -6.236) 8.150 22.913 ( -34.337 -0.000 70.506) 78.423 27.058 ( -0.229 -0.000 2.112) 2.125 27.485 ( 10.623 0.000 -0.041) 10.623 28.113 ( -6.603 -0.000 -6.646) 9.369 ======================= Grid point 162 (68/300) ======================= q-point: ( 0.36 0.27 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.184 ( 11.288 -8.319 12.616) 18.862 1.691 ( 4.210 -19.952 19.665) 28.329 2.368 ( 14.350 -12.896 13.318) 23.444 2.862 ( 13.565 7.776 8.680) 17.883 2.983 ( -2.015 -5.098 1.265) 5.626 3.419 ( 13.835 -13.477 20.124) 27.893 4.171 ( -0.638 -0.277 -3.028) 3.106 4.463 ( -3.670 5.719 1.830) 7.038 5.084 ( -0.075 2.966 -6.606) 7.242 5.646 ( -2.667 -1.089 -0.297) 2.896 5.852 ( -10.727 6.967 -3.461) 13.251 6.311 ( 7.906 -5.176 -6.434) 11.432 6.476 ( -10.755 -5.742 9.545) 15.484 6.607 ( -0.822 -2.227 -2.717) 3.608 7.117 ( -4.596 -6.345 4.003) 8.798 7.565 ( 9.335 7.662 -3.435) 12.556 7.773 ( -0.170 -4.571 0.747) 4.634 8.110 ( -3.304 -13.703 0.955) 14.128 8.363 ( -10.989 -8.041 7.116) 15.364 9.372 ( -6.935 -0.026 22.450) 23.496 9.992 ( 23.389 10.725 -7.266) 26.737 10.982 ( -4.484 7.454 -0.332) 8.705 11.082 ( -4.358 5.041 4.417) 7.995 11.714 ( -2.727 9.935 2.611) 10.629 12.131 ( 0.102 -3.749 -0.622) 3.802 12.169 ( -3.229 5.715 -6.667) 9.356 12.957 ( 5.357 0.212 1.716) 5.630 13.058 ( 3.236 -8.697 -5.818) 10.953 13.379 ( -2.419 7.040 -6.488) 9.875 13.695 ( -5.281 0.246 5.646) 7.734 13.765 ( -5.398 -2.926 5.099) 7.981 14.348 ( -1.563 -2.431 0.984) 3.053 14.574 ( -6.044 -9.725 10.575) 15.586 16.697 ( 7.502 19.602 -21.399) 29.974 17.362 ( -3.359 -13.073 -5.104) 14.430 18.364 ( 48.597 -1.834 -52.534) 71.588 19.759 ( 4.654 -9.728 -3.795) 11.432 21.347 ( 4.512 2.663 -6.649) 8.465 22.777 ( -28.378 3.095 68.965) 74.640 26.505 ( 8.216 38.164 12.297) 40.929 28.010 ( -0.195 -23.359 -6.743) 24.313 28.114 ( -2.597 -9.550 -7.973) 12.709 ======================= Grid point 163 (69/300) ======================= q-point: ( 0.45 0.27 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.581 ( 12.441 -21.614 -0.214) 24.939 2.122 ( 1.329 -19.741 12.554) 23.432 2.658 ( 6.858 -4.074 8.571) 11.709 2.940 ( 12.995 -7.337 4.266) 15.521 3.094 ( -4.804 -9.180 3.089) 10.812 3.796 ( 12.573 -11.288 16.391) 23.541 4.182 ( -0.966 -2.370 -0.833) 2.692 4.311 ( -5.070 5.354 1.325) 7.491 5.020 ( 1.722 3.472 -8.813) 9.627 5.601 ( -10.445 6.016 4.173) 12.755 5.719 ( -2.923 -2.767 -5.826) 7.081 6.274 ( 0.801 6.724 5.586) 8.778 6.538 ( -0.308 -0.315 -3.271) 3.301 6.701 ( 1.793 -5.921 -1.912) 6.475 7.245 ( -5.846 -9.187 2.576) 11.190 7.508 ( 9.239 3.263 -4.117) 10.628 7.854 ( 3.156 -1.842 1.665) 4.015 8.387 ( -8.168 -17.529 -2.735) 19.531 8.553 ( -7.331 -19.610 6.604) 21.953 9.356 ( -3.793 1.602 19.422) 19.853 9.900 ( 17.438 11.691 -4.631) 21.500 10.689 ( -6.089 14.542 2.859) 16.022 11.042 ( -2.936 2.539 0.773) 3.958 11.492 ( -6.519 10.801 1.262) 12.679 11.925 ( 4.639 15.902 -4.365) 17.131 12.228 ( -0.455 -4.130 -6.099) 7.380 12.984 ( 5.938 1.945 4.742) 7.844 13.160 ( -2.932 3.905 -5.253) 7.172 13.249 ( -0.598 -3.796 -3.175) 4.985 13.698 ( -1.520 -1.732 2.558) 3.443 13.877 ( -0.710 -10.595 -0.854) 10.653 14.403 ( -3.507 -5.081 -2.525) 6.670 14.760 ( -2.969 -10.802 11.893) 16.338 16.261 ( -1.226 24.831 -8.501) 26.275 17.506 ( -7.591 -7.774 -0.111) 10.866 18.719 ( 45.659 -8.729 -49.764) 68.099 19.942 ( 2.178 -7.423 -13.277) 15.366 21.302 ( 3.819 3.622 -8.309) 9.835 22.656 ( -22.386 2.557 65.731) 69.485 25.908 ( 3.313 33.481 19.360) 38.817 28.156 ( -1.839 -7.494 -8.773) 11.683 28.461 ( 2.799 -16.296 -9.424) 19.032 ======================= Grid point 164 (70/300) ======================= q-point: ( 0.55 0.27 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.069 ( 10.779 -19.425 -3.995) 22.571 2.444 ( -4.257 -13.657 1.489) 14.382 2.739 ( 13.201 1.000 7.933) 15.433 3.121 ( -5.588 -7.891 -10.316) 14.139 3.356 ( -1.076 -18.046 11.974) 21.684 3.999 ( 6.445 -3.206 0.282) 7.204 4.123 ( -0.357 5.442 1.199) 5.584 4.428 ( 1.399 -14.724 10.342) 18.047 4.932 ( 3.156 6.145 -11.409) 13.337 5.393 ( -11.412 7.081 1.806) 13.551 5.748 ( -2.231 -0.271 -0.464) 2.295 6.197 ( 2.566 2.352 5.070) 6.150 6.484 ( 0.236 5.414 -1.849) 5.726 6.774 ( 1.530 -0.822 0.612) 1.841 7.324 ( 1.970 -0.428 -1.229) 2.361 7.602 ( 1.312 -9.421 -1.286) 9.598 7.903 ( 2.848 -1.456 0.945) 3.335 8.598 ( -9.301 -12.670 2.881) 15.979 8.901 ( -6.159 -14.562 5.586) 16.769 9.354 ( 9.037 0.485 3.862) 9.839 9.847 ( 6.132 1.838 4.310) 7.717 10.395 ( -6.475 13.541 3.270) 15.362 10.915 ( -4.003 6.257 -2.591) 7.867 11.254 ( -6.104 9.479 1.689) 11.400 11.656 ( 3.902 14.549 -2.623) 15.290 12.245 ( 1.831 2.138 -7.113) 7.650 12.963 ( -2.214 2.048 -1.659) 3.443 13.079 ( 4.878 2.581 1.953) 5.854 13.363 ( 1.956 -6.711 -1.124) 7.080 13.724 ( -1.105 -1.231 2.992) 3.419 14.085 ( -0.506 -10.000 -3.274) 10.535 14.481 ( -1.201 -6.730 -7.447) 10.109 14.955 ( -2.355 -9.493 9.120) 13.373 15.794 ( -3.684 20.448 -4.747) 21.313 17.567 ( -4.387 -3.730 -0.510) 5.781 19.116 ( 36.304 -10.120 -43.266) 57.379 20.002 ( 0.978 -0.998 -18.382) 18.435 21.243 ( 2.423 3.262 -10.702) 11.447 22.604 ( -16.995 -0.184 62.759) 65.020 25.375 ( -4.805 26.290 23.478) 35.573 28.275 ( 1.581 -6.633 -10.727) 12.711 28.689 ( 3.984 -7.606 -8.920) 12.381 ======================= Grid point 165 (71/300) ======================= q-point: ( 0.64 0.27 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.327 ( 2.457 -3.011 -0.291) 3.897 2.559 ( 3.945 2.707 -5.872) 7.575 2.894 ( 1.893 -11.687 3.395) 12.317 3.226 ( -4.891 -11.142 -11.346) 16.637 3.651 ( -4.237 -11.259 6.123) 13.498 4.043 ( 7.572 1.802 -3.716) 8.625 4.140 ( 3.940 -6.130 -3.899) 8.265 4.657 ( -1.751 -0.155 -1.401) 2.248 4.864 ( 4.548 -3.752 3.884) 7.060 5.208 ( -7.164 4.923 -3.466) 9.358 5.695 ( -2.476 2.553 4.960) 6.103 6.212 ( 0.267 1.367 6.986) 7.124 6.361 ( 2.935 6.250 -3.870) 7.915 6.760 ( -1.684 2.763 4.581) 5.609 7.316 ( 4.356 3.148 0.237) 5.379 7.826 ( -4.118 -14.877 -0.307) 15.439 7.954 ( 2.490 -1.736 -1.333) 3.316 8.752 ( -6.832 -9.622 4.621) 12.673 8.936 ( -2.467 5.243 8.130) 9.983 9.477 ( 13.667 -1.972 -7.364) 15.649 9.922 ( 0.997 -3.647 10.420) 11.085 10.069 ( -11.545 14.971 4.958) 19.544 10.876 ( 1.657 -4.788 -5.252) 7.297 11.075 ( -5.998 3.598 1.634) 7.183 11.442 ( 2.481 10.571 -0.806) 10.888 12.146 ( 1.326 8.115 -5.493) 9.888 12.916 ( -5.239 -0.909 -4.841) 7.191 13.100 ( 8.037 1.815 7.309) 11.014 13.504 ( 3.047 -5.789 -2.687) 7.072 13.742 ( -1.515 -1.577 3.745) 4.337 14.165 ( -2.727 -0.460 -2.578) 3.781 14.629 ( 3.675 -8.766 -11.180) 14.675 15.073 ( -6.051 -3.977 2.659) 7.714 15.493 ( 1.145 8.230 -5.114) 9.757 17.587 ( -1.109 -0.893 -3.363) 3.651 19.423 ( 23.720 -5.947 -31.194) 39.637 19.957 ( 3.653 2.248 -26.485) 26.831 21.177 ( 1.103 3.008 -12.434) 12.840 22.631 ( -13.930 -2.567 60.315) 61.956 24.975 ( -8.247 15.222 24.879) 30.310 28.381 ( 3.246 -5.131 -12.175) 13.605 28.781 ( 3.777 -1.174 -8.606) 9.471 ======================= Grid point 166 (72/300) ======================= q-point: (-0.27 0.27 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.299 ( 1.017 5.885 0.740) 6.018 2.409 ( 0.628 11.530 -2.679) 11.854 3.095 ( 0.614 -6.164 -7.396) 9.647 3.445 ( 0.688 -14.622 -9.524) 17.464 3.708 ( -3.620 0.467 -0.708) 3.718 4.066 ( 3.804 2.454 -2.382) 5.116 4.316 ( 8.684 -8.106 -10.895) 16.119 4.470 ( -2.645 11.277 -4.794) 12.536 5.029 ( -7.204 -3.297 5.004) 9.371 5.121 ( 3.527 -1.810 0.665) 4.020 5.716 ( 0.511 -5.624 8.372) 10.099 6.110 ( -1.853 7.125 4.197) 8.474 6.326 ( 2.462 1.829 0.359) 3.088 6.665 ( -3.393 6.023 6.132) 9.240 7.273 ( 0.260 3.394 2.902) 4.473 7.947 ( 4.270 2.713 -1.845) 5.385 8.112 ( -5.910 -17.336 -2.525) 18.489 8.781 ( 2.048 11.952 1.994) 12.289 8.891 ( -3.315 -8.194 6.404) 10.915 9.516 ( 6.589 7.753 -2.370) 10.447 9.787 ( -11.168 1.471 6.668) 13.091 9.988 ( 2.026 -0.063 9.403) 9.619 10.887 ( -1.586 1.700 -0.157) 2.330 11.236 ( 2.238 -17.722 -4.524) 18.427 11.292 ( 1.478 5.835 0.556) 6.045 11.964 ( 0.216 10.572 -3.285) 11.072 12.904 ( -5.241 -2.398 -3.815) 6.912 13.135 ( 6.055 1.312 7.353) 9.615 13.571 ( 0.669 -0.310 -2.178) 2.299 13.795 ( -0.266 -3.767 3.293) 5.011 14.092 ( -1.161 5.226 -3.401) 6.342 14.753 ( 2.956 -2.547 -7.462) 8.420 15.039 ( -4.967 1.137 -6.400) 8.180 15.489 ( 4.637 -5.020 -7.186) 9.917 17.570 ( 1.676 2.270 -6.626) 7.202 19.538 ( 8.186 1.722 -8.579) 11.982 19.922 ( 9.362 -0.348 -44.872) 45.840 21.110 ( 1.711 2.582 -12.819) 13.188 22.693 ( -14.665 -3.549 58.975) 60.875 24.789 ( -6.247 4.061 23.612) 24.760 28.478 ( 4.024 -4.938 -12.863) 14.354 28.764 ( 2.163 3.326 -8.872) 9.719 ======================= Grid point 167 (73/300) ======================= q-point: (-0.18 0.27 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.138 ( 4.089 13.326 4.162) 14.547 2.199 ( 1.881 10.757 -3.519) 11.474 3.088 ( 4.310 6.904 -15.186) 17.230 3.557 ( -7.506 2.558 -2.408) 8.288 3.733 ( 7.748 -1.903 -1.914) 8.204 3.962 ( 1.451 6.104 -14.049) 15.386 4.222 ( -5.669 8.814 6.009) 12.080 4.542 ( 6.798 -8.412 -9.909) 14.669 4.906 ( -2.858 7.522 -1.931) 8.275 5.286 ( -1.044 -9.777 10.127) 14.115 5.898 ( -0.269 -7.942 4.521) 9.143 6.027 ( 4.672 0.135 0.702) 4.726 6.282 ( -3.415 2.542 6.056) 7.402 6.534 ( -2.266 6.151 5.356) 8.465 7.206 ( -1.863 3.549 2.467) 4.707 7.901 ( 2.373 3.580 -0.825) 4.373 8.390 ( -0.526 -15.020 -5.455) 15.989 8.507 ( 0.825 18.609 -0.957) 18.652 9.022 ( -2.356 -5.942 9.038) 11.070 9.344 ( -2.263 7.919 2.780) 8.692 9.850 ( -5.253 -7.912 6.040) 11.255 10.011 ( 4.510 0.577 6.557) 7.979 10.904 ( -1.313 -4.981 0.005) 5.151 11.192 ( 1.892 4.272 1.598) 4.937 11.629 ( 3.993 -19.382 -5.594) 20.565 11.767 ( -1.536 8.937 -0.921) 9.115 12.908 ( -4.889 -2.080 -1.879) 5.635 13.162 ( 2.315 -0.155 3.839) 4.486 13.544 ( 0.019 2.686 -2.085) 3.401 13.841 ( -3.345 -0.459 2.296) 4.083 13.986 ( 5.037 5.485 -1.458) 7.588 14.751 ( -0.417 1.680 -3.443) 3.853 14.952 ( 2.245 6.065 -10.231) 12.103 15.683 ( 2.638 -14.025 -9.634) 17.219 17.495 ( 4.006 6.549 -8.281) 11.293 19.510 ( 0.353 2.654 3.166) 4.146 19.901 ( 8.553 1.403 -55.966) 56.633 21.071 ( 4.007 1.264 -11.952) 12.669 22.755 ( -17.634 -4.464 59.879) 62.581 24.785 ( -3.086 -1.918 21.975) 22.273 28.581 ( 3.791 -5.442 -13.222) 14.792 28.672 ( 0.917 5.623 -9.198) 10.820 ======================= Grid point 168 (74/300) ======================= q-point: (-0.09 0.27 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.893 ( 5.635 17.705 5.749) 19.450 2.021 ( 9.821 12.037 -2.214) 15.692 2.847 ( 6.151 18.384 -19.495) 27.493 3.393 ( -5.814 9.586 6.950) 13.191 3.585 ( 2.869 16.306 -6.649) 17.841 3.937 ( 1.969 6.512 3.687) 7.738 4.087 ( -4.335 -1.535 0.839) 4.674 4.625 ( 1.200 4.282 -2.483) 5.094 4.836 ( -0.799 -5.722 -7.378) 9.371 5.479 ( 0.877 -8.697 8.457) 12.163 5.945 ( -1.898 -2.294 -1.778) 3.468 6.123 ( 0.494 -1.097 0.755) 1.420 6.316 ( -0.483 -8.480 7.017) 11.017 6.446 ( 1.950 3.002 4.404) 5.675 7.128 ( -0.831 4.031 0.768) 4.187 7.856 ( 1.733 3.783 0.574) 4.201 8.133 ( -1.300 18.646 -0.124) 18.692 8.646 ( 3.315 -12.625 -7.380) 14.995 9.077 ( -3.872 0.638 6.833) 7.880 9.228 ( -2.580 3.604 7.057) 8.333 9.863 ( -0.087 6.316 -0.894) 6.379 10.140 ( 0.726 -11.053 9.055) 14.307 11.029 ( -3.273 -8.205 1.640) 8.985 11.178 ( 5.510 -0.556 0.855) 5.604 11.640 ( -4.590 1.170 1.432) 4.948 11.971 ( 3.424 -15.040 -5.947) 16.531 12.900 ( -4.778 -1.036 -0.137) 4.891 13.197 ( -0.116 -2.802 -1.350) 3.113 13.465 ( 0.113 5.182 -4.090) 6.603 13.781 ( -1.785 3.131 1.970) 4.107 13.961 ( 6.917 3.616 1.568) 7.961 14.692 ( -1.879 3.158 -1.315) 3.903 14.818 ( 6.040 9.017 -8.530) 13.804 15.996 ( -0.598 -19.822 -10.025) 22.221 17.372 ( 6.686 8.205 -6.932) 12.652 19.418 ( -9.186 7.464 -5.782) 13.173 19.811 ( 12.489 3.663 -51.853) 53.462 21.079 ( 5.945 -0.297 -10.399) 11.982 22.824 ( -21.663 -6.719 63.128) 67.079 24.869 ( 0.007 -4.171 22.595) 22.977 28.547 ( -0.954 5.631 -8.950) 10.617 28.681 ( 3.776 -4.334 -14.156) 15.278 ======================= Grid point 173 (75/300) ======================= q-point: ( 0.36 0.36 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.256 ( 7.436 0.000 21.407) 22.662 1.480 ( -1.029 -0.000 21.324) 21.349 2.371 ( 11.041 0.000 13.739) 17.626 2.919 ( -4.091 -0.000 4.311) 5.943 3.083 ( 13.217 0.000 10.795) 17.065 3.414 ( 19.488 0.000 15.665) 25.003 4.150 ( -3.838 -0.000 -2.063) 4.358 4.500 ( -3.664 -0.000 1.329) 3.898 5.105 ( -0.211 -0.000 -6.379) 6.382 5.618 ( -2.886 -0.000 1.416) 3.215 5.971 ( -3.292 -0.000 -5.190) 6.146 6.053 ( -5.204 -0.000 -1.782) 5.501 6.439 ( -3.582 -0.000 11.130) 11.692 6.587 ( 0.957 0.000 -6.516) 6.586 7.032 ( -4.227 -0.000 2.587) 4.956 7.619 ( -8.034 -0.000 -4.251) 9.090 7.800 ( 15.256 0.000 0.316) 15.260 7.979 ( -1.970 -0.000 7.453) 7.709 8.227 ( -9.686 -0.000 7.632) 12.332 9.355 ( -7.824 -0.000 22.383) 23.712 10.259 ( 23.034 0.000 -7.104) 24.105 11.000 ( -0.366 -0.000 -0.667) 0.761 11.127 ( -10.097 -0.000 1.732) 10.244 11.859 ( -7.104 -0.000 4.613) 8.471 11.912 ( -7.790 -0.000 -3.983) 8.749 12.276 ( 4.792 0.000 -4.222) 6.387 12.965 ( 7.076 0.000 -6.384) 9.530 13.036 ( 8.466 0.000 0.661) 8.492 13.445 ( -0.875 -0.000 -6.816) 6.872 13.623 ( -15.748 -0.000 5.952) 16.836 13.726 ( -0.901 -0.000 7.566) 7.619 14.369 ( 1.004 0.000 4.856) 4.959 14.388 ( -9.031 -0.000 6.484) 11.118 16.973 ( 12.662 0.000 -35.472) 37.664 17.198 ( 0.116 0.000 7.656) 7.657 18.573 ( 43.156 0.000 -56.112) 70.789 19.688 ( 3.303 0.000 4.441) 5.535 21.390 ( 3.610 0.000 -6.824) 7.720 22.736 ( -25.992 -0.000 71.856) 76.412 27.073 ( 1.116 0.000 2.889) 3.097 27.648 ( 11.625 0.000 1.407) 11.710 27.990 ( -7.021 -0.000 -7.170) 10.035 ======================= Grid point 174 (76/300) ======================= q-point: ( 0.45 0.36 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.363 ( 7.715 -8.588 11.285) 16.144 1.757 ( -3.621 -20.251 18.900) 27.937 2.534 ( 3.256 -8.598 13.315) 16.181 2.935 ( -5.510 -4.430 4.157) 8.201 3.111 ( 15.382 6.436 8.348) 18.647 3.697 ( 13.133 -10.701 15.740) 23.125 4.121 ( -4.125 -1.306 -1.505) 4.581 4.415 ( -3.485 6.121 1.143) 7.135 5.073 ( 1.518 2.230 -5.765) 6.365 5.614 ( -2.226 -1.015 0.956) 2.627 5.716 ( -6.061 9.154 -2.254) 11.207 6.351 ( -10.094 -11.175 7.573) 16.856 6.410 ( 8.210 -2.729 -4.768) 9.879 6.599 ( 1.134 -2.469 -4.234) 5.031 7.063 ( -4.062 -5.741 1.859) 7.274 7.560 ( -2.167 0.090 -6.092) 6.467 7.900 ( 11.274 0.685 2.009) 11.472 8.061 ( -4.305 -9.845 2.835) 11.113 8.259 ( -7.127 -8.758 10.947) 15.727 9.345 ( -7.573 -0.874 22.210) 23.482 10.277 ( 20.003 12.383 -6.357) 24.369 10.887 ( -8.840 11.228 0.221) 14.292 11.047 ( -2.490 -0.125 0.187) 2.500 11.636 ( -7.039 9.766 -0.078) 12.038 12.049 ( -4.825 -10.294 -5.627) 12.685 12.211 ( 5.008 9.520 -2.495) 11.042 13.059 ( 7.531 -1.995 1.521) 7.938 13.120 ( 7.330 -3.525 -2.662) 8.558 13.285 ( -7.633 9.043 -4.002) 12.492 13.614 ( -6.512 -5.794 -0.410) 8.726 13.748 ( -0.769 -2.184 5.671) 6.125 14.308 ( -3.674 -1.146 -0.146) 3.851 14.538 ( -4.562 -11.135 11.206) 16.443 16.740 ( 7.697 23.175 -16.127) 29.264 17.306 ( -2.959 -7.626 -0.761) 8.215 18.835 ( 43.300 -5.555 -52.758) 68.477 19.783 ( -0.109 -6.745 -0.774) 6.791 21.374 ( 2.958 2.674 -8.415) 9.312 22.664 ( -22.046 2.223 71.886) 75.224 26.624 ( 2.961 35.666 10.095) 37.186 27.986 ( -0.714 -7.592 -5.270) 9.269 28.093 ( 3.284 -22.934 -5.262) 23.758 ======================= Grid point 175 (77/300) ======================= q-point: ( 0.55 0.36 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.728 ( 8.145 -21.264 -0.879) 22.788 2.125 ( -6.214 -18.313 13.001) 23.302 2.744 ( 0.993 -9.424 8.577) 12.782 2.986 ( -8.242 -3.881 -1.332) 9.207 3.171 ( 12.612 -2.743 10.335) 16.535 3.906 ( -6.030 -5.990 6.036) 10.425 4.227 ( -0.646 -5.962 5.004) 7.810 4.271 ( 7.394 3.381 4.315) 9.205 5.025 ( 2.878 3.643 -7.383) 8.722 5.485 ( -5.267 8.579 3.020) 10.510 5.684 ( -0.843 -3.795 -4.562) 5.993 6.278 ( -3.425 4.037 6.566) 8.434 6.527 ( 0.597 0.032 -2.995) 3.054 6.735 ( 3.947 -6.103 -2.865) 7.812 7.182 ( -3.396 -9.103 1.144) 9.783 7.575 ( 4.270 -1.595 -8.420) 9.575 7.924 ( 3.709 1.707 2.636) 4.860 8.275 ( -6.652 -15.006 0.651) 16.428 8.516 ( -1.164 -19.439 9.217) 21.545 9.367 ( -4.054 -2.565 20.720) 21.268 10.108 ( 13.080 15.815 -3.699) 20.854 10.595 ( -7.809 12.585 0.460) 14.818 10.993 ( -3.692 4.303 -2.655) 6.261 11.407 ( -4.562 10.134 0.053) 11.113 11.974 ( 3.738 15.514 -3.786) 16.401 12.197 ( -0.628 -5.885 -7.603) 9.635 13.027 ( -3.667 7.286 -1.651) 8.322 13.156 ( 6.050 0.627 3.042) 6.801 13.256 ( 1.850 -5.843 0.429) 6.144 13.686 ( -0.905 -3.249 -0.893) 3.489 13.858 ( -1.359 -10.572 -0.603) 10.676 14.343 ( -2.689 -5.011 -4.893) 7.502 14.740 ( -5.800 -11.610 12.923) 18.315 16.256 ( 3.973 28.525 -7.861) 29.854 17.421 ( -4.005 -7.450 -0.790) 8.495 19.175 ( 41.485 -6.723 -47.099) 63.123 19.884 ( -5.342 -6.146 -7.216) 10.880 21.310 ( 2.082 4.044 -11.513) 12.379 22.610 ( -17.002 1.413 69.867) 71.920 25.968 ( -3.565 35.552 16.472) 39.345 28.127 ( 1.919 -8.570 -7.678) 11.665 28.489 ( 4.673 -15.829 -6.052) 17.580 ======================= Grid point 176 (78/300) ======================= q-point: (-0.36 -0.64 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.170 ( 5.143 -17.614 -4.835) 18.976 2.380 ( -6.172 -13.766 3.756) 15.547 2.886 ( 0.128 1.699 6.958) 7.164 2.981 ( -5.465 -9.283 -8.525) 13.738 3.413 ( 4.231 -12.479 9.325) 16.142 3.988 ( -5.452 -8.659 -0.027) 10.233 4.118 ( -2.382 4.438 -0.340) 5.048 4.541 ( 6.991 -10.176 11.917) 17.159 4.945 ( 3.012 5.415 -7.897) 10.038 5.307 ( 0.671 8.328 -0.160) 8.357 5.710 ( -2.995 -0.189 -0.828) 3.113 6.236 ( -0.022 0.281 5.071) 5.079 6.478 ( 0.096 4.610 -1.499) 4.848 6.785 ( -0.384 1.011 1.243) 1.647 7.332 ( 0.639 -6.664 -0.895) 6.754 7.622 ( 2.195 -2.768 -4.775) 5.940 7.940 ( 0.941 -1.544 2.128) 2.792 8.498 ( -5.421 -13.157 2.841) 14.511 8.857 ( -2.751 -12.372 6.276) 14.143 9.493 ( 7.799 -6.772 9.198) 13.831 9.929 ( 2.247 7.040 3.948) 8.379 10.296 ( -7.452 14.607 -0.205) 16.399 10.866 ( -0.907 4.057 -4.807) 6.356 11.195 ( -2.785 10.032 0.915) 10.452 11.697 ( 2.699 14.863 -1.508) 15.181 12.227 ( -0.646 1.135 -8.827) 8.923 12.892 ( -4.404 3.088 -3.470) 6.401 13.201 ( 8.065 1.245 6.107) 10.192 13.396 ( 2.720 -7.250 1.640) 7.916 13.713 ( -1.932 -1.018 1.750) 2.798 14.051 ( -2.040 -9.129 -4.460) 10.363 14.448 ( 1.240 -8.942 -11.159) 14.353 14.907 ( -8.387 -8.636 9.662) 15.436 15.789 ( 4.535 21.529 -4.328) 22.423 17.516 ( -1.961 -5.053 -1.747) 5.695 19.474 ( 33.238 -4.050 -38.804) 51.254 19.909 ( -6.150 -3.202 -14.503) 16.075 21.221 ( 0.787 3.850 -14.613) 15.132 22.615 ( -12.908 -0.443 66.631) 67.872 25.356 ( -8.572 27.392 21.181) 35.671 28.279 ( 3.888 -6.674 -9.673) 12.378 28.724 ( 4.784 -7.075 -6.728) 10.873 ======================= Grid point 177 (79/300) ======================= q-point: (-0.27 -0.64 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.333 ( -1.724 -2.077 0.090) 2.701 2.532 ( -5.067 0.149 -4.873) 7.031 2.907 ( -1.793 -11.130 0.986) 11.316 3.184 ( 5.309 -11.800 -11.891) 17.574 3.634 ( -0.264 -6.354 4.020) 7.524 4.067 ( -2.538 -1.636 -0.240) 3.029 4.157 ( -0.612 -10.484 -1.953) 10.682 4.635 ( 0.903 5.839 -8.468) 10.326 4.908 ( -2.793 -2.806 11.542) 12.202 5.218 ( 11.179 4.947 -6.071) 13.649 5.678 ( -2.330 -0.214 4.451) 5.028 6.218 ( -2.651 4.042 6.875) 8.404 6.392 ( 2.818 3.680 -3.122) 5.589 6.728 ( -4.900 3.256 5.175) 7.836 7.366 ( 2.130 3.935 1.363) 4.677 7.769 ( -2.840 -14.020 -3.074) 14.632 7.982 ( 1.247 -1.223 -0.210) 1.759 8.701 ( -1.970 -10.880 3.600) 11.628 8.930 ( -2.052 2.088 7.969) 8.490 9.633 ( 11.132 0.613 -6.134) 12.725 9.889 ( -13.806 9.503 7.732) 18.458 9.989 ( 1.322 2.846 7.345) 7.987 10.912 ( 6.121 -7.067 -5.893) 11.052 11.018 ( -2.900 4.111 1.779) 5.336 11.471 ( 1.603 10.879 0.312) 11.001 12.121 ( -1.869 7.234 -7.159) 10.348 12.834 ( -3.907 -0.374 -2.879) 4.868 13.234 ( 6.827 2.426 7.819) 10.660 13.538 ( 2.513 -4.415 -0.909) 5.160 13.726 ( -2.477 -2.617 3.462) 4.997 14.116 ( -2.158 -1.037 -4.953) 5.501 14.640 ( 3.797 -10.049 -13.620) 17.346 14.951 ( -9.971 -2.860 1.047) 10.425 15.553 ( 7.653 7.883 -3.470) 11.522 17.574 ( 0.939 -2.080 -3.839) 4.466 19.629 ( 15.532 1.669 -16.896) 23.011 19.891 ( 2.930 -1.630 -35.195) 35.354 21.139 ( 0.586 2.470 -15.513) 15.720 22.655 ( -12.750 -1.038 63.036) 64.321 24.944 ( -7.670 14.024 23.247) 28.212 28.397 ( 4.526 -4.902 -11.194) 13.031 28.803 ( 3.254 0.029 -7.817) 8.467 ======================= Grid point 178 (80/300) ======================= q-point: (-0.18 -0.64 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.304 ( -1.160 3.321 -1.115) 3.690 2.390 ( -2.011 8.187 0.299) 8.436 3.113 ( 5.507 -6.328 -7.038) 10.950 3.433 ( 2.562 -11.012 -11.668) 16.247 3.673 ( -0.254 -1.719 -4.019) 4.378 4.062 ( -3.247 2.310 0.337) 3.999 4.357 ( 1.575 -9.738 -5.130) 11.118 4.415 ( -1.659 11.629 -10.153) 15.527 4.992 ( -0.389 -3.382 5.104) 6.135 5.197 ( 5.367 3.123 2.790) 6.808 5.764 ( 2.624 -7.549 5.689) 9.810 6.101 ( -1.671 5.436 4.332) 7.149 6.343 ( -0.565 3.884 1.335) 4.146 6.626 ( -4.881 4.566 6.474) 9.305 7.279 ( -1.078 5.113 3.888) 6.513 7.936 ( -5.178 -1.971 -1.051) 5.640 8.095 ( 5.380 -13.210 -5.064) 15.136 8.817 ( 1.607 11.049 3.170) 11.606 8.888 ( 0.294 -8.729 5.762) 10.463 9.515 ( -7.956 14.402 1.046) 16.486 9.707 ( -0.249 -4.371 1.624) 4.669 10.043 ( 0.294 -1.089 11.197) 11.254 10.890 ( 2.337 3.083 -1.107) 4.024 11.272 ( 1.791 -15.611 -2.653) 15.936 11.321 ( 4.637 2.864 0.741) 5.500 11.927 ( -3.522 9.879 -5.248) 11.728 12.831 ( -3.264 -2.082 -1.943) 4.331 13.224 ( 2.427 3.575 7.207) 8.403 13.577 ( 1.386 0.497 -1.434) 2.055 13.786 ( -2.585 -3.435 3.020) 5.254 14.083 ( 1.565 2.293 -4.439) 5.235 14.746 ( -0.674 -1.358 -6.059) 6.246 14.961 ( -1.002 -3.824 -10.050) 10.800 15.541 ( 5.291 -1.697 -5.965) 8.152 17.591 ( 4.136 1.451 -6.757) 8.054 19.592 ( 0.133 5.046 2.299) 5.547 19.886 ( 10.701 0.116 -54.359) 55.403 21.092 ( 2.309 0.837 -13.744) 13.962 22.684 ( -15.176 -1.463 60.148) 62.050 24.796 ( -4.331 2.585 22.911) 23.460 28.495 ( 4.333 -4.435 -12.167) 13.656 28.761 ( 1.764 4.214 -9.031) 10.121 ======================= Grid point 179 (81/300) ======================= q-point: (-0.09 0.36 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.201 ( 3.886 9.536 0.641) 10.317 2.243 ( 3.710 7.110 1.258) 8.117 3.148 ( 11.296 9.236 -14.181) 20.348 3.444 ( -6.681 1.556 -3.071) 7.516 3.832 ( 6.318 -8.971 -5.408) 12.233 3.897 ( -2.514 11.077 -11.783) 16.367 4.164 ( -4.265 9.500 2.154) 10.634 4.570 ( 1.608 -11.040 -7.531) 13.461 4.908 ( 2.536 11.817 1.778) 12.216 5.311 ( -0.595 -10.456 9.800) 14.343 5.895 ( -1.387 -2.041 0.469) 2.512 6.100 ( 4.643 -4.501 -0.870) 6.524 6.247 ( -4.652 3.011 8.440) 10.096 6.532 ( -0.600 3.865 6.028) 7.186 7.194 ( -0.991 3.784 2.890) 4.864 7.901 ( -1.946 1.361 0.386) 2.406 8.357 ( -0.559 -6.514 -3.494) 7.413 8.567 ( 6.968 12.349 -4.339) 14.828 9.030 ( -0.586 -4.460 7.739) 8.951 9.285 ( -7.084 5.075 4.688) 9.896 9.818 ( -1.801 -6.588 3.941) 7.885 10.084 ( 1.441 -1.513 9.218) 9.451 10.900 ( 1.432 -2.604 -1.501) 3.329 11.224 ( 0.928 2.525 1.826) 3.251 11.652 ( -1.880 -7.734 -1.323) 8.068 11.736 ( 1.764 -1.662 -5.570) 6.075 12.846 ( -2.625 -1.745 -0.607) 3.210 13.179 ( -1.631 1.747 2.949) 3.795 13.551 ( 2.135 3.490 -2.831) 4.975 13.791 ( -4.133 0.270 2.182) 4.682 14.069 ( 6.346 1.762 -0.577) 6.611 14.719 ( -1.913 1.508 -3.202) 4.023 14.969 ( 5.013 3.537 -10.612) 12.258 15.673 ( 0.070 -11.549 -7.732) 13.899 17.547 ( 6.900 5.792 -8.391) 12.311 19.487 ( -4.832 5.586 0.419) 7.397 19.841 ( 11.416 1.734 -55.714) 56.898 21.092 ( 4.412 -0.503 -10.851) 11.724 22.707 ( -17.561 -2.482 59.002) 61.610 24.824 ( -2.787 -3.161 22.775) 23.162 28.564 ( 0.406 -1.615 -12.480) 12.591 28.678 ( 4.408 3.054 -10.285) 11.599 ======================= Grid point 185 (82/300) ======================= q-point: ( 0.45 0.45 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.405 ( 2.645 0.000 21.842) 22.002 1.488 ( -6.887 -0.000 16.698) 18.062 2.490 ( 0.165 0.000 14.266) 14.267 2.863 ( -5.764 -0.000 4.698) 7.436 3.296 ( 9.541 0.000 14.089) 17.016 3.684 ( 6.203 0.000 10.706) 12.373 4.078 ( -1.742 -0.000 -0.128) 1.746 4.453 ( -2.783 -0.000 0.457) 2.820 5.092 ( 1.441 0.000 -6.037) 6.206 5.596 ( -0.749 -0.000 1.772) 1.924 5.925 ( -0.736 -0.000 -4.072) 4.138 5.992 ( -4.379 -0.000 8.009) 9.128 6.451 ( 1.707 0.000 1.424) 2.223 6.581 ( 1.312 0.000 -6.210) 6.347 6.989 ( -2.491 -0.000 0.675) 2.581 7.520 ( -3.278 -0.000 -6.007) 6.843 7.959 ( -3.802 -0.000 5.273) 6.501 7.996 ( 11.010 0.000 1.929) 11.178 8.157 ( -3.921 -0.000 13.203) 13.773 9.316 ( -8.297 -0.000 22.186) 23.686 10.537 ( 19.155 0.000 -6.375) 20.188 10.965 ( -13.667 -0.000 0.852) 13.694 10.981 ( -1.846 -0.000 -2.947) 3.477 11.762 ( -7.112 -0.000 -0.854) 7.164 11.805 ( -3.559 -0.000 -4.693) 5.890 12.332 ( 3.696 0.000 -1.405) 3.954 13.070 ( 10.186 0.000 -5.720) 11.682 13.167 ( 8.402 0.000 0.192) 8.404 13.387 ( -3.944 -0.000 -4.116) 5.700 13.425 ( -13.418 -0.000 4.036) 14.012 13.740 ( -0.722 -0.000 4.076) 4.140 14.308 ( -5.416 -0.000 7.715) 9.426 14.384 ( -1.020 -0.000 3.297) 3.451 17.027 ( 10.008 0.000 -23.522) 25.562 17.215 ( -1.404 -0.000 7.277) 7.411 18.953 ( 37.231 0.000 -53.997) 65.588 19.731 ( 0.432 0.000 4.444) 4.465 21.403 ( 2.059 0.000 -9.418) 9.641 22.664 ( -20.335 -0.000 76.536) 79.191 27.108 ( 1.895 0.000 4.666) 5.036 27.775 ( 0.763 0.000 -2.243) 2.369 27.909 ( 3.283 0.000 -2.115) 3.905 ======================= Grid point 186 (83/300) ======================= q-point: (-0.45 -0.55 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.465 ( 1.106 -9.808 9.386) 13.620 1.733 ( -8.607 -19.216 18.724) 28.176 2.577 ( -2.637 -7.473 12.431) 14.742 2.855 ( -7.549 -2.719 3.529) 8.765 3.321 ( 7.982 4.259 12.334) 15.296 3.735 ( -14.918 -5.161 7.469) 17.463 4.151 ( 7.836 -4.767 4.659) 10.287 4.393 ( 0.828 4.323 1.261) 4.579 5.086 ( 2.654 1.446 -4.335) 5.284 5.605 ( 1.567 -0.247 -0.116) 1.590 5.673 ( 0.272 10.399 -0.126) 10.404 6.240 ( -8.945 -7.425 7.487) 13.828 6.507 ( 7.173 -4.086 -6.070) 10.246 6.612 ( 2.592 -5.536 -2.410) 6.571 7.025 ( -1.399 -5.405 0.037) 5.583 7.521 ( 0.331 -2.674 -7.893) 8.340 7.963 ( -4.730 -1.416 1.773) 5.246 8.064 ( 4.117 -3.027 1.111) 5.229 8.277 ( 4.022 -9.771 17.110) 20.110 9.315 ( -7.431 -2.056 22.494) 23.778 10.500 ( 12.262 14.817 -3.675) 19.581 10.742 ( -10.027 9.671 -1.831) 14.051 10.991 ( -4.795 -0.818 -4.020) 6.310 11.558 ( -2.756 9.017 -1.704) 9.582 11.976 ( -1.911 -11.332 -7.929) 13.962 12.262 ( 2.729 9.314 -0.503) 9.718 13.149 ( -7.575 8.271 -1.441) 11.308 13.175 ( 6.516 -3.007 -1.009) 7.247 13.223 ( 6.491 0.674 0.642) 6.557 13.535 ( -3.190 -9.421 -2.130) 10.172 13.751 ( -1.634 -1.779 3.390) 4.162 14.265 ( -1.632 -0.419 -0.221) 1.700 14.511 ( -4.591 -10.403 9.740) 14.972 16.801 ( 7.445 24.288 -11.478) 27.877 17.275 ( -1.119 -5.409 0.297) 5.531 19.217 ( 35.476 -9.065 -51.695) 63.349 19.756 ( -3.974 -2.262 3.380) 5.686 21.369 ( 1.235 2.813 -12.065) 12.450 22.648 ( -16.535 1.452 77.936) 79.684 26.654 ( -3.357 36.677 8.695) 37.843 27.968 ( 1.442 -9.763 -5.574) 11.335 28.156 ( 6.393 -20.860 -0.586) 21.826 ======================= Grid point 187 (84/300) ======================= q-point: (-0.36 -0.55 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.795 ( 1.828 -21.469 -2.016) 21.641 2.050 ( -10.734 -17.742 13.770) 24.892 2.756 ( -2.281 -11.163 4.687) 12.320 2.836 ( -12.310 -1.741 2.286) 12.641 3.356 ( 6.949 -1.476 10.580) 12.744 3.747 ( -16.374 -9.004 4.727) 19.275 4.191 ( -1.469 4.765 0.878) 5.063 4.462 ( 9.168 -6.787 11.112) 15.924 5.044 ( 2.700 4.389 -5.606) 7.614 5.506 ( 7.095 9.286 1.645) 11.802 5.654 ( -0.839 -2.643 -5.052) 5.763 6.229 ( -5.928 -0.187 5.786) 8.286 6.534 ( 1.580 1.728 -2.889) 3.719 6.780 ( 2.768 -3.997 -0.477) 4.885 7.169 ( 1.546 -8.974 -0.159) 9.108 7.584 ( 1.678 -4.018 -10.664) 11.519 7.932 ( -4.828 0.589 4.413) 6.568 8.231 ( 0.871 -12.061 1.247) 12.157 8.590 ( 6.654 -15.321 9.413) 19.173 9.393 ( -2.594 -7.172 22.865) 24.104 10.205 ( -0.771 17.883 0.766) 17.916 10.496 ( -3.419 12.018 -4.653) 13.333 10.924 ( -3.478 3.134 -5.893) 7.526 11.376 ( -0.101 9.877 -0.866) 9.916 11.997 ( 1.490 13.267 -4.338) 14.037 12.160 ( -0.743 -3.931 -7.163) 8.204 12.948 ( -5.080 6.384 -1.884) 8.373 13.267 ( 5.830 -0.695 1.702) 6.113 13.305 ( 4.841 -5.071 5.391) 8.844 13.659 ( -2.312 -4.208 -2.349) 5.345 13.837 ( -1.030 -9.378 -1.265) 9.519 14.306 ( 0.666 -4.899 -7.169) 8.708 14.689 ( -6.987 -10.336 11.523) 16.983 16.305 ( 5.727 29.235 -5.570) 30.307 17.387 ( -0.318 -6.722 -1.593) 6.916 19.544 ( 31.974 -8.482 -50.978) 60.770 19.756 ( -9.295 -2.272 3.973) 10.361 21.280 ( 0.345 4.473 -15.720) 16.348 22.659 ( -11.494 0.958 75.643) 76.518 25.921 ( -10.438 36.252 14.190) 40.305 28.157 ( 5.358 -8.251 -6.109) 11.580 28.549 ( 6.027 -15.247 -3.524) 16.770 ======================= Grid point 188 (85/300) ======================= q-point: (-0.27 -0.55 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.170 ( -3.387 -14.446 -3.877) 15.336 2.288 ( -8.911 -15.956 3.796) 18.666 2.744 ( -12.530 -1.994 -2.023) 12.848 2.996 ( 3.287 -12.247 -2.381) 12.902 3.516 ( 4.026 -8.363 8.682) 12.709 3.880 ( -10.040 -13.519 4.746) 17.496 4.081 ( -1.221 4.506 -0.503) 4.695 4.651 ( 3.472 -4.443 8.416) 10.131 4.946 ( -0.018 5.584 -3.938) 6.833 5.425 ( 14.990 7.328 -2.394) 16.856 5.655 ( -3.932 -0.184 -1.935) 4.387 6.228 ( -3.486 -1.394 6.098) 7.161 6.481 ( 1.143 4.161 -1.801) 4.676 6.772 ( -2.374 3.805 2.483) 5.127 7.350 ( 2.507 -7.825 -1.074) 8.287 7.615 ( -1.017 -1.282 -5.430) 5.671 7.927 ( -4.452 -3.028 3.824) 6.604 8.484 ( 2.756 -12.546 0.980) 12.882 8.865 ( 0.705 -8.080 6.011) 10.095 9.649 ( 8.750 -11.761 13.839) 20.160 9.902 ( -8.937 10.128 5.876) 14.730 10.208 ( -3.203 14.766 -5.395) 16.043 10.860 ( 2.406 0.438 -5.408) 5.935 11.178 ( -0.068 10.648 -0.485) 10.659 11.722 ( 1.339 14.703 -0.337) 14.767 12.168 ( -2.734 1.243 -10.164) 10.598 12.834 ( -2.428 2.898 -1.089) 3.935 13.327 ( 6.711 0.445 4.279) 7.971 13.453 ( 3.710 -6.296 5.108) 8.916 13.674 ( -4.124 -1.344 1.056) 4.465 14.004 ( -1.941 -7.892 -5.973) 10.086 14.441 ( 3.602 -9.885 -13.572) 17.173 14.809 ( -8.717 -6.108 7.343) 12.931 15.868 ( 7.490 20.182 -2.813) 21.710 17.498 ( 0.146 -5.337 -2.847) 6.050 19.727 ( -11.166 -1.580 4.288) 12.065 19.781 ( 26.383 -3.816 -50.722) 57.301 21.169 ( 0.073 3.857 -18.188) 18.593 22.696 ( -9.438 1.337 71.014) 71.651 25.283 ( -11.473 25.192 18.936) 33.539 28.314 ( 5.297 -5.902 -8.345) 11.512 28.774 ( 5.063 -5.435 -5.540) 9.266 ======================= Grid point 189 (86/300) ======================= q-point: (-0.18 -0.55 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.257 ( -9.452 -3.827 -1.503) 10.307 2.418 ( -8.070 -2.400 -0.684) 8.447 2.878 ( -0.081 -16.846 -5.447) 17.705 3.249 ( 7.616 -11.608 -11.231) 17.857 3.668 ( 2.290 -1.974 3.738) 4.808 4.004 ( -4.823 -2.649 2.394) 6.001 4.117 ( -4.747 -12.197 1.046) 13.130 4.628 ( 3.582 9.590 -12.806) 16.395 4.898 ( -3.475 -3.055 11.674) 12.558 5.400 ( 13.646 8.329 -4.250) 16.542 5.665 ( -0.445 -4.973 2.429) 5.552 6.191 ( -4.471 4.292 7.351) 9.614 6.413 ( 1.168 3.610 -1.651) 4.137 6.667 ( -5.926 3.911 5.634) 9.064 7.378 ( -1.800 4.683 3.616) 6.184 7.728 ( -0.726 -11.610 -5.565) 12.896 7.983 ( -0.932 -5.121 0.402) 5.220 8.729 ( 4.490 -10.597 2.167) 11.712 8.936 ( -0.769 0.897 7.691) 7.781 9.658 ( -13.226 7.990 6.136) 16.626 9.789 ( 5.584 9.065 -7.109) 12.802 10.039 ( 0.814 -0.729 10.819) 10.874 10.987 ( 1.269 -9.070 0.532) 9.174 11.015 ( 6.939 3.603 -4.535) 9.038 11.491 ( 0.918 10.715 1.439) 10.850 12.046 ( -4.369 6.941 -9.457) 12.517 12.795 ( -0.767 0.170 0.063) 0.788 13.332 ( 2.600 4.047 6.748) 8.287 13.572 ( 2.684 -2.579 1.191) 3.908 13.698 ( -2.924 -3.996 2.915) 5.746 14.069 ( -1.940 -2.589 -6.585) 7.337 14.639 ( 2.443 -9.171 -13.282) 16.324 14.839 ( -4.745 -4.003 -1.679) 6.431 15.656 ( 8.217 9.058 -3.479) 12.715 17.578 ( 1.073 -3.499 -4.392) 5.717 19.661 ( -8.342 2.220 4.170) 9.587 19.886 ( 18.849 0.032 -52.586) 55.862 21.093 ( 1.159 1.209 -17.362) 17.442 22.705 ( -11.608 2.318 66.076) 67.128 24.917 ( -7.214 10.797 21.213) 24.872 28.429 ( 5.075 -4.334 -10.307) 12.279 28.818 ( 2.456 1.701 -7.571) 8.139 ======================= Grid point 190 (87/300) ======================= q-point: (-0.09 -0.55 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.243 ( -5.544 -2.067 -3.660) 6.957 2.370 ( -1.923 3.114 2.533) 4.451 3.183 ( 6.454 -12.626 -7.138) 15.874 3.437 ( 3.958 -1.026 -11.485) 12.191 3.669 ( 2.144 -2.516 -6.010) 6.860 4.011 ( -3.756 0.730 3.430) 5.139 4.304 ( -5.196 -6.940 -7.442) 11.425 4.398 ( 3.990 8.899 -9.681) 13.742 5.025 ( 0.995 -7.146 7.835) 10.651 5.274 ( 3.398 9.391 3.396) 10.548 5.818 ( 2.734 -6.988 0.928) 7.561 6.088 ( -2.248 2.655 3.946) 5.260 6.325 ( -2.676 5.633 3.227) 7.021 6.583 ( -4.134 2.240 7.192) 8.593 7.271 ( -2.076 4.753 4.886) 7.126 7.855 ( -4.459 -4.006 -2.322) 6.428 8.168 ( 6.352 -12.230 -4.851) 14.610 8.844 ( 0.307 10.284 3.592) 10.898 8.944 ( 4.872 -7.370 4.760) 10.036 9.359 ( -13.430 10.064 4.617) 17.406 9.743 ( 3.877 -0.932 -2.000) 4.460 10.066 ( -2.798 -0.611 11.973) 12.310 10.937 ( 4.027 2.758 -0.883) 4.960 11.256 ( -2.088 -2.406 0.050) 3.186 11.430 ( 9.209 -9.164 -0.658) 13.008 11.832 ( -6.178 9.652 -8.146) 14.060 12.807 ( 0.403 -1.251 0.742) 1.510 13.245 ( -2.430 5.540 5.345) 8.072 13.610 ( 3.490 0.864 -0.226) 3.603 13.746 ( -3.847 -2.341 1.931) 4.900 14.092 ( 1.247 -1.940 -4.006) 4.622 14.707 ( -1.310 -1.039 -4.776) 5.060 14.946 ( 3.688 -6.737 -11.595) 13.908 15.589 ( 4.277 2.283 -5.889) 7.628 17.623 ( 3.064 -0.496 -6.961) 7.622 19.549 ( -6.182 4.410 1.761) 7.796 19.878 ( 14.617 2.945 -53.903) 55.927 21.081 ( 2.836 -1.094 -13.752) 14.083 22.687 ( -13.843 1.344 61.490) 63.043 24.813 ( -4.527 1.151 21.954) 22.445 28.513 ( 4.086 -2.968 -12.026) 13.043 28.754 ( 1.633 4.053 -8.931) 9.942 ======================= Grid point 197 (88/300) ======================= q-point: (-0.45 -0.45 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.406 ( -11.827 -0.000 13.223) 17.741 1.470 ( -4.765 -0.000 22.953) 23.442 2.503 ( -4.125 -0.000 13.135) 13.768 2.793 ( -6.334 -0.000 5.180) 8.183 3.418 ( -0.469 -0.000 16.280) 16.287 3.549 ( -25.024 -0.000 6.469) 25.847 4.180 ( 10.259 0.000 4.223) 11.094 4.441 ( 1.353 0.000 -0.106) 1.358 5.100 ( 2.204 0.000 -4.913) 5.385 5.623 ( 4.196 0.000 0.774) 4.267 5.924 ( 2.622 0.000 -4.102) 4.869 5.985 ( -1.893 -0.000 12.953) 13.091 6.489 ( 3.567 0.000 -0.806) 3.657 6.583 ( 1.984 0.000 -5.936) 6.259 6.967 ( -0.785 -0.000 -0.687) 1.043 7.489 ( 2.375 0.000 -7.558) 7.922 7.911 ( -4.914 -0.000 3.303) 5.921 8.079 ( 2.654 0.000 -1.721) 3.163 8.265 ( 8.552 0.000 22.630) 24.192 9.278 ( -7.822 -0.000 22.544) 23.863 10.698 ( -9.876 -0.000 1.969) 10.071 10.797 ( 6.320 0.000 -8.220) 10.368 10.919 ( -4.864 -0.000 -6.212) 7.890 11.658 ( -6.377 -0.000 -4.253) 7.665 11.800 ( 5.189 0.000 -5.004) 7.209 12.365 ( 1.124 0.000 0.495) 1.228 13.165 ( -9.093 -0.000 -1.026) 9.151 13.194 ( 8.948 0.000 -4.515) 10.023 13.323 ( -2.946 -0.000 -1.798) 3.452 13.378 ( 5.860 0.000 2.424) 6.341 13.722 ( -3.359 -0.000 2.253) 4.044 14.296 ( 0.087 0.000 7.500) 7.500 14.361 ( -3.560 -0.000 2.160) 4.164 17.103 ( 10.568 0.000 -16.970) 19.992 17.206 ( -3.252 -0.000 6.872) 7.602 19.254 ( 30.523 0.000 -50.468) 58.980 19.730 ( -2.659 -0.000 4.164) 4.940 21.380 ( 0.173 0.000 -13.686) 13.687 22.691 ( -14.800 -0.000 84.499) 85.785 27.158 ( 2.304 0.000 6.944) 7.317 27.674 ( -8.040 -0.000 -6.489) 10.332 28.044 ( 10.575 0.000 3.568) 11.161 ======================= Grid point 198 (89/300) ======================= q-point: (-0.36 -0.45 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.451 ( -6.778 -13.075 6.334) 16.032 1.649 ( -12.718 -16.916 20.387) 29.386 2.565 ( -4.200 -7.387 11.211) 14.067 2.749 ( -9.210 0.684 3.977) 10.055 3.377 ( -12.008 -0.919 9.089) 15.088 3.464 ( -18.661 -5.777 12.310) 23.090 4.263 ( 5.398 0.579 2.934) 6.171 4.450 ( 4.384 -1.002 4.560) 6.404 5.112 ( 2.834 0.831 -3.364) 4.476 5.629 ( 2.085 2.243 -3.993) 5.032 5.752 ( 10.342 9.072 2.666) 14.013 6.154 ( -6.295 -4.657 5.781) 9.733 6.559 ( 3.569 -0.439 -6.183) 7.153 6.662 ( 4.244 -9.559 1.999) 10.649 7.026 ( 1.490 -6.967 -1.381) 7.258 7.519 ( 3.874 -1.648 -9.131) 10.055 7.876 ( -7.980 -0.362 3.247) 8.623 8.122 ( 4.624 -3.426 0.137) 5.757 8.461 ( 11.618 -8.551 18.768) 23.671 9.297 ( -6.196 -3.780 24.274) 25.336 10.450 ( -17.088 12.272 2.094) 21.142 10.728 ( 7.609 12.344 -8.612) 16.865 10.895 ( -4.569 -1.337 -7.106) 8.554 11.531 ( -1.272 6.530 -3.391) 7.467 11.954 ( 3.654 -8.745 -8.622) 12.813 12.283 ( 0.014 8.993 0.897) 9.038 13.026 ( -7.355 6.127 -0.999) 9.625 13.257 ( 2.840 -1.734 1.392) 3.607 13.313 ( 7.281 -1.427 -1.049) 7.494 13.516 ( 0.816 -7.239 -2.285) 7.635 13.724 ( -2.963 -2.844 2.124) 4.624 14.263 ( 1.173 0.537 -2.014) 2.392 14.478 ( -4.013 -9.505 9.031) 13.711 16.861 ( 4.945 24.602 -6.278) 25.868 17.279 ( 2.014 -5.054 -1.745) 5.713 19.440 ( 16.188 -6.776 -42.546) 46.023 19.737 ( 3.820 -2.035 -1.911) 4.731 21.323 ( -0.806 2.913 -16.605) 16.878 22.739 ( -10.303 0.819 86.181) 86.799 26.590 ( -9.747 40.792 8.171) 42.728 27.996 ( 5.014 -16.711 -4.966) 18.140 28.256 ( 6.915 -16.216 2.378) 17.788 ======================= Grid point 199 (90/300) ======================= q-point: (-0.27 -0.45 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.764 ( -4.874 -22.055 -3.293) 22.826 1.916 ( -15.046 -17.457 14.286) 27.115 2.624 ( -14.709 0.277 -0.897) 14.739 2.766 ( -1.604 -12.071 6.576) 13.839 3.394 ( -8.856 -7.208 8.618) 14.306 3.542 ( -12.780 -12.679 11.818) 21.535 4.213 ( 4.012 6.846 -0.265) 7.939 4.580 ( 2.391 -6.651 11.692) 13.662 5.061 ( 2.478 5.953 -5.636) 8.564 5.586 ( 0.062 1.182 -5.102) 5.237 5.712 ( 13.996 6.965 -0.520) 15.642 6.167 ( -5.084 -2.283 5.337) 7.717 6.547 ( 1.762 2.259 -3.161) 4.266 6.807 ( 0.736 -1.231 2.655) 3.017 7.215 ( 4.274 -8.976 -0.715) 9.967 7.553 ( -0.760 -2.326 -10.302) 10.588 7.839 ( -9.818 -2.014 6.588) 11.994 8.302 ( 8.086 -10.369 -0.297) 13.152 8.744 ( 10.065 -8.691 7.019) 15.036 9.466 ( 1.414 -12.812 26.858) 29.791 10.082 ( -15.516 14.011 3.602) 21.214 10.462 ( -0.436 15.740 -9.551) 18.416 10.876 ( 0.393 0.243 -6.793) 6.809 11.372 ( -0.693 9.593 -2.744) 10.002 11.997 ( 1.348 10.822 -4.375) 11.751 12.132 ( 0.210 0.583 -5.617) 5.651 12.888 ( -2.494 4.459 -0.608) 5.145 13.329 ( 3.207 -3.695 2.220) 5.373 13.422 ( 7.845 -2.899 4.617) 9.553 13.598 ( -5.330 -3.592 -1.846) 6.687 13.821 ( -0.322 -8.291 -2.964) 8.811 14.305 ( 2.317 -4.785 -9.072) 10.515 14.636 ( -4.934 -8.299 9.485) 13.535 16.369 ( 5.235 27.882 -3.517) 28.586 17.391 ( 1.578 -5.557 -3.362) 6.684 19.509 ( -11.149 -6.165 -12.697) 17.986 19.876 ( 22.516 -2.770 -29.113) 36.908 21.214 ( -0.996 4.303 -19.507) 20.001 22.805 ( -6.299 1.989 82.182) 82.447 25.775 ( -16.754 35.342 13.179) 41.273 28.227 ( 6.891 -6.817 -5.109) 10.957 28.632 ( 7.103 -14.282 -2.307) 16.116 ======================= Grid point 200 (91/300) ======================= q-point: (-0.18 -0.45 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.038 ( -14.015 -10.505 0.262) 17.517 2.151 ( -11.396 -17.496 0.788) 20.896 2.595 ( -6.056 -9.372 -6.177) 12.754 3.031 ( 3.061 -14.242 -1.723) 14.669 3.535 ( -6.112 -10.964 8.751) 15.302 3.772 ( -8.215 -16.609 10.137) 21.121 4.100 ( 4.232 7.739 -1.244) 8.908 4.715 ( 2.115 -3.106 8.201) 9.021 4.925 ( -0.301 7.343 -6.024) 9.503 5.582 ( -3.365 -1.999 -2.956) 4.905 5.657 ( 15.639 8.587 -3.319) 18.148 6.194 ( -4.230 -1.639 7.568) 8.823 6.493 ( 1.206 4.056 -1.846) 4.616 6.738 ( -3.807 6.354 4.167) 8.499 7.385 ( 1.332 -4.568 -0.122) 4.760 7.562 ( -2.658 -4.226 -5.014) 7.076 7.853 ( -7.099 -5.228 3.877) 9.632 8.572 ( 8.938 -11.254 -0.792) 14.393 8.911 ( 2.633 -3.863 6.012) 7.615 9.732 ( -15.734 7.076 9.464) 19.678 9.846 ( 10.561 -8.548 13.372) 19.063 10.147 ( -3.184 13.095 -8.028) 15.687 10.891 ( 4.098 -2.282 -4.122) 6.244 11.175 ( -0.004 9.274 -3.325) 9.851 11.736 ( 0.410 14.442 1.421) 14.517 12.098 ( -1.130 3.277 -10.634) 11.184 12.821 ( 0.769 2.193 0.917) 2.498 13.402 ( 1.532 0.116 1.884) 2.431 13.537 ( 4.373 -3.725 8.045) 9.885 13.616 ( -3.082 -2.943 -0.385) 4.278 13.949 ( -2.961 -6.434 -6.878) 9.873 14.445 ( 3.209 -9.865 -13.714) 17.196 14.735 ( -3.944 -4.596 4.355) 7.460 15.970 ( 8.261 18.544 -3.310) 20.569 17.484 ( -1.035 -4.951 -3.902) 6.388 19.531 ( -12.316 -6.492 -3.299) 14.308 19.983 ( 20.537 1.777 -39.239) 44.324 21.104 ( 0.167 2.887 -20.242) 20.447 22.831 ( -7.571 5.100 75.744) 76.292 25.165 ( -13.876 20.046 17.191) 29.831 28.365 ( 5.540 -4.809 -7.475) 10.473 28.824 ( 4.541 -2.845 -5.583) 7.739 ======================= Grid point 201 (92/300) ======================= q-point: (-0.09 -0.45 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.078 ( -13.279 -7.074 -2.171) 15.201 2.301 ( -9.035 -7.164 0.582) 11.545 2.872 ( 2.891 -19.517 -11.122) 22.649 3.307 ( 5.653 -12.157 -7.860) 15.541 3.684 ( -2.865 -4.936 5.208) 7.727 4.000 ( 3.143 3.459 1.392) 4.877 4.036 ( -6.728 -13.929 3.134) 15.783 4.647 ( 5.509 12.466 -14.927) 20.213 4.893 ( -2.930 -5.829 11.557) 13.272 5.497 ( 0.538 8.470 -0.129) 8.488 5.718 ( 7.994 -4.750 -3.314) 9.872 6.148 ( -5.228 4.225 8.214) 10.614 6.413 ( -0.675 4.814 0.204) 4.865 6.608 ( -5.179 3.740 6.306) 8.977 7.338 ( -5.883 3.849 5.044) 8.653 7.714 ( 1.967 -8.054 -7.037) 10.875 7.968 ( -0.790 -11.163 0.043) 11.191 8.830 ( 7.840 -9.494 1.922) 12.462 8.961 ( 0.722 1.240 7.205) 7.346 9.454 ( -16.704 9.931 6.552) 20.508 9.847 ( 4.777 8.752 -8.880) 13.352 10.086 ( -0.026 0.323 12.946) 12.950 10.981 ( -1.506 -1.023 2.392) 3.006 11.128 ( 9.166 -6.298 -6.162) 12.714 11.511 ( 1.005 9.284 2.671) 9.713 11.953 ( -2.895 8.598 -10.811) 14.113 12.814 ( 2.749 0.404 2.309) 3.612 13.339 ( -3.699 5.213 3.531) 7.302 13.631 ( 2.317 -1.899 4.490) 5.398 13.669 ( -0.485 -3.321 0.864) 3.466 14.009 ( -3.484 -4.717 -6.337) 8.634 14.620 ( 1.139 -7.461 -10.062) 12.578 14.811 ( 1.637 -6.272 -4.985) 8.177 15.757 ( 8.264 11.076 -5.694) 14.946 17.557 ( -2.107 -4.987 -4.914) 7.311 19.535 ( -7.750 -1.323 -1.494) 8.003 19.976 ( 16.349 4.466 -45.681) 48.724 21.054 ( 1.905 -0.368 -17.634) 17.740 22.779 ( -10.935 5.925 68.848) 69.962 24.882 ( -7.716 6.799 19.352) 21.915 28.466 ( 5.095 -3.635 -9.990) 11.789 28.818 ( 1.279 3.252 -7.787) 8.535 ======================= Grid point 209 (93/300) ======================= q-point: (-0.36 -0.36 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.252 ( -15.754 -0.000 11.977) 19.789 1.422 ( -13.297 -0.000 23.413) 26.925 2.484 ( -4.340 -0.000 12.939) 13.648 2.730 ( -5.082 -0.000 6.559) 8.298 3.122 ( -37.452 -0.000 8.478) 38.399 3.396 ( -9.477 -0.000 14.938) 17.690 4.304 ( 4.408 0.000 4.720) 6.458 4.483 ( 3.562 0.000 0.749) 3.640 5.121 ( 3.085 0.000 -3.971) 5.029 5.706 ( 6.397 0.000 0.738) 6.440 5.970 ( 5.908 0.000 -5.342) 7.965 6.021 ( 0.877 0.000 10.976) 11.011 6.554 ( 5.153 0.000 3.569) 6.269 6.596 ( 2.611 0.000 -5.701) 6.271 6.960 ( 0.407 0.000 -1.386) 1.445 7.538 ( 8.399 0.000 -8.469) 11.928 7.848 ( -5.102 -0.000 2.177) 5.547 8.115 ( 3.330 0.000 -0.738) 3.411 8.497 ( 11.888 0.000 25.874) 28.474 9.257 ( -6.302 -0.000 24.490) 25.288 10.423 ( -22.700 -0.000 0.004) 22.700 10.801 ( -7.642 -0.000 -10.590) 13.059 10.945 ( 11.960 0.000 -7.217) 13.969 11.545 ( -7.381 -0.000 -5.666) 9.305 11.905 ( 11.351 0.000 -5.001) 12.404 12.364 ( -1.718 -0.000 1.214) 2.103 13.033 ( -7.358 -0.000 -0.948) 7.419 13.255 ( -0.144 -0.000 3.463) 3.466 13.323 ( 4.691 0.000 -6.777) 8.242 13.486 ( 7.437 0.000 -0.326) 7.445 13.671 ( -4.244 -0.000 2.437) 4.894 14.299 ( -5.941 -0.000 1.304) 6.083 14.358 ( 5.202 0.000 5.913) 7.876 17.171 ( -4.812 -0.000 6.401) 8.008 17.205 ( 11.002 0.000 -13.396) 17.335 19.461 ( 22.720 0.000 -49.881) 54.811 19.686 ( -5.301 -0.000 3.723) 6.478 21.310 ( -2.207 -0.000 -18.324) 18.456 22.841 ( -7.000 -0.000 94.550) 94.809 27.221 ( 2.608 0.000 9.512) 9.863 27.538 ( -7.873 -0.000 -6.178) 10.007 28.195 ( 8.429 0.000 4.271) 9.450 ======================= Grid point 210 (94/300) ======================= q-point: (-0.27 -0.36 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.330 ( -12.509 -16.914 5.246) 21.681 1.508 ( -17.333 -14.914 20.465) 30.687 2.531 ( -10.170 -2.976 13.613) 17.251 2.618 ( -9.491 1.460 3.380) 10.181 3.046 ( -26.149 -14.166 10.657) 31.591 3.373 ( -9.658 -3.302 13.217) 16.700 4.329 ( 2.372 1.703 2.097) 3.595 4.517 ( 2.322 -2.326 5.829) 6.692 5.143 ( 3.183 0.910 -3.382) 4.732 5.651 ( 3.214 6.943 -4.011) 8.638 5.939 ( 13.976 4.811 0.377) 14.785 6.104 ( -3.280 -2.152 5.020) 6.371 6.580 ( 2.612 0.679 -6.031) 6.607 6.736 ( 4.093 -8.291 6.097) 11.075 7.045 ( 1.665 -9.016 -2.188) 9.426 7.573 ( 7.887 2.842 -8.784) 12.143 7.767 ( -9.067 2.001 4.887) 10.492 8.209 ( 7.771 -6.347 -0.716) 10.059 8.709 ( 13.970 -6.767 16.886) 22.937 9.320 ( -2.898 -6.986 29.825) 30.769 10.167 ( -22.336 8.767 0.802) 24.009 10.681 ( -7.707 7.534 -14.239) 17.858 10.907 ( 7.244 5.731 -4.681) 10.355 11.468 ( -5.742 2.901 -5.173) 8.255 12.028 ( 9.910 -3.657 -7.182) 12.774 12.271 ( -1.806 8.203 1.216) 8.487 12.948 ( -2.991 3.733 -0.745) 4.842 13.289 ( 1.178 -2.738 3.997) 4.986 13.400 ( 4.540 -5.689 -5.747) 9.274 13.517 ( 0.371 0.326 0.836) 0.971 13.703 ( -0.376 -4.548 0.232) 4.569 14.251 ( -2.524 -0.590 -3.078) 4.024 14.489 ( 2.311 -6.875 7.481) 10.420 16.890 ( 1.010 23.161 -1.772) 23.251 17.317 ( 4.855 -3.775 -5.675) 8.369 19.389 ( -4.953 4.273 -18.919) 20.018 19.841 ( 13.725 -10.628 -25.406) 30.770 21.233 ( -2.757 2.543 -20.433) 20.774 22.963 ( -1.836 1.645 95.349) 95.381 26.436 ( -16.406 47.191 9.201) 50.801 28.076 ( 8.601 -21.365 -4.878) 23.542 28.361 ( 6.300 -14.466 3.720) 16.211 ======================= Grid point 211 (95/300) ======================= q-point: (-0.18 -0.36 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.641 ( -10.608 -21.931 -2.951) 24.540 1.722 ( -18.784 -16.753 12.622) 28.157 2.399 ( -16.517 -2.870 0.353) 16.768 2.784 ( 0.977 -13.249 6.646) 14.854 3.216 ( -16.636 -16.495 12.796) 26.695 3.465 ( -6.868 -11.038 11.381) 17.278 4.273 ( 3.415 6.124 -0.447) 7.027 4.632 ( 0.032 -6.591 11.325) 13.104 5.078 ( 2.929 7.385 -7.069) 10.634 5.562 ( 0.509 2.859 -6.280) 6.919 5.918 ( 13.004 8.301 -1.361) 15.487 6.134 ( -1.555 -2.803 5.952) 6.760 6.559 ( 1.338 2.351 -3.441) 4.377 6.827 ( 0.205 2.313 5.587) 6.050 7.253 ( 0.089 -10.321 -1.526) 10.433 7.489 ( -5.515 1.989 -2.532) 6.386 7.742 ( -4.083 -2.135 2.809) 5.397 8.440 ( 11.324 -10.289 -1.737) 15.398 8.897 ( 8.131 -2.402 4.563) 9.629 9.624 ( 5.818 -14.915 29.023) 33.146 9.847 ( -17.305 7.527 5.211) 19.577 10.377 ( -5.999 14.862 -13.529) 20.974 10.890 ( 4.144 -0.014 -5.048) 6.531 11.318 ( -4.841 7.670 -5.023) 10.368 12.007 ( 0.374 12.419 0.106) 12.425 12.147 ( 5.975 2.769 -7.407) 9.911 12.878 ( 1.271 2.822 0.302) 3.110 13.371 ( 1.048 -3.449 1.367) 3.855 13.504 ( -6.560 -3.111 2.094) 7.556 13.552 ( 8.697 -3.832 -0.026) 9.504 13.797 ( -1.820 -6.026 -4.409) 7.685 14.289 ( -0.346 -5.941 -8.462) 10.345 14.634 ( 0.827 -5.504 6.251) 8.369 16.427 ( 4.902 24.906 -3.784) 25.664 17.392 ( 0.001 -3.186 -5.218) 6.114 19.312 ( -10.757 -5.448 -5.586) 13.289 20.038 ( 15.101 -3.942 -35.251) 38.551 21.123 ( -1.489 3.166 -21.518) 21.800 23.046 ( -1.672 6.357 89.528) 89.769 25.538 ( -23.325 32.295 13.587) 42.091 28.306 ( 6.376 -4.965 -4.910) 9.456 28.731 ( 7.976 -12.058 -3.235) 14.815 ======================= Grid point 212 (96/300) ======================= q-point: (-0.09 -0.36 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.804 ( -18.599 -10.109 3.342) 21.431 1.978 ( -12.163 -18.334 -2.583) 22.153 2.517 ( -2.024 -16.664 -8.538) 18.833 3.079 ( 4.237 -14.843 0.125) 15.437 3.441 ( -10.598 -15.150 12.249) 22.179 3.705 ( -6.319 -16.338 9.071) 19.727 4.165 ( 4.132 7.732 -0.575) 8.786 4.769 ( 0.197 -5.492 10.968) 12.268 4.905 ( 2.484 10.942 -11.747) 16.245 5.522 ( -2.464 0.125 -3.222) 4.058 5.838 ( 10.490 7.460 -4.759) 13.723 6.172 ( -2.592 0.053 9.208) 9.566 6.498 ( 0.040 4.266 -1.294) 4.458 6.696 ( -4.726 8.338 6.060) 11.339 7.321 ( -10.791 -1.055 2.373) 11.099 7.571 ( 6.476 -10.083 -4.831) 12.921 7.773 ( -4.837 -5.256 1.340) 7.268 8.710 ( 10.207 -10.128 -1.210) 14.430 8.975 ( 3.069 -1.379 6.670) 7.471 9.518 ( -17.162 8.536 6.391) 20.205 10.046 ( -3.594 -2.989 7.199) 8.583 10.060 ( 7.763 6.208 0.446) 9.950 10.942 ( 4.175 -2.512 -1.282) 5.038 11.149 ( -0.747 4.530 -6.986) 8.359 11.742 ( -0.515 14.162 3.290) 14.548 12.085 ( 4.471 7.132 -10.024) 13.090 12.860 ( 3.834 1.411 2.137) 4.611 13.376 ( -4.702 1.473 -0.650) 4.970 13.556 ( -3.036 -4.505 4.763) 7.225 13.661 ( 5.883 -2.112 2.287) 6.656 13.869 ( -4.674 -5.299 -6.662) 9.711 14.438 ( 2.411 -10.265 -11.280) 15.441 14.726 ( 0.481 -3.794 1.318) 4.045 16.080 ( 9.939 17.284 -6.852) 21.083 17.429 ( -4.888 -4.253 -3.944) 7.585 19.392 ( -4.929 -7.884 -3.571) 9.960 20.077 ( 11.593 2.256 -39.748) 41.465 21.041 ( 1.051 1.234 -20.160) 20.225 22.993 ( -8.225 10.651 80.794) 81.907 25.013 ( -15.255 12.574 16.020) 25.445 28.415 ( 4.890 -3.984 -7.305) 9.651 28.859 ( 3.156 0.353 -6.939) 7.631 ======================= Grid point 221 (97/300) ======================= q-point: (-0.27 -0.27 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.053 ( -18.254 -0.000 14.313) 23.196 1.261 ( -20.222 -0.000 22.405) 30.182 2.458 ( -15.137 -0.000 24.084) 28.446 2.592 ( -32.600 -0.000 4.095) 32.856 2.702 ( -2.365 -0.000 8.094) 8.432 3.278 ( -12.869 -0.000 11.604) 17.328 4.339 ( -1.243 -0.000 4.402) 4.574 4.527 ( 1.687 0.000 1.833) 2.491 5.163 ( 4.562 0.000 -3.318) 5.641 5.794 ( 4.994 0.000 2.317) 5.506 6.047 ( 7.803 0.000 -7.479) 10.808 6.079 ( 2.908 0.000 6.481) 7.104 6.615 ( 2.706 0.000 -5.586) 6.207 6.658 ( 6.108 0.000 8.278) 10.288 6.970 ( 1.683 0.000 -0.973) 1.944 7.666 ( 13.638 0.000 -8.638) 16.143 7.788 ( -4.215 -0.000 2.218) 4.763 8.171 ( 4.782 0.000 0.571) 4.816 8.771 ( 13.871 0.000 24.837) 28.448 9.282 ( -2.853 -0.000 31.962) 32.089 10.084 ( -24.428 -0.000 -1.649) 24.483 10.627 ( -10.828 -0.000 -16.086) 19.391 11.070 ( 9.165 0.000 -6.619) 11.306 11.409 ( -9.015 -0.000 -4.632) 10.135 12.059 ( 10.913 0.000 -3.618) 11.497 12.334 ( -1.811 -0.000 -0.050) 1.811 12.966 ( -1.583 -0.000 -1.236) 2.008 13.266 ( -0.388 -0.000 6.635) 6.646 13.337 ( -0.334 -0.000 -7.259) 7.267 13.573 ( 5.383 0.000 -2.820) 6.077 13.643 ( -0.280 -0.000 2.390) 2.406 14.206 ( -7.434 -0.000 0.881) 7.486 14.475 ( 8.476 0.000 4.252) 9.483 17.119 ( -5.384 -0.000 5.985) 8.050 17.313 ( 10.005 0.000 -12.271) 15.833 19.522 ( 9.732 0.000 -55.902) 56.743 19.610 ( -6.859 -0.000 3.283) 7.604 21.196 ( -3.853 -0.000 -21.138) 21.487 23.169 ( 6.103 0.000 103.656) 103.835 27.301 ( 3.575 0.000 12.458) 12.960 27.414 ( -6.562 -0.000 -5.530) 8.581 28.307 ( 5.295 0.000 3.903) 6.579 ======================= Grid point 222 (98/300) ======================= q-point: (-0.18 -0.27 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.150 ( -15.436 -18.962 6.864) 25.396 1.304 ( -20.677 -14.722 18.528) 31.425 2.224 ( -35.584 0.367 17.021) 39.447 2.597 ( 0.159 -8.279 8.710) 12.019 2.835 ( -9.686 -12.719 12.185) 20.101 3.267 ( -10.250 -6.372 10.086) 15.729 4.337 ( -2.188 0.341 2.483) 3.327 4.559 ( 1.125 -2.793 4.876) 5.731 5.178 ( 3.456 2.172 -3.981) 5.702 5.696 ( 4.995 9.561 -3.201) 11.252 6.085 ( 1.256 1.495 0.980) 2.185 6.132 ( 9.890 0.097 1.809) 10.055 6.594 ( 2.258 1.475 -5.821) 6.416 6.816 ( 3.383 -6.181 8.407) 10.969 7.052 ( 0.456 -7.669 -2.457) 8.066 7.585 ( -10.344 13.212 6.843) 18.122 7.747 ( 10.582 0.433 -5.673) 12.014 8.335 ( 10.435 -9.419 -1.985) 14.197 8.939 ( 10.770 -1.831 8.327) 13.736 9.459 ( 7.078 -12.494 40.669) 43.130 9.840 ( -23.525 6.195 0.112) 24.327 10.476 ( -12.815 4.960 -18.157) 22.770 10.991 ( 6.096 8.124 -3.176) 10.642 11.352 ( -7.071 1.340 -4.994) 8.759 12.135 ( 4.453 0.232 -2.070) 4.916 12.276 ( 5.679 5.498 -3.225) 8.537 12.938 ( 1.694 2.192 -0.705) 2.859 13.318 ( 0.824 -2.936 2.076) 3.689 13.363 ( -5.299 -5.705 -2.742) 8.255 13.575 ( 6.284 0.152 -0.923) 6.353 13.699 ( -0.456 -3.244 -1.710) 3.696 14.180 ( -5.287 -2.844 -1.793) 6.265 14.582 ( 6.721 -3.538 4.718) 8.942 16.882 ( -1.348 20.196 -0.446) 20.246 17.361 ( 4.239 -0.289 -9.246) 10.176 19.223 ( -9.336 6.789 -17.107) 20.638 19.875 ( 3.522 -15.385 -33.789) 37.294 21.117 ( -2.605 1.670 -21.168) 21.393 23.364 ( 11.076 6.431 102.469) 103.266 26.176 ( -26.548 56.193 13.221) 63.539 28.200 ( 11.105 -18.981 -6.428) 22.911 28.464 ( 7.176 -18.194 2.709) 19.744 ======================= Grid point 223 (99/300) ======================= q-point: (-0.09 -0.27 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.447 ( -18.977 -15.477 7.172) 25.517 1.483 ( -16.268 -21.886 0.774) 27.281 2.182 ( -14.369 -13.663 5.243) 20.509 2.838 ( 3.070 -13.869 7.034) 15.851 3.060 ( -12.321 -17.062 15.797) 26.314 3.408 ( -6.068 -12.627 9.411) 16.877 4.287 ( -1.120 3.784 -0.186) 3.951 4.667 ( -0.077 -6.113 8.282) 10.294 5.094 ( 3.093 7.779 -8.272) 11.769 5.573 ( 4.080 6.173 -5.032) 8.948 6.023 ( 2.936 6.244 -1.642) 7.092 6.187 ( 5.333 0.576 5.857) 7.942 6.560 ( 0.481 2.733 -3.396) 4.386 6.848 ( -1.380 7.584 8.270) 11.305 7.154 ( -13.723 -5.810 -1.600) 14.988 7.404 ( -6.327 -6.135 8.794) 12.450 7.772 ( 8.175 3.025 -5.387) 10.247 8.595 ( 11.057 -9.932 -2.351) 15.048 9.000 ( 4.396 0.286 3.611) 5.696 9.546 ( -18.239 6.762 3.836) 19.827 9.887 ( 4.635 -13.278 23.159) 27.095 10.238 ( -3.200 8.091 -8.981) 12.504 10.947 ( 5.618 0.574 -2.733) 6.274 11.223 ( -4.807 5.869 -5.878) 9.597 12.007 ( -0.401 12.478 2.307) 12.696 12.246 ( 10.602 5.709 -8.018) 14.467 12.922 ( 4.251 1.683 0.877) 4.655 13.335 ( -5.043 -1.305 -4.276) 6.739 13.454 ( -2.114 -5.492 4.953) 7.692 13.650 ( 1.426 -2.088 -2.469) 3.534 13.750 ( 0.779 -4.256 -3.647) 5.658 14.255 ( 0.093 -8.321 -6.715) 10.693 14.679 ( 1.811 -2.437 3.961) 4.991 16.489 ( 7.147 20.261 -7.944) 22.906 17.344 ( -4.275 -0.064 -5.145) 6.689 19.196 ( -1.753 -8.795 -7.646) 11.785 20.027 ( 0.080 -6.441 -39.316) 39.840 21.040 ( 0.696 1.661 -20.002) 20.083 23.368 ( 0.961 17.162 97.498) 99.002 25.209 ( -29.628 24.268 14.675) 41.013 28.367 ( 4.498 -3.532 -5.205) 7.733 28.828 ( 7.753 -7.492 -7.163) 12.943 ======================= Grid point 233 (100/300) ======================= q-point: (-0.18 -0.18 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.854 ( -17.647 -0.000 21.317) 27.673 1.019 ( -24.015 -0.000 20.743) 31.733 1.937 ( -50.177 -0.000 27.588) 57.261 2.534 ( 0.618 0.000 11.999) 12.015 2.712 ( -0.677 -0.000 8.555) 8.582 3.134 ( -11.503 -0.000 8.457) 14.278 4.316 ( -3.516 -0.000 4.221) 5.494 4.540 ( -0.775 -0.000 2.331) 2.456 5.220 ( 4.620 0.000 -3.338) 5.700 5.861 ( 2.841 0.000 4.029) 4.930 6.128 ( 7.558 0.000 -9.818) 12.390 6.155 ( 5.766 0.000 4.425) 7.268 6.630 ( 2.084 0.000 -5.823) 6.184 6.760 ( 3.310 0.000 8.692) 9.301 7.004 ( 3.000 0.000 0.973) 3.154 7.746 ( -2.465 -0.000 3.293) 4.113 7.862 ( 17.348 0.000 -7.972) 19.092 8.254 ( 6.044 0.000 0.818) 6.099 9.010 ( 8.726 0.000 8.317) 12.055 9.468 ( 12.261 0.000 50.763) 52.223 9.730 ( -23.893 -0.000 -3.283) 24.118 10.376 ( -15.696 -0.000 -16.601) 22.847 11.161 ( 6.926 0.000 -5.942) 9.126 11.276 ( -7.580 -0.000 -1.242) 7.681 12.121 ( -2.606 -0.000 1.154) 2.850 12.374 ( 9.684 0.000 -5.534) 11.154 12.973 ( 2.840 0.000 -1.510) 3.216 13.256 ( -6.480 -0.000 0.306) 6.487 13.296 ( 0.357 0.000 0.634) 0.728 13.605 ( 0.580 0.000 -6.243) 6.270 13.674 ( 2.946 0.000 1.981) 3.550 14.107 ( -6.548 -0.000 1.666) 6.757 14.615 ( 9.053 0.000 3.072) 9.560 17.067 ( -4.576 -0.000 5.925) 7.487 17.390 ( 6.801 0.000 -14.722) 16.217 19.256 ( -21.753 -0.000 -70.329) 73.616 19.523 ( -6.715 -0.000 2.957) 7.337 21.082 ( -1.143 -0.000 -19.461) 19.495 23.754 ( 26.966 0.000 99.883) 103.459 27.317 ( -4.491 -0.000 -4.870) 6.625 27.420 ( 6.969 0.000 14.914) 16.462 28.371 ( 2.123 0.000 2.705) 3.439 ======================= Grid point 234 (101/300) ======================= q-point: (-0.09 -0.18 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.949 ( -16.825 -18.691 9.515) 26.888 1.055 ( -23.113 -13.734 16.792) 31.699 1.777 ( -34.351 -14.295 27.117) 46.040 2.646 ( 1.349 -8.718 11.324) 14.355 2.793 ( -3.682 -7.529 11.437) 14.180 3.170 ( -7.418 -9.171 8.118) 14.319 4.300 ( -3.627 0.195 2.611) 4.474 4.581 ( 0.125 -4.311 2.820) 5.153 5.208 ( 2.717 3.882 -4.950) 6.853 5.765 ( 5.326 9.580 -0.851) 10.994 6.107 ( 2.338 2.920 0.162) 3.744 6.268 ( 8.356 -0.610 0.374) 8.387 6.603 ( 1.811 2.140 -5.665) 6.321 6.868 ( -1.310 -6.564 6.819) 9.555 7.042 ( -1.103 0.743 -0.653) 1.482 7.413 ( -18.476 17.958 17.538) 31.167 7.926 ( 16.004 4.263 -7.134) 18.033 8.475 ( 9.840 -11.206 -3.569) 15.334 9.044 ( 1.959 0.989 -0.983) 2.405 9.514 ( -20.529 3.971 -0.679) 20.920 9.750 ( 4.273 -8.164 22.343) 24.168 10.280 ( 1.531 -0.027 5.665) 5.869 11.054 ( 3.908 7.047 -1.351) 8.171 11.260 ( -3.050 1.729 -4.212) 5.480 12.141 ( -0.278 0.269 0.454) 0.597 12.405 ( 12.407 3.594 -6.984) 14.684 12.981 ( 4.242 1.249 -0.571) 4.459 13.248 ( -5.906 -3.056 -6.374) 9.212 13.349 ( 0.011 -4.906 4.688) 6.785 13.597 ( -4.481 -1.193 -7.406) 8.738 13.715 ( 5.704 -2.213 0.514) 6.140 14.114 ( -3.048 -4.759 -0.297) 5.659 14.680 ( 3.905 -0.080 3.833) 5.473 16.855 ( -1.392 16.530 -3.883) 17.037 17.353 ( -0.969 3.828 -12.358) 12.973 18.974 ( -16.579 -9.578 -36.144) 40.902 19.681 ( -14.526 -15.734 -24.861) 32.812 21.043 ( 2.392 1.017 -17.595) 17.786 23.994 ( 28.746 17.144 96.743) 102.369 25.738 ( -46.450 68.136 25.699) 86.375 28.313 ( 6.980 -7.951 -7.381) 12.901 28.601 ( 12.882 -25.230 -7.203) 29.230 ======================= Grid point 245 (102/300) ======================= q-point: (-0.09 -0.09 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.732 ( -25.482 -0.000 20.128) 32.473 0.732 ( -11.828 -0.000 30.716) 32.915 1.361 ( -44.714 -0.000 39.347) 59.561 2.607 ( 2.317 0.000 17.111) 17.268 2.721 ( -2.325 -0.000 5.988) 6.423 3.032 ( -6.462 -0.000 7.992) 10.277 4.284 ( -2.840 -0.000 4.297) 5.151 4.530 ( -1.501 -0.000 2.454) 2.876 5.262 ( 2.904 0.000 -3.873) 4.841 5.896 ( -0.223 -0.000 4.293) 4.298 6.187 ( 5.702 0.000 -11.405) 12.751 6.288 ( 11.366 0.000 3.709) 11.956 6.633 ( 1.339 0.000 -6.293) 6.434 6.792 ( -2.776 -0.000 5.975) 6.588 7.057 ( 3.193 0.000 3.670) 4.865 7.738 ( -0.605 -0.000 5.252) 5.287 8.092 ( 17.487 0.000 -6.117) 18.526 8.297 ( -3.991 -0.000 -4.032) 5.674 9.023 ( -8.976 -0.000 -12.522) 15.407 9.403 ( -19.011 -0.000 -5.579) 19.812 9.652 ( -21.734 -0.000 -0.438) 21.739 10.503 ( 54.181 0.000 49.591) 73.450 11.207 ( -1.325 -0.000 4.143) 4.349 11.230 ( 5.558 0.000 -4.607) 7.219 12.045 ( -6.889 -0.000 0.625) 6.917 12.513 ( 11.269 0.000 -7.049) 13.292 13.021 ( 4.012 0.000 -1.125) 4.167 13.139 ( -8.461 -0.000 -2.640) 8.863 13.310 ( 0.287 0.000 2.417) 2.434 13.525 ( -8.090 -0.000 -9.528) 12.500 13.724 ( 2.478 0.000 2.956) 3.858 14.051 ( -2.411 -0.000 3.995) 4.666 14.735 ( 5.949 0.000 2.377) 6.406 17.037 ( -2.623 -0.000 6.447) 6.960 17.324 ( -15.797 -0.000 -37.035) 40.263 18.287 ( -79.987 -0.000 -52.360) 95.601 19.451 ( -4.521 -0.000 2.801) 5.318 21.052 ( 5.365 0.000 -15.221) 16.139 24.511 ( 31.965 0.000 53.025) 61.915 27.256 ( -1.809 -0.000 -4.243) 4.612 27.579 ( 6.053 0.000 5.165) 7.957 28.387 ( -0.591 -0.000 0.883) 1.063 ======================= Grid point 246 (103/300) ======================= q-point: ( 0.00 0.00 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.008 ( -10.014 -0.000 25.657) 27.542 1.481 ( 2.046 0.000 32.238) 32.303 1.996 ( -16.402 -0.000 42.967) 45.991 2.671 ( -7.642 -0.000 -2.718) 8.111 3.233 ( 1.869 0.000 28.202) 28.264 3.349 ( -3.098 -0.000 22.059) 22.276 4.332 ( -7.055 -0.000 5.190) 8.758 4.581 ( -0.932 -0.000 3.069) 3.207 5.163 ( 0.738 0.000 -6.327) 6.370 5.812 ( -2.480 -0.000 -8.759) 9.103 5.906 ( 4.559 0.000 -16.721) 17.332 6.412 ( 2.774 0.000 -14.101) 14.371 6.624 ( -1.233 -0.000 14.418) 14.471 6.846 ( -3.364 -0.000 7.520) 8.238 7.248 ( 2.965 0.000 6.803) 7.421 7.756 ( -41.137 -0.000 1.491) 41.164 7.937 ( 2.415 0.000 8.351) 8.693 8.204 ( 15.644 0.000 -3.906) 16.124 8.594 ( 0.162 0.000 -4.843) 4.846 8.936 ( -7.703 -0.000 -16.043) 17.797 9.951 ( -5.885 -0.000 27.433) 28.057 11.090 ( 2.111 0.000 0.315) 2.135 11.215 ( 8.768 0.000 -4.970) 10.078 11.892 ( -8.912 -0.000 -3.074) 9.427 11.953 ( 31.811 0.000 0.872) 31.823 12.438 ( 5.634 0.000 -9.284) 10.860 12.904 ( -6.662 -0.000 -6.419) 9.251 13.014 ( -5.734 -0.000 -1.802) 6.011 13.324 ( -3.266 -0.000 -0.710) 3.343 13.338 ( 22.412 0.000 -9.199) 24.226 13.895 ( 1.782 0.000 8.510) 8.695 14.193 ( 2.785 0.000 5.809) 6.442 14.858 ( -1.131 -0.000 4.770) 4.902 15.784 ( -52.271 -0.000 -7.819) 52.853 17.238 ( 0.073 0.000 11.216) 11.217 17.796 ( -12.405 -0.000 6.345) 13.934 19.508 ( -0.707 -0.000 5.460) 5.506 20.799 ( 11.605 0.000 -16.999) 20.582 25.158 ( -24.273 -0.000 31.026) 39.393 27.141 ( 3.917 0.000 -5.627) 6.856 27.415 ( -12.522 -0.000 0.144) 12.523 28.298 ( -5.148 -0.000 -5.548) 7.569 ======================= Grid point 247 (104/300) ======================= q-point: ( 0.09 0.00 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.122 ( -1.095 -10.177 21.676) 23.972 1.373 ( 0.381 9.514 34.729) 36.011 2.182 ( 0.726 -10.796 25.337) 27.551 2.728 ( -8.280 -11.990 2.590) 14.800 3.195 ( -1.768 3.032 23.597) 23.857 3.543 ( 0.706 -12.086 22.666) 25.697 4.268 ( -7.860 1.873 4.952) 9.476 4.592 ( -2.742 -0.952 3.284) 4.383 5.054 ( -0.689 8.648 -7.796) 11.663 5.689 ( 0.584 5.715 -12.225) 13.508 5.971 ( 0.284 -2.773 -10.930) 11.280 6.397 ( 2.667 -0.023 -12.825) 13.100 6.559 ( -17.903 2.128 11.427) 21.345 6.847 ( 11.789 4.789 13.210) 18.342 7.201 ( -4.604 6.156 8.304) 11.316 7.468 ( -13.564 -1.542 13.418) 19.142 8.135 ( 3.281 9.389 -3.764) 10.634 8.252 ( -7.519 -23.124 -2.700) 24.465 8.715 ( -0.721 -10.651 -1.010) 10.723 8.885 ( 6.822 2.794 -16.350) 17.935 9.933 ( -5.331 2.499 26.885) 27.523 11.087 ( -0.572 1.820 0.736) 2.045 11.259 ( 8.609 1.000 -1.998) 8.895 11.495 ( 2.458 23.195 8.264) 24.746 12.167 ( 3.445 1.686 -3.689) 5.321 12.395 ( -0.336 5.818 -9.767) 11.374 12.914 ( 0.579 -5.404 -10.480) 11.805 12.960 ( -5.608 -0.068 -3.091) 6.403 13.312 ( -2.176 -0.496 -3.172) 3.878 13.517 ( 23.991 1.243 -6.292) 24.833 14.004 ( 11.800 -3.226 2.092) 12.410 14.167 ( -1.415 1.772 5.627) 6.067 14.707 ( -10.624 5.315 6.812) 13.694 15.850 ( -15.979 -26.215 -21.783) 37.644 17.255 ( -1.583 0.828 10.864) 11.010 17.843 ( -14.076 -13.111 2.706) 19.425 19.531 ( 1.862 -1.045 5.211) 5.632 20.835 ( 11.667 1.829 -17.154) 20.827 24.957 ( -35.090 6.664 37.588) 51.851 26.364 ( 4.624 43.850 27.660) 52.050 27.907 ( -1.551 -22.687 -19.079) 29.684 28.277 ( -7.180 -3.591 -8.973) 12.039 ======================= Grid point 248 (105/300) ======================= q-point: ( 0.18 0.00 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.278 ( -0.177 -8.108 12.936) 15.269 1.560 ( 13.848 -14.917 20.790) 29.095 2.315 ( 6.923 1.394 5.589) 9.006 2.962 ( -5.972 -14.211 2.739) 15.656 3.256 ( -3.164 -7.905 20.890) 22.558 3.820 ( 3.028 -11.258 17.841) 21.312 4.176 ( -5.330 3.100 2.326) 6.590 4.572 ( -5.611 0.126 3.825) 6.791 4.882 ( 0.021 6.921 -8.749) 11.155 5.614 ( 3.452 1.108 -11.825) 12.368 5.933 ( -0.293 4.550 -7.417) 8.706 6.421 ( -9.846 1.645 7.969) 12.773 6.428 ( -2.714 -3.533 -5.104) 6.775 6.819 ( 7.120 9.721 18.150) 21.785 7.109 ( -0.237 1.582 6.702) 6.890 7.548 ( -3.805 -8.764 10.202) 13.977 7.984 ( 0.327 5.875 -4.993) 7.717 8.620 ( -9.360 -20.797 -5.149) 23.380 8.814 ( 2.040 0.337 -10.742) 10.939 8.969 ( 7.278 -10.264 -1.520) 12.674 9.886 ( -3.516 3.514 24.015) 24.524 10.926 ( -3.393 14.875 6.829) 16.716 11.248 ( -0.814 3.575 6.454) 7.423 11.305 ( 10.992 3.266 0.614) 11.483 12.010 ( -4.729 12.880 -1.253) 13.778 12.223 ( -1.618 8.108 -9.487) 12.584 12.914 ( -2.733 0.597 -2.628) 3.838 13.052 ( 4.519 -7.237 -10.732) 13.710 13.269 ( -4.955 1.765 -4.647) 7.019 13.639 ( 13.475 -2.499 -2.573) 13.944 13.967 ( -2.062 4.601 6.633) 8.331 14.338 ( 13.475 -8.679 -4.890) 16.758 14.631 ( -5.954 -0.748 3.386) 6.890 16.091 ( 9.265 -3.616 -33.948) 35.375 17.215 ( -2.013 2.790 7.761) 8.490 18.060 ( -19.307 -21.861 -9.450) 30.659 19.584 ( 5.314 -0.694 2.913) 6.100 20.844 ( 10.788 2.219 -16.552) 19.882 24.558 ( -35.871 14.439 49.255) 62.620 25.879 ( 9.811 21.744 35.016) 42.369 28.127 ( 2.709 -5.978 -16.388) 17.653 28.291 ( -6.261 -5.057 -18.303) 19.994 ======================= Grid point 249 (106/300) ======================= q-point: ( 0.27 0.00 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.581 ( 6.929 -19.045 -1.460) 20.319 2.010 ( 18.420 -15.814 12.856) 27.472 2.328 ( 6.001 0.092 -3.897) 7.156 3.126 ( -1.702 -7.981 -7.686) 11.211 3.423 ( -2.321 -5.177 8.010) 9.816 4.001 ( 3.845 -0.779 4.433) 5.920 4.108 ( -4.723 -0.091 3.824) 6.078 4.581 ( -0.947 -4.375 5.306) 6.941 4.771 ( -1.445 2.946 -4.396) 5.486 5.650 ( 4.555 -2.855 -6.743) 8.624 5.818 ( -2.693 4.482 -4.172) 6.689 6.365 ( -9.295 -0.753 11.280) 14.635 6.432 ( -0.271 3.498 -0.748) 3.587 6.698 ( 2.763 6.629 12.454) 14.376 7.147 ( 3.538 -2.096 7.412) 8.476 7.738 ( -0.766 -10.995 4.003) 11.726 7.923 ( -1.448 -1.110 -3.491) 3.939 8.677 ( 7.420 7.330 -9.903) 14.383 8.964 ( -5.134 -13.603 -0.839) 14.564 9.246 ( -2.554 -15.222 2.007) 15.565 9.864 ( 0.883 0.317 17.759) 17.784 10.619 ( -3.098 15.545 9.585) 18.523 11.183 ( -2.915 5.709 1.258) 6.532 11.312 ( 5.864 3.217 3.193) 7.412 11.707 ( -7.845 11.239 -1.206) 13.759 12.046 ( 2.029 9.733 -8.872) 13.325 12.884 ( -0.098 1.111 -1.545) 1.906 13.165 ( -0.666 -0.047 -3.544) 3.606 13.212 ( -2.395 -5.177 -7.441) 9.376 13.795 ( 8.342 -5.017 -1.753) 9.891 13.933 ( -1.386 -1.659 4.017) 4.562 14.560 ( 13.151 -5.517 -6.527) 15.684 14.615 ( -3.861 -0.716 -0.781) 4.004 15.998 ( 9.139 13.324 -23.900) 28.849 17.200 ( 5.123 -0.295 -2.057) 5.529 18.293 ( -17.480 -19.238 -24.312) 35.591 19.624 ( 6.498 1.516 0.490) 6.690 20.858 ( 9.559 1.084 -15.039) 17.853 24.171 ( -27.564 11.526 54.450) 62.109 25.691 ( 4.810 12.501 33.723) 36.286 28.175 ( -2.114 -2.590 -15.526) 15.882 28.310 ( 4.476 -1.923 -22.476) 22.998 ======================= Grid point 250 (107/300) ======================= q-point: ( 0.36 0.00 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.992 ( 8.803 -17.041 -3.512) 19.499 2.257 ( 6.564 0.498 0.729) 6.623 2.576 ( 15.553 -19.404 -6.453) 25.691 3.232 ( -0.289 -5.973 -15.304) 16.431 3.403 ( 0.295 4.530 -9.266) 10.318 3.874 ( 6.134 13.102 -12.056) 18.832 4.155 ( -8.263 -5.092 7.262) 12.122 4.610 ( 1.502 4.248 -2.025) 4.940 4.848 ( 0.847 -11.245 9.563) 14.786 5.672 ( 0.180 5.741 6.071) 8.358 5.779 ( -4.318 -5.948 -4.115) 8.424 6.258 ( -2.100 7.930 8.186) 11.589 6.404 ( -4.250 -2.201 7.047) 8.519 6.680 ( 2.405 0.381 7.747) 8.121 7.239 ( 1.753 -3.782 8.802) 9.739 7.854 ( 0.668 -1.081 -3.164) 3.409 8.067 ( -4.086 -15.858 -1.820) 16.476 8.553 ( 13.369 11.291 -9.094) 19.721 9.130 ( -6.950 -8.538 4.582) 11.925 9.406 ( -5.732 -3.491 10.077) 12.108 9.973 ( 2.741 -5.252 9.141) 10.893 10.375 ( 0.153 9.608 8.736) 12.987 10.972 ( -5.919 10.202 -1.498) 11.889 11.286 ( 1.055 2.498 2.829) 3.919 11.533 ( -9.044 2.119 -1.951) 9.491 11.857 ( 6.492 11.841 -8.814) 16.125 12.871 ( 2.672 0.923 0.173) 2.832 13.140 ( -6.810 -2.923 0.389) 7.421 13.326 ( 2.385 -6.298 -6.971) 9.693 13.862 ( -0.540 0.351 5.181) 5.221 14.032 ( 6.446 -4.506 -5.303) 9.486 14.593 ( -2.755 -0.617 -4.517) 5.327 14.706 ( 10.115 -2.286 -9.440) 14.024 15.722 ( 3.065 15.534 -11.985) 19.858 17.292 ( 11.308 -3.664 -9.320) 15.105 18.443 ( -9.798 -13.403 -37.088) 40.635 19.628 ( 4.522 1.891 1.206) 5.047 20.877 ( 7.673 1.284 -13.575) 15.646 23.937 ( -20.282 5.535 54.964) 58.847 25.558 ( -1.414 9.483 32.322) 33.714 28.158 ( -2.264 -1.259 -20.948) 21.108 28.359 ( 9.412 -1.664 -19.202) 21.449 ======================= Grid point 251 (108/300) ======================= q-point: ( 0.45 0.00 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.192 ( 3.304 3.080 -3.587) 5.767 2.313 ( 0.531 -6.678 -2.082) 7.016 3.025 ( 6.887 -14.860 -11.233) 19.860 3.219 ( 11.208 7.474 -11.996) 18.039 3.359 ( 1.595 -4.646 -23.061) 23.578 3.689 ( 8.028 5.631 -18.588) 21.015 4.145 ( -9.209 0.067 0.916) 9.255 4.516 ( -0.656 5.599 2.861) 6.322 5.101 ( 4.030 -10.747 7.630) 13.782 5.517 ( -4.557 9.416 8.909) 13.741 5.877 ( -5.314 -6.881 5.262) 10.163 6.148 ( 1.193 4.601 3.076) 5.662 6.427 ( -4.082 -1.520 11.127) 11.950 6.721 ( -0.038 -1.836 7.973) 8.182 7.328 ( -0.656 -3.414 8.218) 8.923 7.833 ( -1.451 2.443 -3.195) 4.276 8.256 ( 2.797 1.603 -7.310) 7.989 8.519 ( 7.029 -7.791 -7.252) 12.755 9.211 ( -5.747 -3.800 9.837) 12.010 9.391 ( -2.923 1.997 10.317) 10.907 9.964 ( -0.425 7.629 8.877) 11.713 10.314 ( -2.929 0.993 9.702) 10.183 10.875 ( 3.865 -2.876 -3.648) 6.043 11.247 ( -4.193 0.761 1.240) 4.439 11.449 ( -10.661 -1.649 -6.519) 12.605 11.677 ( 10.320 12.128 -6.186) 17.083 12.891 ( 4.420 0.042 3.197) 5.455 13.177 ( -7.487 -5.752 1.453) 9.553 13.452 ( 2.449 -6.591 -6.926) 9.870 13.834 ( -0.949 2.576 4.373) 5.163 14.087 ( 4.324 2.178 -6.174) 7.846 14.580 ( -1.896 0.212 -6.643) 6.911 14.765 ( 9.603 0.857 -13.429) 16.532 15.486 ( -0.106 7.788 -6.135) 9.914 17.416 ( 7.582 -2.683 -10.019) 12.847 18.563 ( 2.312 -11.067 -45.718) 47.095 19.635 ( 1.169 -0.199 3.588) 3.779 20.857 ( 5.172 3.451 -12.923) 14.341 23.866 ( -14.528 -1.002 54.957) 56.854 25.433 ( -6.151 6.440 30.717) 31.982 28.139 ( 1.782 -1.264 -23.451) 23.552 28.427 ( 7.634 -2.256 -17.142) 18.901 ======================= Grid point 252 (109/300) ======================= q-point: (-0.45 0.00 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.070 ( -3.383 7.495 -4.134) 9.204 2.333 ( -6.676 2.997 -2.247) 7.655 2.889 ( -0.669 14.847 -18.312) 23.584 3.256 ( 11.369 3.479 -13.615) 18.076 3.550 ( 8.714 -8.845 -9.866) 15.859 3.810 ( 7.406 -16.641 -22.991) 29.332 4.050 ( -8.379 2.922 -0.569) 8.892 4.417 ( 0.210 4.953 4.663) 6.806 5.230 ( -1.805 6.084 8.981) 10.997 5.394 ( -1.130 -4.098 3.792) 5.696 5.903 ( 0.242 5.261 7.858) 9.460 6.152 ( -4.220 -6.997 5.350) 9.767 6.446 ( -2.227 -1.024 9.430) 9.744 6.750 ( -3.522 -0.690 9.756) 10.395 7.372 ( -3.957 -1.429 5.308) 6.773 7.733 ( -0.302 6.509 -3.120) 7.224 8.119 ( 6.620 11.264 -7.554) 15.092 8.798 ( -3.455 -17.207 -6.602) 18.751 9.196 ( 3.817 7.386 10.101) 13.082 9.388 ( -7.695 -4.651 11.548) 14.635 9.823 ( 3.326 8.225 3.420) 9.508 10.306 ( -6.275 -3.218 12.839) 14.648 10.988 ( 3.498 -1.769 0.734) 3.988 11.217 ( -0.993 0.370 -1.759) 2.053 11.463 ( -6.107 -9.291 -12.314) 16.590 11.552 ( 9.743 6.979 -0.906) 12.019 12.933 ( 4.994 0.095 4.930) 7.018 13.232 ( -8.479 -5.548 0.008) 10.133 13.567 ( -0.331 -4.986 -5.818) 7.669 13.786 ( 2.357 2.858 2.762) 4.621 14.011 ( -0.321 5.725 -4.138) 7.071 14.499 ( 3.138 6.889 -12.924) 14.978 14.774 ( 5.247 1.797 -7.403) 9.251 15.444 ( 0.980 -4.283 -8.423) 9.500 17.435 ( -0.842 1.150 -8.932) 9.045 18.744 ( 11.594 -10.655 -45.801) 48.432 19.660 ( -1.603 -1.672 4.432) 5.000 20.781 ( 3.313 5.040 -13.196) 14.509 23.957 ( -10.560 -7.959 55.940) 57.482 25.347 ( -8.747 2.502 28.513) 29.929 28.150 ( 5.161 -1.480 -23.352) 23.962 28.489 ( 3.857 -3.154 -15.782) 16.550 ======================= Grid point 253 (110/300) ======================= q-point: (-0.36 0.00 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.879 ( -7.508 7.916 -2.427) 11.177 2.117 ( -11.813 11.607 -0.917) 16.587 2.575 ( -0.175 14.312 -14.128) 20.112 3.223 ( 8.338 5.319 -6.784) 11.993 3.694 ( -0.347 -5.750 -8.440) 10.218 3.908 ( -7.652 5.601 0.267) 9.487 4.177 ( 8.198 -11.755 -3.388) 14.726 4.388 ( 2.880 -4.170 -4.923) 7.065 5.036 ( -6.865 8.824 6.529) 12.946 5.497 ( -0.008 -1.766 0.674) 1.891 5.794 ( 4.267 5.302 3.975) 7.882 6.312 ( -4.042 -9.918 9.131) 14.074 6.457 ( -0.316 0.401 5.434) 5.458 6.751 ( -6.301 -2.345 10.790) 12.713 7.331 ( -8.036 2.123 1.922) 8.531 7.615 ( 5.218 6.164 -3.626) 8.853 7.938 ( 0.889 9.931 -2.619) 10.309 8.998 ( -8.275 -4.900 -0.678) 9.640 9.068 ( 7.811 7.437 2.164) 11.000 9.457 ( -8.289 -4.861 13.494) 16.566 9.748 ( 3.617 1.865 -3.135) 5.137 10.408 ( -2.539 -7.898 14.248) 16.487 10.979 ( -2.929 0.514 -0.269) 2.986 11.164 ( 6.015 7.130 1.034) 9.385 11.596 ( 2.777 -6.714 1.568) 7.433 11.666 ( 5.457 -13.192 -12.517) 18.987 12.968 ( 4.862 0.789 4.177) 6.459 13.253 ( -8.679 -3.162 -2.284) 9.516 13.567 ( -5.553 1.369 -4.160) 7.072 13.794 ( 5.364 0.884 0.741) 5.487 13.874 ( -3.116 6.565 -0.351) 7.275 14.356 ( 6.859 8.815 -14.409) 18.231 14.760 ( 0.630 0.618 -1.695) 1.911 15.602 ( 3.977 -11.934 -13.954) 18.787 17.362 ( -4.682 2.264 -5.999) 7.939 18.912 ( 10.668 -5.181 -39.206) 40.960 19.685 ( -3.120 -1.884 2.786) 4.587 20.690 ( 3.222 4.059 -14.365) 15.271 24.206 ( -8.631 -15.654 58.030) 60.721 25.312 ( -10.392 -0.648 26.252) 28.242 28.175 ( 6.509 -0.580 -21.329) 22.308 28.547 ( 0.434 -4.280 -15.091) 15.692 ======================= Grid point 254 (111/300) ======================= q-point: (-0.27 0.00 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.644 ( -9.653 11.038 -1.826) 14.777 1.790 ( -14.380 12.812 9.357) 21.413 2.339 ( -3.272 7.082 -3.985) 8.760 3.160 ( 3.452 5.169 0.578) 6.243 3.658 ( -8.876 9.896 11.467) 17.556 3.757 ( -0.808 5.410 -0.551) 5.498 4.249 ( -1.434 -0.152 6.853) 7.003 4.652 ( 3.748 -15.320 -10.956) 19.204 4.879 ( -4.963 3.818 1.175) 6.371 5.438 ( 3.997 5.128 -2.748) 7.058 5.850 ( 3.829 -5.825 -2.075) 7.273 6.433 ( 1.048 -0.416 12.640) 12.690 6.460 ( -0.444 -2.035 -1.593) 2.622 6.817 ( -9.259 -8.599 10.359) 16.339 7.197 ( -9.152 5.016 1.493) 10.542 7.589 ( 11.578 2.468 -4.019) 12.502 7.767 ( -5.355 5.777 4.202) 8.927 8.859 ( 5.581 11.393 2.497) 12.930 9.056 ( -3.663 1.846 -5.454) 6.824 9.451 ( -10.298 0.609 2.902) 10.717 9.786 ( -4.579 -5.092 3.841) 7.852 10.583 ( 3.915 -7.470 15.916) 18.012 10.987 ( -2.619 -4.123 -2.296) 5.398 11.084 ( 9.004 6.787 4.106) 12.000 11.807 ( 0.870 -12.965 1.135) 13.044 11.937 ( 9.369 -11.693 -10.348) 18.210 12.987 ( 4.353 1.104 2.007) 4.919 13.210 ( -7.370 1.209 -5.101) 9.044 13.475 ( -6.556 1.827 -5.733) 8.899 13.689 ( -6.355 7.346 1.502) 9.829 13.827 ( 6.960 2.594 1.022) 7.498 14.237 ( 6.065 6.489 -9.442) 12.963 14.762 ( -1.582 -1.059 1.613) 2.495 15.869 ( 5.110 -15.551 -19.151) 25.193 17.290 ( -4.623 0.817 -0.990) 4.798 18.910 ( 3.595 5.090 -30.516) 31.146 19.678 ( -6.191 -0.027 1.014) 6.274 20.644 ( 5.272 1.069 -15.930) 16.813 24.631 ( -7.159 -25.615 59.645) 65.306 25.302 ( -13.038 -2.114 25.127) 28.387 28.184 ( 5.621 0.658 -18.574) 19.417 28.592 ( -1.284 -3.047 -15.280) 15.634 ======================= Grid point 255 (112/300) ======================= q-point: (-0.18 0.00 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.370 ( -10.294 9.090 12.775) 18.756 1.473 ( -16.915 11.596 15.183) 25.517 2.249 ( -6.337 0.793 8.953) 10.997 3.092 ( -0.851 3.560 6.481) 7.444 3.316 ( -12.959 18.740 18.998) 29.666 3.620 ( 0.854 10.280 13.190) 16.744 4.285 ( -3.241 -3.987 4.420) 6.778 4.746 ( -7.177 3.321 2.928) 8.433 4.914 ( 2.273 -9.028 -8.553) 12.642 5.477 ( 10.629 -5.341 -11.465) 16.521 5.984 ( 0.736 -6.059 -4.867) 7.806 6.420 ( 3.173 2.979 -5.285) 6.847 6.512 ( 3.800 -1.352 10.568) 11.311 6.898 ( -17.628 -5.528 6.849) 19.703 7.101 ( -0.896 -0.757 7.181) 7.276 7.596 ( -2.784 1.618 11.563) 12.003 7.762 ( 9.491 -5.130 -5.637) 12.173 8.700 ( 7.263 11.478 -0.298) 13.586 8.903 ( -5.294 9.287 -11.659) 15.818 9.295 ( -19.883 3.408 -7.741) 21.607 9.858 ( -6.959 -4.856 17.132) 19.118 10.829 ( 12.387 -10.708 17.096) 23.672 11.046 ( 2.516 -0.154 1.508) 2.937 11.090 ( 4.853 -3.351 0.486) 5.918 12.040 ( 0.901 -9.580 -0.479) 9.634 12.183 ( 10.096 -8.787 -9.509) 16.418 12.999 ( 3.423 0.665 -0.189) 3.492 13.096 ( -5.214 4.121 -8.451) 10.752 13.397 ( -6.269 1.100 -7.712) 9.999 13.516 ( -5.164 6.280 1.420) 8.253 13.834 ( 7.363 1.977 3.056) 8.213 14.168 ( 2.611 3.135 -2.056) 4.568 14.773 ( -3.100 -1.308 3.807) 5.080 16.146 ( 0.994 -14.046 -23.917) 27.754 17.264 ( -3.283 -0.438 3.657) 4.934 18.636 ( -9.755 17.889 -21.295) 29.473 19.602 ( -7.901 2.365 3.013) 8.781 20.669 ( 8.194 -1.306 -16.773) 18.713 25.260 ( 10.852 -6.888 39.688) 41.718 25.320 ( -32.182 -35.753 40.914) 63.150 28.158 ( 3.937 2.909 -17.662) 18.327 28.560 ( -2.715 2.978 -15.022) 15.553 ======================= Grid point 256 (113/300) ======================= q-point: (-0.09 0.00 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.159 ( -14.054 9.814 22.611) 28.374 1.325 ( -8.734 -5.563 29.031) 30.822 2.167 ( -11.706 6.324 25.802) 29.031 2.872 ( -13.329 13.388 4.565) 19.436 3.127 ( -0.360 -0.947 24.388) 24.409 3.458 ( 0.285 10.240 20.922) 23.295 4.337 ( -4.413 -2.908 5.122) 7.360 4.629 ( -3.883 4.082 3.482) 6.623 5.077 ( 1.126 -8.162 -7.662) 11.251 5.676 ( 7.305 -9.433 -13.294) 17.863 6.010 ( -0.372 3.241 -9.194) 9.756 6.393 ( 3.896 -0.341 -11.935) 12.560 6.586 ( 6.163 0.441 13.535) 14.879 6.856 ( -14.161 -3.318 7.300) 16.274 7.183 ( 2.519 -3.286 6.875) 8.026 7.632 ( -14.170 -10.757 15.843) 23.823 7.985 ( 18.355 -7.785 -7.621) 21.345 8.408 ( -9.676 21.628 -6.565) 24.587 8.686 ( -0.347 6.867 -8.893) 11.241 9.075 ( -19.571 1.932 -11.675) 22.871 9.921 ( -6.090 -2.768 24.620) 25.513 11.066 ( 5.300 0.445 0.769) 5.374 11.133 ( 10.541 -3.752 -2.962) 11.574 11.337 ( 12.031 -22.011 15.944) 29.722 12.117 ( 3.107 3.614 -3.762) 6.071 12.362 ( 8.945 -4.473 -9.369) 13.704 12.980 ( -5.319 1.910 -7.959) 9.762 13.019 ( 1.865 -0.327 -2.069) 2.805 13.311 ( -0.553 2.778 -8.504) 8.964 13.397 ( -3.605 3.893 0.423) 5.322 13.872 ( 6.706 0.847 5.479) 8.701 14.154 ( 0.247 -0.552 4.448) 4.489 14.795 ( -3.917 -3.622 5.225) 7.467 16.208 ( -20.291 0.271 -25.739) 32.776 17.250 ( -2.188 1.427 7.776) 8.203 18.094 ( -21.314 20.141 -2.133) 29.403 19.527 ( -3.749 1.502 4.878) 6.333 20.735 ( 10.323 -1.448 -16.840) 19.805 25.239 ( -16.730 -0.771 28.284) 32.871 26.251 ( -5.246 -55.316 31.467) 63.856 27.990 ( 0.448 18.115 -20.763) 27.558 28.398 ( -5.252 6.437 -8.219) 11.686 ======================= Grid point 258 (114/300) ======================= q-point: ( 0.09 0.09 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.086 ( 8.096 0.000 24.022) 25.350 1.650 ( 5.349 0.000 33.053) 33.483 2.018 ( -2.108 -0.000 43.413) 43.464 2.601 ( 0.129 0.000 -5.013) 5.014 3.352 ( 1.321 0.000 27.746) 27.778 3.370 ( -4.881 -0.000 22.916) 23.430 4.227 ( -9.178 -0.000 5.454) 10.677 4.587 ( 0.043 0.000 3.132) 3.133 5.130 ( -2.294 -0.000 -6.651) 7.036 5.713 ( -6.242 -0.000 -8.783) 10.776 5.900 ( 2.662 0.000 -16.530) 16.743 6.404 ( 2.844 0.000 -13.833) 14.122 6.471 ( -17.935 -0.000 11.149) 21.118 7.018 ( 16.955 0.000 10.139) 19.755 7.285 ( -1.158 -0.000 7.148) 7.241 7.286 ( -26.871 -0.000 10.950) 29.016 7.994 ( 0.511 0.000 8.027) 8.043 8.216 ( -10.375 -0.000 -1.204) 10.444 8.580 ( -1.408 -0.000 -1.891) 2.358 9.012 ( 24.387 0.000 -16.017) 29.176 9.963 ( -6.352 -0.000 28.383) 29.085 11.093 ( -1.734 -0.000 1.727) 2.448 11.323 ( 7.388 0.000 -2.254) 7.724 11.769 ( -5.248 -0.000 -5.443) 7.561 12.187 ( 3.646 0.000 -2.076) 4.196 12.419 ( -3.949 -0.000 -9.942) 10.698 12.819 ( -1.989 -0.000 -5.360) 5.717 12.922 ( -3.603 -0.000 -3.417) 4.966 13.290 ( -0.315 -0.000 -3.946) 3.958 13.847 ( 44.323 0.000 -17.233) 47.555 13.929 ( -1.297 -0.000 8.972) 9.065 14.296 ( 14.699 0.000 -0.127) 14.700 14.826 ( -5.534 -0.000 5.234) 7.617 15.124 ( -37.920 -0.000 6.305) 38.441 17.286 ( 0.736 0.000 12.192) 12.215 17.701 ( -4.153 -0.000 3.513) 5.440 19.547 ( 3.247 0.000 6.237) 7.031 20.908 ( 11.864 0.000 -17.600) 21.225 24.839 ( -35.778 -0.000 42.310) 55.410 27.205 ( 7.291 0.000 -3.477) 8.078 27.262 ( -9.542 -0.000 5.306) 10.918 28.192 ( -6.412 -0.000 -7.970) 10.229 ======================= Grid point 259 (115/300) ======================= q-point: ( 0.18 0.09 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.247 ( 6.151 -2.568 22.130) 23.112 1.585 ( 12.989 4.142 31.114) 33.970 2.343 ( 8.962 -11.813 25.124) 29.173 2.663 ( -1.768 -8.730 1.735) 9.075 3.241 ( -2.980 3.825 22.548) 23.063 3.630 ( 0.193 -13.530 24.382) 27.885 4.172 ( -6.350 0.721 3.806) 7.439 4.575 ( -1.676 1.791 3.643) 4.392 5.007 ( -1.861 7.807 -7.905) 11.265 5.624 ( -3.049 1.844 -11.676) 12.207 5.945 ( 1.287 -2.702 -11.996) 12.364 6.342 ( -10.328 1.013 4.221) 11.203 6.412 ( -0.472 -0.060 -5.755) 5.775 7.047 ( -3.798 6.670 12.079) 14.311 7.167 ( 8.810 1.528 10.374) 13.695 7.373 ( -6.646 -7.805 9.700) 14.113 8.038 ( -13.302 2.602 -4.130) 14.169 8.185 ( -1.222 -13.333 1.933) 13.528 8.655 ( -4.544 -8.484 -0.014) 9.624 9.119 ( 26.432 5.802 -12.066) 29.630 9.947 ( -6.151 1.852 27.398) 28.141 11.070 ( -2.404 2.223 1.738) 3.707 11.325 ( -1.552 4.410 3.718) 5.973 11.545 ( 6.311 13.806 -0.959) 15.211 12.159 ( -2.930 5.292 -1.152) 6.157 12.300 ( -7.031 5.228 -9.985) 13.284 12.900 ( -0.857 -2.499 -2.224) 3.453 12.902 ( 1.832 -6.205 -9.222) 11.265 13.274 ( -0.639 1.484 -5.673) 5.898 13.783 ( 10.154 7.421 1.860) 12.714 14.127 ( -6.936 10.108 7.160) 14.196 14.281 ( 24.568 -2.942 -10.276) 26.792 14.600 ( -3.973 0.898 7.493) 8.528 15.648 ( -0.364 -39.577 -25.201) 46.920 17.283 ( 0.433 2.822 10.922) 11.289 17.709 ( -6.197 -4.007 2.401) 7.760 19.606 ( 5.688 -1.752 4.999) 7.773 20.937 ( 10.924 2.220 -17.533) 20.777 24.591 ( -35.972 7.419 49.312) 61.488 26.534 ( 6.487 34.723 22.734) 42.007 27.837 ( 0.389 -24.868 -14.680) 28.881 28.142 ( -7.138 -1.434 -10.259) 12.580 ======================= Grid point 260 (116/300) ======================= q-point: ( 0.27 0.09 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.366 ( 5.848 -7.914 12.859) 16.191 1.889 ( 21.514 -13.384 17.680) 30.896 2.462 ( 10.856 5.587 4.818) 13.125 2.913 ( -2.755 -13.421 5.278) 14.683 3.294 ( -1.343 -7.457 18.499) 19.991 3.905 ( -0.231 -9.306 20.115) 22.165 4.136 ( -0.013 0.174 -0.837) 0.855 4.519 ( -4.593 1.028 5.723) 7.410 4.849 ( -0.232 6.437 -9.401) 11.396 5.601 ( 0.800 -2.561 -11.928) 12.226 5.898 ( -2.052 5.306 -5.760) 8.097 6.304 ( -7.212 -1.439 7.775) 10.702 6.424 ( 2.060 -1.967 -7.733) 8.241 6.888 ( -5.207 8.348 12.493) 15.902 7.217 ( 10.801 3.202 9.383) 14.662 7.524 ( -4.464 -10.539 9.460) 14.849 7.906 ( -6.735 1.529 -5.590) 8.885 8.499 ( -5.439 -20.713 -3.049) 21.631 8.796 ( -1.953 -8.484 -1.018) 8.766 9.146 ( 17.871 5.177 -6.036) 19.561 9.916 ( -3.964 1.754 24.377) 24.760 10.896 ( -4.176 14.135 5.642) 15.782 11.215 ( -5.686 2.047 5.303) 8.040 11.458 ( 9.793 5.848 -0.752) 11.431 11.906 ( -8.237 14.873 -3.678) 17.395 12.168 ( -1.479 4.654 -7.880) 9.271 12.900 ( 1.836 0.111 -0.379) 1.878 13.080 ( 3.958 -8.472 -8.349) 12.536 13.186 ( -3.552 4.519 -6.960) 9.027 13.788 ( 7.725 -0.654 -0.948) 7.810 13.925 ( -6.590 3.465 6.933) 10.174 14.490 ( 2.587 -7.063 -2.981) 8.091 14.632 ( 10.725 0.198 1.021) 10.776 16.096 ( 6.150 -7.985 -30.968) 32.567 17.270 ( 9.567 1.640 -0.148) 9.707 17.793 ( -14.560 -13.609 -4.003) 20.328 19.690 ( 7.989 -0.719 1.077) 8.093 20.931 ( 9.285 2.510 -16.509) 19.107 24.266 ( -30.399 10.325 54.665) 63.395 26.114 ( 7.116 22.159 31.103) 38.846 28.090 ( -2.614 -2.245 -13.458) 13.892 28.172 ( 1.198 -11.654 -19.355) 22.625 ======================= Grid point 261 (117/300) ======================= q-point: ( 0.36 0.09 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.698 ( 10.015 -18.629 -1.555) 21.208 2.341 ( 20.991 -14.136 10.768) 27.503 2.414 ( 6.973 4.816 -0.707) 8.504 3.072 ( -2.251 -7.030 -6.862) 10.078 3.459 ( 3.881 -3.309 4.829) 7.023 3.998 ( -6.130 -3.157 10.231) 12.337 4.107 ( 3.431 6.684 -4.453) 8.734 4.607 ( 0.605 -10.268 10.698) 14.841 4.726 ( -2.248 3.574 -6.285) 7.571 5.666 ( 0.980 -4.202 -10.776) 11.608 5.758 ( -4.698 5.122 1.909) 7.208 6.294 ( -5.145 -0.740 9.329) 10.679 6.431 ( 0.558 3.014 -1.354) 3.351 6.755 ( 0.604 4.297 7.333) 8.521 7.245 ( 5.174 1.029 9.103) 10.521 7.727 ( -3.085 -12.562 3.962) 13.529 7.868 ( -2.686 -1.495 -3.259) 4.480 8.781 ( 6.209 -5.742 -5.323) 9.993 8.907 ( 1.241 -5.272 -2.614) 6.014 9.219 ( -2.406 -8.010 3.566) 9.092 9.937 ( 0.545 -2.046 18.043) 18.167 10.605 ( -3.468 13.851 7.788) 16.264 11.102 ( -8.073 7.576 0.489) 11.082 11.392 ( 3.293 6.426 0.862) 7.272 11.584 ( -7.359 10.553 -2.652) 13.136 12.053 ( 3.089 6.918 -8.865) 11.662 12.919 ( 5.049 0.781 1.577) 5.347 13.064 ( -6.998 1.302 -5.239) 8.839 13.237 ( 4.759 -5.439 -4.510) 8.519 13.854 ( -0.711 -1.399 2.945) 3.337 13.945 ( 3.095 -6.497 -2.679) 7.679 14.547 ( -5.118 -1.796 -2.414) 5.936 14.742 ( 14.764 -1.200 -4.073) 15.362 15.986 ( -2.669 12.730 -13.426) 18.693 17.355 ( 19.861 0.769 -10.351) 22.410 17.988 ( -12.741 -19.278 -22.392) 32.178 19.727 ( 7.849 2.847 -1.738) 8.528 20.927 ( 7.236 1.327 -14.791) 16.520 24.002 ( -23.031 7.464 56.139) 61.137 25.850 ( 1.047 16.210 32.980) 36.764 28.074 ( -2.598 -1.944 -18.147) 18.435 28.331 ( 7.566 -5.333 -18.820) 20.973 ======================= Grid point 262 (118/300) ======================= q-point: ( 0.45 0.09 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.104 ( 8.766 -15.645 -4.401) 18.466 2.341 ( 6.196 6.363 -2.726) 9.290 2.765 ( 10.817 -15.585 -0.640) 18.982 3.154 ( -2.916 -6.239 -15.467) 16.931 3.471 ( 13.851 5.831 -9.378) 17.714 3.904 ( 2.484 10.669 -9.851) 14.732 4.060 ( -6.719 -2.156 3.136) 7.722 4.599 ( -1.471 4.380 -3.025) 5.522 4.907 ( 1.936 -13.650 11.795) 18.144 5.605 ( -11.152 3.583 3.332) 12.178 5.751 ( 0.285 -2.742 0.668) 2.836 6.267 ( -0.105 4.415 6.592) 7.934 6.381 ( -2.302 -0.697 7.054) 7.453 6.744 ( 3.626 1.028 4.566) 5.920 7.290 ( 0.785 -1.750 8.437) 8.652 7.854 ( 1.548 0.006 -2.548) 2.982 7.994 ( -5.518 -15.992 -1.265) 16.965 8.745 ( 16.593 12.829 -7.889) 22.409 9.045 ( -7.228 -9.229 4.559) 12.578 9.358 ( -5.434 -6.864 9.154) 12.666 10.038 ( 1.485 -2.206 11.724) 12.022 10.389 ( -3.063 7.998 7.431) 11.339 10.879 ( -5.575 5.605 -3.332) 8.579 11.278 ( -3.784 5.256 1.015) 6.556 11.407 ( -5.806 4.510 -2.121) 7.651 11.925 ( 6.777 8.851 -8.943) 14.292 12.941 ( 5.664 1.080 0.934) 5.841 13.037 ( -6.009 -3.626 0.092) 7.019 13.356 ( 4.039 -5.052 -3.782) 7.492 13.859 ( -2.097 0.280 5.353) 5.756 14.090 ( 4.531 -4.533 -8.037) 10.280 14.526 ( -4.120 -1.376 -5.852) 7.288 14.837 ( 12.605 0.489 -8.605) 15.270 15.667 ( -6.789 13.835 -5.056) 16.219 17.447 ( 12.641 0.812 -8.807) 15.428 18.237 ( 2.042 -17.126 -39.580) 43.175 19.703 ( 5.657 4.003 -0.793) 6.975 20.920 ( 4.749 1.869 -13.415) 14.353 23.864 ( -16.819 2.422 55.637) 58.174 25.622 ( -5.540 12.496 32.626) 35.374 28.071 ( 0.634 -2.212 -21.901) 22.021 28.424 ( 8.694 -2.011 -17.526) 19.667 ======================= Grid point 263 (119/300) ======================= q-point: ( 0.55 0.09 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.225 ( 3.653 8.643 -2.681) 9.759 2.316 ( 0.686 -2.160 -3.609) 4.261 2.981 ( -1.828 -2.035 -13.846) 14.114 3.239 ( 0.218 -8.287 -20.356) 21.979 3.524 ( 21.616 -0.869 -8.120) 23.107 3.733 ( 8.513 6.502 -20.426) 23.064 4.017 ( -8.239 0.283 -1.044) 8.309 4.508 ( -1.691 4.252 2.579) 5.253 5.175 ( 2.609 -10.821 8.169) 13.807 5.427 ( -11.887 7.289 7.654) 15.906 5.842 ( -2.632 -7.467 7.279) 10.755 6.171 ( 0.592 6.439 2.887) 7.081 6.418 ( -2.730 -2.103 12.025) 12.509 6.759 ( 1.627 0.971 6.552) 6.820 7.335 ( -1.830 -1.571 6.074) 6.535 7.826 ( 1.595 3.795 -1.560) 4.402 8.232 ( -2.800 -9.967 -6.563) 12.258 8.605 ( 8.175 6.853 -7.180) 12.859 9.159 ( -6.141 -7.346 9.553) 13.526 9.414 ( 1.131 1.075 9.778) 9.901 10.005 ( 1.627 7.078 8.824) 11.429 10.259 ( -9.058 2.820 9.786) 13.630 10.926 ( 3.615 -8.515 -3.045) 9.739 11.179 ( -4.725 0.123 -2.791) 5.489 11.302 ( -6.108 1.243 -3.594) 7.195 11.790 ( 8.091 9.664 -5.635) 13.806 12.969 ( 2.431 -0.740 0.937) 2.708 13.086 ( -2.922 -4.075 2.619) 5.657 13.471 ( 2.856 -5.049 -4.614) 7.413 13.840 ( -0.260 1.383 3.959) 4.202 14.096 ( -0.016 3.902 -7.049) 8.057 14.539 ( 0.219 -1.808 -9.096) 9.276 14.869 ( 10.652 3.276 -11.848) 16.266 15.421 ( -6.023 5.110 -4.683) 9.183 17.453 ( 1.834 2.423 -8.676) 9.193 18.519 ( 14.168 -14.372 -45.664) 49.925 19.672 ( 2.434 2.289 2.182) 3.991 20.868 ( 2.666 3.992 -12.917) 13.780 23.865 ( -12.642 -3.330 55.059) 56.589 25.432 ( -8.962 7.808 30.934) 33.139 28.095 ( 3.814 -2.969 -23.814) 24.299 28.470 ( 6.480 -0.338 -16.530) 17.758 ======================= Grid point 264 (120/300) ======================= q-point: (-0.36 0.09 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.040 ( 1.188 11.893 -2.916) 12.303 2.229 ( -5.980 7.466 -2.552) 9.901 2.815 ( -0.718 12.475 -19.823) 23.433 3.346 ( 8.750 0.023 -14.317) 16.779 3.585 ( 2.099 -1.757 -14.663) 14.916 3.825 ( -1.275 -7.118 -14.094) 15.841 4.029 ( 10.336 -6.506 -3.690) 12.759 4.427 ( -1.048 3.864 4.084) 5.719 5.175 ( -9.716 9.632 8.870) 16.305 5.402 ( 0.655 -7.939 3.868) 8.855 5.949 ( 2.228 2.999 8.348) 9.146 6.105 ( -5.191 -5.800 6.231) 9.970 6.450 ( -1.949 -1.164 9.923) 10.180 6.737 ( -3.184 2.161 9.703) 10.438 7.327 ( -4.098 1.433 3.422) 5.528 7.744 ( 2.944 5.495 -2.090) 6.575 8.186 ( 6.534 11.852 -7.714) 15.578 8.683 ( -8.937 -13.123 -6.628) 17.205 9.271 ( 0.315 -3.217 11.761) 12.197 9.365 ( -0.587 4.293 10.311) 11.185 9.898 ( 5.656 7.961 3.106) 10.248 10.239 ( -9.230 -6.426 12.586) 16.879 10.994 ( -2.501 0.942 1.833) 3.241 11.214 ( -0.024 -0.630 -0.267) 0.685 11.377 ( 1.123 -15.169 -11.864) 19.290 11.678 ( 7.880 6.668 -1.102) 10.381 12.999 ( -0.313 -1.269 0.703) 1.483 13.139 ( -1.663 -2.625 1.907) 3.646 13.538 ( -1.106 -1.333 -3.818) 4.193 13.837 ( 3.271 0.388 1.338) 3.555 13.968 ( -3.299 6.295 -3.993) 8.153 14.518 ( 5.722 4.598 -12.890) 14.834 14.818 ( 3.377 5.044 -6.540) 8.922 15.413 ( 0.220 -7.376 -11.753) 13.878 17.372 ( -2.946 3.444 -8.688) 9.799 18.784 ( 15.124 -10.136 -43.586) 47.236 19.659 ( -0.865 0.521 4.030) 4.154 20.776 ( 2.519 4.924 -13.427) 14.522 23.994 ( -11.740 -9.480 55.613) 57.624 25.319 ( -8.698 3.090 28.543) 29.999 28.149 ( 6.409 -3.050 -24.009) 25.036 28.478 ( 2.168 -0.572 -15.714) 15.873 ======================= Grid point 265 (121/300) ======================= q-point: (-0.27 0.09 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.808 ( -0.811 12.347 -3.711) 12.918 1.985 ( -6.527 13.228 3.605) 15.185 2.517 ( -0.460 13.952 -16.511) 21.621 3.293 ( 5.066 6.581 -9.347) 12.503 3.660 ( -0.538 -4.428 -7.176) 8.449 3.811 ( -4.526 0.875 -3.812) 5.981 4.279 ( 4.482 -2.198 4.067) 6.439 4.407 ( 3.703 -7.936 -7.710) 11.668 4.948 ( -7.918 7.940 5.712) 12.584 5.513 ( 1.777 -1.420 2.051) 3.063 5.856 ( 2.859 4.744 2.093) 5.922 6.288 ( -3.820 -11.795 9.698) 15.740 6.466 ( -1.575 -0.268 7.537) 7.704 6.690 ( -7.587 0.008 11.133) 13.473 7.235 ( -5.717 4.690 1.961) 7.650 7.689 ( 6.688 2.763 -3.331) 7.966 7.965 ( 4.372 13.968 -3.149) 14.971 8.817 ( -13.625 -9.803 -6.099) 17.859 9.184 ( 5.582 10.958 3.803) 12.872 9.428 ( -3.883 -4.163 16.455) 17.412 9.788 ( 3.324 6.854 -1.953) 7.864 10.397 ( -5.635 -12.531 13.650) 19.368 10.966 ( 1.887 0.759 -0.400) 2.073 11.219 ( 0.727 0.865 2.767) 2.989 11.619 ( 2.542 -7.663 -2.333) 8.404 11.748 ( 7.812 -11.133 -6.919) 15.259 13.010 ( -2.121 -0.864 -0.572) 2.361 13.161 ( -1.255 -0.587 -0.705) 1.554 13.489 ( -3.632 3.343 -3.425) 6.008 13.784 ( -3.141 6.664 -1.880) 7.603 13.895 ( 3.301 0.595 1.669) 3.747 14.419 ( 8.783 8.312 -13.385) 18.039 14.750 ( -1.476 1.507 -1.933) 2.861 15.609 ( 5.364 -13.252 -18.594) 23.455 17.279 ( -3.876 2.162 -4.994) 6.681 18.922 ( 9.062 -2.168 -38.508) 39.619 19.642 ( -4.695 0.371 4.166) 6.287 20.697 ( 5.070 3.220 -14.735) 15.912 24.243 ( -14.870 -16.853 57.146) 61.407 25.284 ( -5.862 0.492 27.226) 27.854 28.198 ( 7.475 -0.690 -22.117) 23.356 28.483 ( -1.885 -3.042 -15.956) 16.352 ======================= Grid point 266 (122/300) ======================= q-point: (-0.18 0.09 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.538 ( -3.852 14.190 -2.479) 14.911 1.688 ( -4.777 15.403 13.830) 21.244 2.292 ( -0.839 6.367 -5.623) 8.536 3.184 ( 0.927 5.831 -3.755) 6.997 3.563 ( -9.837 11.249 11.175) 18.660 3.795 ( 5.437 3.234 1.491) 6.499 4.229 ( -4.621 1.422 7.305) 8.760 4.637 ( -1.148 -9.526 -6.326) 11.492 4.829 ( -2.131 0.478 -1.382) 2.584 5.510 ( 7.185 2.232 -4.343) 8.687 5.875 ( 1.032 -4.201 -2.860) 5.186 6.446 ( -0.583 -2.094 -1.354) 2.560 6.494 ( 0.140 -4.830 16.069) 16.780 6.676 ( -14.125 -3.928 10.730) 18.168 7.115 ( -3.541 3.489 3.123) 5.871 7.729 ( -0.158 3.780 1.223) 3.976 7.752 ( 10.734 5.030 -1.608) 11.962 8.835 ( -8.275 -2.308 -6.176) 10.580 9.020 ( 1.586 10.039 -1.230) 10.237 9.348 ( -5.826 11.878 0.282) 13.233 9.761 ( -2.421 -3.464 12.023) 12.744 10.643 ( -2.638 -14.288 14.124) 20.263 11.010 ( 6.846 -2.165 -1.784) 7.399 11.202 ( 4.818 3.222 5.422) 7.937 11.815 ( -0.139 -12.838 0.515) 12.849 12.023 ( 6.519 -12.420 -9.202) 16.776 13.001 ( -3.375 -0.585 -1.994) 3.964 13.133 ( -0.251 2.807 -5.247) 5.956 13.390 ( -3.259 2.864 -3.890) 5.827 13.624 ( -1.476 7.884 -1.288) 8.124 13.905 ( 2.915 1.014 3.055) 4.343 14.307 ( 8.425 7.897 -9.001) 14.641 14.730 ( -3.666 -0.760 0.991) 3.873 15.885 ( 8.145 -14.102 -24.745) 29.623 17.231 ( -3.846 -0.323 1.162) 4.031 18.822 ( -2.051 10.405 -31.943) 33.657 19.589 ( -6.586 1.365 4.880) 8.310 20.688 ( 8.611 0.141 -16.023) 18.191 24.606 ( -24.272 -25.651 55.632) 65.895 25.316 ( 1.502 -1.346 30.165) 30.233 28.198 ( 5.538 1.728 -18.831) 19.704 28.500 ( -3.495 -2.953 -17.620) 18.205 ======================= Grid point 267 (123/300) ======================= q-point: (-0.09 0.09 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.289 ( -7.583 6.784 13.456) 16.870 1.394 ( -1.357 15.873 20.435) 25.911 2.238 ( 0.755 1.344 6.952) 7.121 3.050 ( -6.113 9.804 -0.001) 11.553 3.247 ( -7.007 13.080 23.603) 27.880 3.709 ( 4.019 10.466 15.393) 19.043 4.243 ( -4.982 -4.077 4.323) 7.754 4.653 ( -7.055 1.267 2.475) 7.583 4.907 ( 0.857 -7.771 -8.580) 11.608 5.575 ( 8.057 -4.254 -11.953) 15.029 5.964 ( -0.623 -4.706 -6.066) 7.703 6.429 ( 1.976 2.210 -8.300) 8.814 6.619 ( -7.968 -1.113 11.810) 14.290 6.662 ( -5.510 -7.112 15.752) 18.140 7.110 ( -1.808 -3.573 7.246) 8.278 7.570 ( -4.796 6.087 11.624) 13.971 7.913 ( 11.317 -7.788 -5.953) 14.973 8.741 ( -3.034 17.202 -3.145) 17.748 8.823 ( 2.013 3.342 -12.734) 13.318 9.016 ( -13.360 11.345 -5.651) 18.416 9.855 ( -3.887 -4.561 22.451) 23.237 10.944 ( -2.506 -16.149 10.648) 19.505 11.122 ( 11.532 -3.853 -0.280) 12.162 11.211 ( 5.463 -0.074 6.115) 8.201 12.046 ( -0.220 -10.519 -1.029) 10.571 12.251 ( 3.420 -9.772 -9.484) 14.041 12.979 ( -3.947 -0.247 -3.472) 5.262 13.042 ( 1.217 5.186 -9.537) 10.923 13.338 ( -1.712 0.532 -3.706) 4.117 13.491 ( 5.076 6.315 -2.898) 8.605 13.931 ( 3.970 -1.067 4.845) 6.354 14.216 ( 5.891 6.236 -2.700) 8.993 14.714 ( -6.644 -0.959 3.678) 7.655 16.095 ( 5.341 -4.996 -30.117) 30.993 17.235 ( -3.559 -1.779 6.852) 7.924 18.375 ( -17.423 23.751 -16.591) 33.808 19.541 ( -1.763 1.178 4.856) 5.299 20.747 ( 10.648 -1.812 -16.697) 19.886 24.928 ( -37.624 -19.141 41.193) 58.982 25.595 ( 11.802 -21.356 41.065) 47.767 28.145 ( 3.081 4.455 -17.978) 18.776 28.442 ( -5.823 3.301 -17.092) 18.355 ======================= Grid point 270 (124/300) ======================= q-point: ( 0.18 0.18 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.339 ( 13.854 0.000 23.554) 27.326 1.833 ( 3.468 0.000 31.888) 32.076 2.220 ( 10.108 0.000 37.888) 39.213 2.649 ( 9.173 0.000 -4.610) 10.266 3.373 ( -5.642 -0.000 23.495) 24.163 3.466 ( 1.664 0.000 26.955) 27.006 4.150 ( -3.245 -0.000 4.124) 5.248 4.597 ( -0.512 -0.000 3.314) 3.354 5.058 ( -3.996 -0.000 -7.697) 8.672 5.605 ( -3.771 -0.000 -9.112) 9.861 5.869 ( 0.986 0.000 -15.814) 15.844 6.300 ( -11.561 -0.000 10.734) 15.776 6.397 ( 2.883 0.000 -13.462) 13.767 7.010 ( -17.744 -0.000 10.940) 20.846 7.264 ( -5.164 -0.000 6.590) 8.373 7.329 ( 19.378 0.000 10.765) 22.167 7.911 ( -14.481 -0.000 -1.801) 14.593 8.121 ( -1.012 -0.000 5.327) 5.423 8.538 ( -4.201 -0.000 1.603) 4.497 9.373 ( 30.326 0.000 -11.777) 32.532 9.962 ( -7.538 -0.000 28.449) 29.430 11.062 ( -3.412 -0.000 2.731) 4.370 11.364 ( -2.551 -0.000 1.349) 2.886 11.751 ( 7.101 0.000 -8.473) 11.055 12.154 ( -6.089 -0.000 1.315) 6.229 12.275 ( -10.343 -0.000 -10.636) 14.836 12.804 ( 1.511 0.000 -3.420) 3.739 12.894 ( 1.080 0.000 -2.138) 2.395 13.286 ( 2.017 0.000 -6.387) 6.698 13.922 ( -3.664 -0.000 8.033) 8.829 14.093 ( -1.338 -0.000 2.027) 2.429 14.625 ( -4.137 -0.000 12.965) 13.609 14.750 ( -7.831 -0.000 7.530) 10.864 14.934 ( 42.790 0.000 -42.798) 60.520 17.337 ( 0.340 0.000 12.633) 12.637 17.698 ( 3.077 0.000 0.035) 3.078 19.634 ( 5.332 0.000 6.948) 8.758 21.005 ( 10.336 0.000 -18.111) 20.853 24.501 ( -33.796 -0.000 52.794) 62.685 27.186 ( -4.620 -0.000 7.845) 9.105 27.323 ( 10.534 0.000 -1.358) 10.621 28.065 ( -6.989 -0.000 -10.054) 12.245 ======================= Grid point 271 (125/300) ======================= q-point: ( 0.27 0.18 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.422 ( 6.716 4.088 25.080) 26.283 1.901 ( 15.423 -4.166 23.771) 28.640 2.578 ( 9.674 -13.926 27.304) 32.140 2.703 ( 8.452 -0.095 -1.534) 8.591 3.268 ( -3.670 3.699 21.524) 22.145 3.728 ( 2.226 -13.969 25.028) 28.748 4.135 ( -0.449 0.745 1.421) 1.666 4.558 ( -2.920 3.681 3.528) 5.876 4.953 ( -1.430 5.905 -8.424) 10.387 5.545 ( -1.882 0.320 -11.910) 12.062 5.911 ( -1.213 -2.167 -9.460) 9.780 6.235 ( -6.161 -0.969 4.752) 7.841 6.410 ( 2.926 -0.682 -9.048) 9.533 6.914 ( -14.008 0.547 10.094) 17.274 7.302 ( -6.526 -6.799 5.691) 11.009 7.437 ( 15.312 3.947 11.946) 19.818 7.827 ( -12.019 -2.105 -5.378) 13.334 8.187 ( -0.635 -8.017 3.734) 8.867 8.591 ( -5.381 -8.077 4.087) 10.531 9.469 ( 27.056 9.426 -9.710) 30.251 9.947 ( -7.003 0.873 27.425) 28.319 11.033 ( -3.600 2.521 1.682) 4.706 11.260 ( -8.090 6.675 4.783) 11.528 11.665 ( 9.616 9.328 -3.299) 13.797 12.076 ( -7.159 8.862 -6.945) 13.343 12.166 ( -6.479 -0.913 -5.857) 8.782 12.909 ( 3.509 -5.490 -5.668) 8.636 12.920 ( 3.798 -4.491 0.038) 5.882 13.251 ( 0.298 4.244 -7.647) 8.751 13.853 ( -0.261 2.989 5.570) 6.327 14.008 ( -12.385 8.605 7.138) 16.685 14.400 ( -1.125 1.269 -0.974) 1.956 14.738 ( 11.654 -0.156 5.791) 13.014 15.683 ( 20.776 -31.863 -38.718) 54.276 17.343 ( 2.670 0.815 8.397) 8.849 17.692 ( 4.202 3.388 -0.512) 5.422 19.712 ( 6.262 -2.430 5.043) 8.399 21.017 ( 8.845 2.536 -17.948) 20.169 24.305 ( -29.763 6.203 56.376) 64.051 26.696 ( 5.811 29.042 20.007) 35.742 27.825 ( 3.971 -23.320 -10.149) 25.741 28.009 ( -6.019 -1.234 -11.829) 13.330 ======================= Grid point 272 (126/300) ======================= q-point: ( 0.36 0.18 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.517 ( 8.847 -7.348 11.914) 16.559 2.231 ( 16.126 -12.330 15.505) 25.544 2.651 ( 13.829 8.843 5.063) 17.178 2.916 ( -0.195 -9.139 6.801) 11.394 3.337 ( -1.630 -9.246 16.760) 19.211 3.975 ( 2.292 -2.146 15.433) 15.749 4.163 ( 3.162 -3.780 0.935) 5.016 4.471 ( -5.684 -0.426 7.764) 9.632 4.817 ( 0.751 6.876 -10.108) 12.248 5.562 ( -0.156 -4.734 -12.873) 13.717 5.822 ( -7.178 5.526 0.000) 9.059 6.277 ( 0.788 -1.743 2.588) 3.218 6.433 ( 2.652 -1.512 -6.630) 7.299 6.817 ( -8.315 2.359 8.115) 11.856 7.358 ( 0.729 1.966 5.003) 5.425 7.507 ( -0.992 -6.671 9.978) 12.043 7.819 ( -1.035 -2.375 -3.981) 4.750 8.432 ( -3.815 -18.641 -0.395) 19.032 8.757 ( -4.174 -12.220 4.578) 13.700 9.395 ( 19.148 13.868 -6.122) 24.423 9.944 ( -3.580 -0.332 23.613) 23.885 10.840 ( -6.294 13.027 4.347) 15.107 11.138 ( -6.918 2.673 2.844) 7.943 11.555 ( 2.293 8.267 -0.416) 8.589 11.784 ( -3.709 14.242 -7.914) 16.710 12.125 ( -1.293 1.699 -6.921) 7.243 12.961 ( 5.970 -0.451 1.850) 6.266 13.088 ( -0.843 2.539 -5.793) 6.381 13.146 ( 2.946 -4.778 -6.146) 8.324 13.835 ( -5.246 1.852 2.664) 6.169 13.864 ( 0.207 -2.882 2.961) 4.137 14.439 ( -5.441 -4.571 -2.247) 7.453 14.842 ( 13.238 -0.291 3.750) 13.762 16.040 ( -0.126 -3.022 -22.882) 23.081 17.483 ( 18.223 -10.052 -15.052) 25.684 17.646 ( -0.193 2.425 -0.241) 2.444 19.801 ( 6.746 -0.825 0.807) 6.844 20.987 ( 6.632 2.864 -16.960) 18.435 24.077 ( -23.858 7.618 58.118) 63.285 26.290 ( 3.097 23.315 28.190) 36.713 27.984 ( -3.442 -2.597 -15.027) 15.633 28.180 ( 6.538 -13.195 -14.829) 20.899 ======================= Grid point 273 (127/300) ======================= q-point: ( 0.45 0.18 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.843 ( 10.909 -17.127 -2.351) 20.441 2.487 ( 3.425 0.870 3.113) 4.709 2.668 ( 18.396 -3.181 8.870) 20.669 3.017 ( -2.535 -4.179 -5.605) 7.437 3.540 ( 3.763 -7.439 4.350) 9.404 3.960 ( -1.576 3.212 4.175) 5.499 4.133 ( 1.763 6.751 -2.475) 7.404 4.656 ( -3.508 -8.319 6.647) 11.212 4.679 ( 3.233 -0.833 -0.778) 3.428 5.581 ( -7.622 2.006 -7.008) 10.546 5.718 ( -2.440 -1.287 1.487) 3.134 6.290 ( 0.053 0.197 7.739) 7.741 6.438 ( 1.091 2.947 -1.654) 3.551 6.780 ( 0.669 -0.517 3.935) 4.025 7.319 ( 1.028 2.351 5.208) 5.806 7.678 ( -5.349 -12.201 3.379) 13.744 7.862 ( 2.965 -1.418 -0.523) 3.328 8.747 ( -6.111 -16.449 1.222) 17.590 8.998 ( 6.114 -10.893 -1.098) 12.539 9.232 ( 5.178 10.421 0.751) 11.661 10.004 ( 0.349 -3.523 17.504) 17.859 10.563 ( -6.059 11.987 5.833) 14.643 10.973 ( -9.247 8.954 -1.792) 12.996 11.372 ( -6.404 8.345 0.784) 10.548 11.538 ( 2.976 10.739 -4.101) 11.875 12.063 ( 2.461 3.983 -9.708) 10.778 12.957 ( -5.242 2.175 -5.335) 7.789 13.029 ( 8.596 0.284 3.920) 9.452 13.297 ( 5.071 -4.942 -0.820) 7.128 13.830 ( -3.380 -2.191 3.911) 5.615 13.972 ( 2.169 -7.689 -6.116) 10.062 14.451 ( -6.693 -2.113 -4.670) 8.430 14.937 ( 13.436 0.749 -1.081) 13.500 15.844 ( -11.141 12.478 -6.198) 17.839 17.586 ( 6.144 4.854 -3.652) 8.640 17.874 ( 18.872 -18.554 -34.208) 43.251 19.822 ( 6.163 3.311 -1.730) 7.207 20.954 ( 3.752 1.691 -15.449) 15.988 23.908 ( -17.964 4.948 57.801) 60.731 25.940 ( -4.237 19.436 31.484) 37.242 27.996 ( 0.872 -2.685 -18.659) 18.872 28.384 ( 8.202 -6.251 -15.912) 18.961 ======================= Grid point 274 (128/300) ======================= q-point: ( 0.55 0.18 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.205 ( 7.658 -12.149 -5.754) 15.471 2.417 ( 5.639 7.184 -1.355) 9.233 2.867 ( 4.584 -5.434 -1.302) 7.227 3.052 ( -3.999 -5.058 -14.527) 15.893 3.696 ( 19.365 -1.672 -5.938) 20.324 3.841 ( -6.910 4.827 -3.985) 9.323 4.030 ( 3.103 6.520 -6.512) 9.723 4.551 ( -3.508 2.880 -4.126) 6.134 4.983 ( 2.750 -13.293 13.061) 18.838 5.433 ( -13.889 3.707 4.292) 15.002 5.750 ( -1.110 -2.452 1.843) 3.262 6.298 ( 1.643 3.638 3.632) 5.397 6.385 ( -1.124 -0.013 8.867) 8.938 6.813 ( 3.897 0.631 3.778) 5.465 7.315 ( -0.210 -0.386 4.606) 4.627 7.888 ( 2.416 -3.073 -2.654) 4.725 7.902 ( -5.422 -11.444 0.730) 12.684 8.936 ( 8.350 7.744 -0.740) 11.412 8.962 ( -2.476 -1.286 0.707) 2.878 9.331 ( -1.529 -11.879 6.739) 13.743 10.098 ( 1.135 -0.679 12.391) 12.462 10.327 ( -8.822 9.206 6.715) 14.411 10.801 ( -3.236 -0.887 -4.603) 5.696 11.187 ( -7.618 5.890 0.161) 9.631 11.382 ( 2.035 7.670 -1.525) 8.081 11.974 ( 4.336 6.356 -9.475) 12.206 12.909 ( -5.020 -1.568 -4.456) 6.893 13.100 ( 8.640 -0.054 6.816) 11.005 13.408 ( 4.446 -3.873 -1.320) 6.043 13.846 ( -2.062 -0.678 4.717) 5.193 14.096 ( 0.359 -3.377 -9.263) 9.866 14.444 ( -3.403 -4.034 -8.862) 10.315 14.990 ( 11.954 2.739 -6.771) 14.009 15.512 ( -11.982 11.458 -2.444) 16.758 17.521 ( 1.167 4.161 -5.555) 7.038 18.282 ( 23.494 -15.517 -42.733) 51.175 19.775 ( 4.600 5.050 -0.619) 6.859 20.914 ( 1.139 2.002 -14.258) 14.443 23.843 ( -13.574 0.646 56.312) 57.929 25.625 ( -9.575 14.355 32.175) 36.510 28.029 ( 4.146 -2.716 -21.587) 22.149 28.482 ( 7.674 -1.393 -16.231) 18.008 ======================= Grid point 275 (129/300) ======================= q-point: (-0.36 0.18 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.289 ( 5.288 8.667 1.136) 10.216 2.303 ( 0.613 5.374 -6.020) 8.093 2.907 ( -1.590 2.112 -14.826) 15.060 3.180 ( 1.368 -14.198 -19.426) 24.100 3.653 ( 0.853 7.363 -12.502) 14.534 3.844 ( 9.243 8.468 -18.158) 22.064 3.974 ( 9.616 -7.104 -0.370) 11.961 4.482 ( -3.252 2.453 1.839) 4.470 5.231 ( -0.601 -6.543 9.775) 11.777 5.266 ( -11.374 1.883 7.073) 13.526 5.843 ( -1.263 -8.015 7.737) 11.211 6.187 ( 0.160 8.123 3.415) 8.813 6.429 ( -1.655 -1.851 11.545) 11.809 6.803 ( 0.874 3.550 7.219) 8.092 7.327 ( -1.063 -0.047 3.317) 3.483 7.861 ( 3.516 4.575 -0.614) 5.802 8.141 ( -6.413 -14.934 -6.351) 17.450 8.688 ( 6.638 15.421 -6.367) 17.956 9.111 ( -5.331 -9.885 10.648) 15.476 9.479 ( 3.304 -0.625 7.489) 8.209 10.053 ( -1.734 3.965 9.028) 10.011 10.155 ( -7.153 4.081 8.691) 11.974 10.929 ( -2.250 -7.096 -0.501) 7.461 11.112 ( -1.172 -7.263 -7.243) 10.324 11.272 ( 1.639 5.386 0.208) 5.634 11.858 ( 3.978 7.473 -5.704) 10.208 12.913 ( -5.281 -3.120 -3.793) 7.212 13.167 ( 7.401 0.590 7.537) 10.580 13.495 ( 2.382 -2.727 -3.300) 4.899 13.855 ( 0.646 -0.523 3.291) 3.395 14.041 ( -3.580 4.754 -7.644) 9.688 14.525 ( 2.697 -4.714 -11.658) 12.861 14.957 ( 5.090 6.911 -8.409) 12.016 15.312 ( -4.569 0.774 -7.199) 8.561 17.425 ( -0.534 4.945 -8.311) 9.685 18.622 ( 20.525 -11.800 -44.285) 50.216 19.713 ( 1.816 4.066 2.690) 5.202 20.844 ( 0.619 3.338 -13.862) 14.272 23.880 ( -12.278 -3.920 55.021) 56.510 25.402 ( -9.955 7.626 30.929) 33.375 28.085 ( 6.293 -3.573 -23.234) 24.335 28.493 ( 4.803 1.733 -16.507) 17.279 ======================= Grid point 276 (130/300) ======================= q-point: (-0.27 0.18 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.075 ( 4.123 14.418 -5.033) 15.818 2.178 ( 0.387 9.214 3.297) 9.794 2.733 ( -0.303 11.359 -21.275) 24.120 3.408 ( 6.343 -1.766 -14.883) 16.274 3.542 ( 1.065 -3.634 -18.018) 18.412 3.714 ( -5.577 0.587 -13.014) 14.170 4.227 ( 15.974 -7.858 -3.155) 18.080 4.410 ( -3.382 3.291 3.726) 6.013 5.054 ( -10.222 8.075 8.804) 15.722 5.434 ( 1.279 -7.784 5.706) 9.736 6.016 ( 2.976 4.721 6.067) 8.243 6.052 ( -5.170 -7.479 7.540) 11.812 6.457 ( -2.073 -0.679 9.969) 10.205 6.723 ( -3.791 4.996 10.605) 12.321 7.291 ( -2.238 3.469 2.990) 5.097 7.794 ( 4.986 4.563 -2.580) 7.234 8.245 ( 5.081 6.270 -7.746) 11.186 8.526 ( -8.992 -3.945 -6.134) 11.578 9.289 ( -3.591 -9.697 15.099) 18.301 9.412 ( 1.604 9.139 6.441) 11.295 10.000 ( 6.627 9.509 3.205) 12.025 10.141 ( -9.573 -10.520 11.770) 18.462 10.956 ( -3.379 -2.619 1.238) 4.451 11.209 ( 0.109 1.655 1.881) 2.508 11.402 ( 6.406 -16.735 -10.675) 20.858 11.752 ( 2.559 4.855 -0.991) 5.577 12.928 ( -5.362 -3.059 -4.004) 7.358 13.198 ( 4.537 1.956 5.493) 7.388 13.509 ( -1.427 1.255 -3.256) 3.770 13.881 ( 2.921 3.055 -3.492) 5.483 13.912 ( -2.306 1.668 0.122) 2.849 14.566 ( 6.923 2.064 -12.390) 14.342 14.807 ( -2.031 6.812 -5.596) 9.047 15.390 ( 3.765 -9.795 -15.262) 18.521 17.313 ( -0.820 4.642 -8.484) 9.705 18.842 ( 13.080 -6.563 -42.873) 45.301 19.656 ( -2.145 2.940 5.413) 6.523 20.767 ( 3.337 3.253 -14.256) 14.999 23.997 ( -14.947 -8.685 55.018) 57.670 25.310 ( -6.298 1.762 29.114) 29.839 28.168 ( 7.874 -3.973 -23.687) 25.275 28.442 ( 0.638 2.304 -16.468) 16.640 ======================= Grid point 277 (131/300) ======================= q-point: (-0.18 0.18 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.821 ( 4.614 15.482 -6.807) 17.531 1.983 ( 3.305 13.747 10.572) 17.654 2.457 ( 0.948 12.922 -18.041) 22.212 3.303 ( 1.989 6.959 -12.472) 14.420 3.600 ( -5.669 0.136 -4.936) 7.517 3.781 ( 3.898 -8.576 -10.128) 13.832 4.295 ( -4.674 5.915 8.603) 11.439 4.471 ( 8.182 -8.034 -6.157) 13.015 4.868 ( -5.813 6.140 5.714) 10.205 5.559 ( 3.289 -2.678 2.969) 5.178 5.881 ( 0.040 5.222 -0.765) 5.278 6.272 ( -3.175 -12.281 9.679) 15.956 6.464 ( -2.772 -0.279 8.591) 9.031 6.630 ( -5.589 2.779 11.992) 13.519 7.190 ( -1.979 5.518 3.078) 6.621 7.773 ( 6.357 1.533 -3.217) 7.288 8.034 ( 6.470 15.491 -3.235) 17.097 8.606 ( -11.694 -10.303 -7.512) 17.301 9.234 ( -0.666 10.221 4.335) 11.122 9.441 ( -2.601 -2.978 14.812) 15.330 9.834 ( 3.722 10.367 0.544) 11.028 10.360 ( -5.191 -14.586 12.256) 19.746 11.019 ( 4.312 -3.314 0.017) 5.438 11.219 ( -1.398 -2.291 4.502) 5.241 11.650 ( 2.501 -5.356 -3.556) 6.899 11.805 ( 3.004 -11.688 -5.446) 13.240 12.933 ( -4.967 -2.201 -4.276) 6.914 13.182 ( 1.957 2.511 0.599) 3.239 13.427 ( -4.085 4.210 -3.435) 6.798 13.771 ( 2.792 6.717 -1.938) 7.528 13.934 ( 1.471 0.076 2.118) 2.580 14.508 ( 9.626 7.518 -11.979) 17.108 14.705 ( -3.404 1.210 -2.573) 4.435 15.633 ( 7.898 -14.447 -21.207) 26.848 17.225 ( -1.366 2.500 -4.542) 5.362 18.877 ( 2.549 2.306 -39.656) 39.804 19.590 ( -4.512 2.213 6.496) 8.213 20.736 ( 7.675 1.377 -14.962) 16.872 24.178 ( -21.076 -13.997 55.501) 60.995 25.338 ( -0.700 -1.994 29.484) 29.559 28.237 ( 8.740 -0.067 -21.842) 23.525 28.387 ( -3.443 -1.582 -17.489) 17.895 ======================= Grid point 278 (132/300) ======================= q-point: (-0.09 0.18 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.520 ( 2.300 17.518 -2.384) 17.828 1.765 ( 8.403 16.675 15.014) 23.960 2.283 ( 2.565 3.543 -5.669) 7.160 3.168 ( -0.452 6.814 -6.972) 9.760 3.469 ( -8.120 9.335 10.481) 16.215 3.900 ( 7.633 1.526 2.135) 8.071 4.174 ( -6.445 1.837 7.372) 9.963 4.597 ( -2.236 -2.389 -0.548) 3.318 4.800 ( -1.063 -2.053 -3.135) 3.895 5.593 ( 6.522 1.296 -5.680) 8.745 5.861 ( -1.133 -3.480 -4.535) 5.827 6.434 ( -0.975 -1.211 -0.534) 1.644 6.478 ( -10.866 -5.775 14.383) 18.929 6.612 ( 1.378 -2.669 13.482) 13.813 7.104 ( -0.151 2.671 4.525) 5.257 7.730 ( -0.289 9.290 3.728) 10.014 7.890 ( 7.959 0.582 -3.549) 8.734 8.694 ( -4.846 -7.381 -9.911) 13.273 9.022 ( -2.141 12.805 0.070) 12.983 9.282 ( -3.372 17.358 -0.332) 17.685 9.796 ( 0.065 -2.538 16.344) 16.540 10.633 ( -4.019 -16.025 11.407) 20.076 11.131 ( 8.893 -3.525 -0.341) 9.572 11.255 ( 0.545 -0.413 6.086) 6.125 11.793 ( -3.579 -12.106 -0.307) 12.628 12.051 ( 2.223 -11.777 -8.895) 14.925 12.926 ( -4.163 -1.283 -3.550) 5.620 13.140 ( 3.383 3.800 -6.100) 7.943 13.316 ( -6.213 2.117 -3.478) 7.428 13.671 ( 8.369 7.477 -2.197) 11.435 13.934 ( -0.424 0.207 4.471) 4.496 14.414 ( 10.890 7.946 -8.115) 15.735 14.673 ( -4.236 0.025 0.206) 4.241 15.933 ( 11.322 -13.413 -27.594) 32.703 17.190 ( -2.358 -0.525 1.921) 3.086 18.610 ( -12.684 16.349 -29.282) 35.855 19.559 ( 0.629 0.291 4.262) 4.318 20.769 ( 10.159 -0.689 -15.682) 18.698 24.396 ( -29.726 -17.607 53.457) 63.650 25.493 ( 6.140 -7.818 33.536) 34.978 28.209 ( 4.405 3.416 -17.063) 17.951 28.383 ( -2.989 -2.030 -20.767) 21.079 ======================= Grid point 282 (133/300) ======================= q-point: ( 0.27 0.27 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.604 ( 10.620 0.000 27.443) 29.426 1.942 ( -2.679 -0.000 26.795) 26.928 2.525 ( 14.546 0.000 28.962) 32.410 2.817 ( 14.144 0.000 -0.079) 14.144 3.388 ( -2.964 -0.000 24.228) 24.409 3.596 ( 4.789 0.000 23.896) 24.371 4.152 ( 0.714 0.000 2.481) 2.582 4.587 ( -2.750 -0.000 3.277) 4.278 4.974 ( -3.217 -0.000 -9.950) 10.457 5.557 ( 1.151 0.000 -7.756) 7.840 5.826 ( 0.473 0.000 -14.473) 14.480 6.198 ( -8.308 -0.000 10.160) 13.124 6.392 ( 2.890 0.000 -13.041) 13.357 6.821 ( -14.317 -0.000 10.324) 17.651 7.191 ( -7.637 -0.000 5.079) 9.172 7.630 ( 17.609 0.000 8.770) 19.672 7.684 ( -14.120 -0.000 -5.882) 15.297 8.136 ( -1.089 -0.000 6.494) 6.585 8.484 ( -4.924 -0.000 7.045) 8.595 9.751 ( 27.786 0.000 -9.978) 29.523 9.946 ( -8.619 -0.000 28.502) 29.776 11.023 ( -3.186 -0.000 2.176) 3.859 11.281 ( -8.514 -0.000 1.371) 8.623 11.862 ( 7.683 0.000 -6.354) 9.970 12.040 ( -10.105 -0.000 -0.115) 10.105 12.095 ( -6.106 -0.000 -12.696) 14.088 12.834 ( 3.847 0.000 -0.741) 3.918 12.945 ( 6.337 0.000 0.644) 6.369 13.293 ( 2.055 0.000 -7.876) 8.140 13.888 ( -4.384 -0.000 6.065) 7.483 13.971 ( -15.645 -0.000 4.995) 16.423 14.530 ( -6.831 -0.000 10.841) 12.814 14.667 ( -8.156 -0.000 10.974) 13.673 15.535 ( 52.892 0.000 -51.594) 73.889 17.381 ( -0.413 -0.000 12.690) 12.696 17.797 ( 12.139 0.000 -4.451) 12.929 19.734 ( 4.889 0.000 7.306) 8.791 21.071 ( 7.777 0.000 -18.588) 20.149 24.263 ( -26.722 -0.000 58.549) 64.359 27.177 ( -1.067 -0.000 9.446) 9.506 27.489 ( 12.831 0.000 0.348) 12.836 27.928 ( -6.930 -0.000 -11.417) 13.356 ======================= Grid point 283 (134/300) ======================= q-point: ( 0.36 0.27 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.597 ( 5.370 6.156 24.687) 26.003 2.122 ( 4.266 -12.008 20.665) 24.278 2.770 ( 6.391 -9.389 20.961) 23.840 2.891 ( 14.007 3.308 3.687) 14.857 3.299 ( -1.264 5.275 21.062) 21.749 3.881 ( 7.909 -14.488 23.029) 28.334 4.143 ( -0.157 1.157 1.071) 1.584 4.507 ( -5.590 5.426 2.072) 8.061 4.917 ( 0.798 3.347 -8.475) 9.147 5.496 ( 0.793 1.775 -11.896) 12.054 5.842 ( -5.274 1.030 -3.029) 6.169 6.207 ( 1.255 -5.602 -0.999) 5.827 6.428 ( 3.839 -1.758 -7.732) 8.810 6.749 ( -13.707 -1.247 9.133) 16.518 7.210 ( -8.402 -6.899 3.987) 11.580 7.550 ( -5.847 2.780 -1.001) 6.551 7.785 ( 9.746 -2.182 2.799) 10.373 8.182 ( -2.302 -6.176 4.520) 7.992 8.541 ( -4.489 -7.595 9.771) 13.164 9.789 ( 19.407 11.913 -4.403) 23.193 9.951 ( -2.770 -0.345 23.100) 23.268 10.976 ( -5.239 4.775 0.567) 7.111 11.155 ( -8.297 4.714 3.116) 10.038 11.716 ( -3.789 9.404 -1.946) 10.323 11.963 ( -2.329 6.349 -12.678) 14.369 12.089 ( -0.778 -1.972 -4.037) 4.559 12.961 ( 5.886 -8.691 -2.605) 10.815 13.010 ( 7.707 -1.512 2.607) 8.276 13.221 ( -0.922 7.033 -8.005) 10.695 13.805 ( -11.122 1.694 4.799) 12.231 13.883 ( -5.285 1.868 5.477) 7.837 14.363 ( -3.247 3.013 0.399) 4.448 14.833 ( -1.901 -9.290 13.848) 16.783 15.913 ( 28.398 -9.420 -41.239) 50.949 17.390 ( -0.363 -0.932 8.062) 8.124 17.848 ( 19.726 4.316 -8.522) 21.918 19.806 ( 4.136 -2.541 5.372) 7.240 21.060 ( 5.985 2.848 -18.605) 19.750 24.138 ( -22.311 5.152 60.104) 64.318 26.828 ( 3.142 26.114 17.957) 31.847 27.866 ( 2.520 -10.316 -7.321) 12.898 27.909 ( 1.306 -12.226 -11.285) 16.689 ======================= Grid point 284 (135/300) ======================= q-point: ( 0.45 0.27 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.678 ( 7.891 -7.226 10.023) 14.661 2.406 ( 1.867 -10.566 14.108) 17.724 2.892 ( 13.798 7.545 9.005) 18.122 2.941 ( 1.217 -3.430 5.560) 6.645 3.356 ( -2.861 -9.006 14.819) 17.575 4.061 ( 2.239 3.173 6.861) 7.884 4.232 ( 5.417 0.168 3.271) 6.330 4.419 ( -4.944 -8.847 12.264) 15.910 4.809 ( 3.247 8.054 -9.584) 12.933 5.509 ( -0.839 -3.817 -13.004) 13.578 5.712 ( -8.559 4.560 3.611) 10.348 6.328 ( 4.801 -0.950 -0.063) 4.895 6.451 ( 2.516 -0.574 -4.540) 5.223 6.734 ( -5.898 -3.687 5.164) 8.663 7.295 ( -7.703 -5.984 1.870) 9.932 7.510 ( -2.886 -2.618 1.455) 4.159 7.873 ( 7.193 -0.766 2.401) 7.622 8.379 ( -4.257 -16.245 2.014) 16.914 8.722 ( -3.392 -13.149 8.635) 16.092 9.624 ( 14.500 17.033 -1.694) 22.433 9.989 ( -0.030 -1.100 19.271) 19.302 10.746 ( -8.708 11.961 2.958) 15.088 11.039 ( -7.632 4.666 -0.578) 8.964 11.493 ( -7.682 9.462 -1.128) 12.240 11.787 ( 5.694 11.690 -8.834) 15.720 12.082 ( -1.102 0.111 -7.129) 7.214 13.013 ( -1.766 7.217 -3.903) 8.393 13.095 ( 7.042 0.132 0.427) 7.057 13.204 ( 5.895 -9.529 -0.417) 11.213 13.751 ( -6.409 -2.704 2.126) 7.273 13.876 ( -0.453 -2.296 1.717) 2.903 14.342 ( -6.415 -2.729 -3.903) 7.990 14.990 ( 3.772 -4.632 9.810) 11.486 15.975 ( 2.372 8.555 -18.806) 20.796 17.477 ( -4.504 -7.882 -1.365) 9.180 17.942 ( 34.762 1.780 -21.569) 40.948 19.877 ( 3.103 -1.040 1.930) 3.799 20.998 ( 3.348 3.500 -18.088) 18.725 23.990 ( -17.268 6.107 60.407) 63.123 26.386 ( -2.799 25.243 24.887) 35.559 27.914 ( 1.017 -3.854 -14.022) 14.578 28.241 ( 8.272 -12.851 -11.535) 19.148 ======================= Grid point 285 (136/300) ======================= q-point: ( 0.55 0.27 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.975 ( 8.723 -15.700 -3.594) 18.317 2.525 ( -0.353 0.141 6.480) 6.491 2.896 ( 8.227 1.531 4.467) 9.486 2.962 ( -2.174 0.721 -2.825) 3.637 3.564 ( -2.223 -12.081 6.907) 14.093 4.001 ( 5.853 7.746 -1.654) 9.849 4.142 ( -0.278 3.369 1.240) 3.601 4.592 ( -2.589 4.389 -8.872) 10.231 4.788 ( 7.113 -11.312 13.234) 18.807 5.442 ( -8.979 5.417 -1.140) 10.549 5.682 ( -2.524 -3.907 -2.269) 5.176 6.329 ( 1.143 0.715 6.639) 6.775 6.449 ( 1.048 2.891 -0.963) 3.222 6.811 ( 2.033 -3.969 3.163) 5.467 7.320 ( -1.330 -0.910 0.229) 1.628 7.607 ( -5.364 -9.841 0.470) 11.218 7.932 ( 5.161 -0.149 3.312) 6.134 8.659 ( -6.995 -15.687 3.576) 17.544 9.018 ( -2.583 -18.435 5.209) 19.330 9.378 ( 14.004 18.884 -3.192) 23.726 10.071 ( 0.876 -4.022 16.388) 16.897 10.470 ( -9.673 11.402 4.267) 15.549 10.843 ( -7.187 7.994 -3.886) 11.431 11.277 ( -6.095 8.399 0.526) 10.391 11.588 ( 4.932 11.789 -3.942) 13.373 12.050 ( 0.743 1.880 -10.886) 11.072 12.883 ( -3.021 2.959 -3.625) 5.570 13.169 ( 8.448 -0.691 4.069) 9.402 13.376 ( 5.561 -4.288 2.667) 7.511 13.797 ( -2.781 -3.704 2.875) 5.451 13.962 ( -0.404 -7.316 -6.705) 9.933 14.334 ( -6.438 -2.674 -7.343) 10.125 15.085 ( 5.344 -0.572 3.173) 6.241 15.680 ( -6.784 15.635 -6.306) 18.172 17.534 ( -4.986 -1.983 -2.526) 5.931 18.209 ( 36.916 -6.725 -36.548) 52.381 19.882 ( 2.424 2.756 0.138) 3.673 20.925 ( 0.147 2.252 -16.956) 17.105 23.891 ( -12.892 3.902 59.100) 60.616 25.946 ( -9.568 21.487 29.107) 37.423 27.975 ( 4.908 -3.084 -17.369) 18.311 28.451 ( 8.394 -5.734 -13.750) 17.100 ======================= Grid point 286 (137/300) ======================= q-point: (-0.36 -0.73 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.269 ( 4.043 -8.096 -6.468) 11.124 2.490 ( 4.203 4.616 1.291) 6.375 2.899 ( 1.146 1.205 -3.987) 4.320 2.944 ( -3.835 -4.948 -13.444) 14.830 3.707 ( -7.029 -0.626 -2.452) 7.471 3.951 ( 15.072 -1.566 -3.195) 15.487 4.072 ( 6.492 8.973 -9.760) 14.762 4.471 ( -5.496 1.178 -5.352) 7.761 5.080 ( 4.753 -10.662 12.522) 17.119 5.270 ( -10.575 5.082 6.162) 13.253 5.734 ( -1.966 -4.213 1.554) 4.902 6.330 ( 1.724 4.904 0.781) 5.256 6.403 ( -1.353 -0.756 10.595) 10.708 6.869 ( 1.095 0.536 5.870) 5.995 7.332 ( 1.914 -0.104 0.690) 2.037 7.790 ( -6.932 -14.472 -3.664) 16.460 7.951 ( 3.565 2.178 2.099) 4.675 8.872 ( -6.920 -11.946 6.459) 15.241 9.061 ( 4.111 16.028 0.609) 16.558 9.380 ( 6.898 -11.311 -0.104) 13.249 10.136 ( -4.567 6.322 8.665) 11.658 10.218 ( -6.559 3.671 10.123) 12.608 10.765 ( 0.807 -5.195 -4.671) 7.032 11.095 ( -5.088 6.113 0.383) 7.963 11.422 ( 3.506 8.614 -1.126) 9.368 11.975 ( 0.582 4.672 -10.690) 11.681 12.841 ( -2.753 -0.631 -2.081) 3.508 13.246 ( 7.973 -0.075 6.194) 10.097 13.471 ( 4.704 -2.064 0.288) 5.145 13.837 ( -1.439 -1.834 4.710) 5.255 14.039 ( -3.463 -1.508 -9.681) 10.392 14.377 ( -0.744 -7.877 -12.343) 14.662 15.079 ( -0.463 4.217 -2.099) 4.733 15.375 ( -1.886 10.193 -5.636) 11.799 17.493 ( -0.949 2.940 -5.295) 6.130 18.522 ( 28.362 -8.293 -42.415) 51.693 19.821 ( 1.421 4.963 1.404) 5.349 20.858 ( -1.404 1.472 -15.740) 15.870 23.865 ( -11.017 0.814 56.840) 57.903 25.581 ( -11.719 14.300 31.005) 36.099 28.037 ( 6.898 -2.641 -20.276) 21.579 28.529 ( 6.566 0.185 -15.521) 16.854 ======================= Grid point 287 (138/300) ======================= q-point: (-0.27 0.27 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.274 ( -1.169 5.584 -5.219) 7.732 2.391 ( 6.094 9.394 3.487) 11.728 2.848 ( 2.044 4.797 -16.011) 16.838 3.138 ( 1.489 -18.269 -18.594) 26.110 3.570 ( -4.024 5.894 -13.343) 15.132 3.846 ( 4.079 13.695 -18.998) 23.773 4.188 ( 14.496 -8.016 -0.976) 16.594 4.424 ( -5.824 0.552 1.147) 5.961 5.125 ( -7.990 5.171 9.141) 13.196 5.295 ( 1.848 -8.523 8.811) 12.397 5.853 ( -0.952 -8.764 7.115) 11.329 6.199 ( -0.308 8.662 3.995) 9.544 6.445 ( -1.572 -1.325 10.133) 10.340 6.822 ( -2.353 5.009 9.086) 10.639 7.338 ( 1.215 1.627 2.587) 3.289 7.908 ( 3.066 4.244 -1.840) 5.550 8.022 ( -6.371 -15.797 -5.877) 18.019 8.750 ( 5.155 17.967 -5.758) 19.559 9.084 ( -3.891 -11.585 11.581) 16.837 9.543 ( 2.099 0.735 5.310) 5.757 9.952 ( -12.540 -0.978 8.561) 15.215 10.193 ( 4.255 4.794 8.959) 11.016 10.884 ( -3.068 -1.745 -0.055) 3.530 11.115 ( 4.863 -13.383 -6.536) 15.668 11.311 ( 2.667 5.640 1.179) 6.349 11.855 ( -1.463 5.769 -7.262) 9.389 12.844 ( -2.698 -1.870 -1.538) 3.625 13.290 ( 5.606 2.204 6.789) 9.077 13.514 ( 1.928 0.099 -2.894) 3.479 13.876 ( -0.290 -2.163 3.699) 4.295 13.964 ( -1.977 3.540 -8.937) 9.814 14.526 ( 3.295 -7.407 -13.342) 15.611 14.917 ( -6.532 7.630 -4.657) 11.071 15.295 ( 6.279 -0.440 -10.502) 12.244 17.403 ( 1.804 5.481 -8.423) 10.210 18.749 ( 17.790 -6.092 -44.278) 48.105 19.733 ( -1.114 5.102 4.661) 7.000 20.801 ( 0.787 1.288 -14.974) 15.050 23.892 ( -12.888 -2.269 55.114) 56.647 25.374 ( -8.731 5.675 30.553) 32.278 28.108 ( 7.654 -3.526 -22.079) 23.633 28.494 ( 3.663 3.949 -16.942) 17.778 ======================= Grid point 288 (139/300) ======================= q-point: (-0.18 0.27 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.101 ( 3.407 11.032 -5.367) 12.733 2.263 ( 5.667 10.496 7.495) 14.087 2.691 ( 6.760 12.029 -21.574) 25.609 3.379 ( -3.108 0.199 -14.886) 15.208 3.524 ( 3.929 -14.285 -20.713) 25.466 3.611 ( 0.050 8.300 -15.694) 17.754 4.355 ( -6.130 2.550 3.382) 7.451 4.413 ( 10.130 -6.173 -0.565) 11.876 4.981 ( -3.543 7.695 8.894) 12.283 5.475 ( 1.173 -8.056 7.448) 11.034 5.996 ( -4.936 1.975 5.106) 7.372 6.080 ( 2.057 -3.433 5.762) 7.016 6.458 ( -2.688 -0.120 9.987) 10.343 6.708 ( -3.445 5.993 11.126) 13.099 7.285 ( -0.603 4.669 4.806) 6.727 7.855 ( 4.338 3.252 -3.571) 6.492 8.251 ( -0.644 -11.497 -7.895) 13.962 8.435 ( 0.306 15.758 -6.080) 16.893 9.280 ( -5.033 -7.893 14.856) 17.559 9.435 ( -1.555 6.712 6.113) 9.210 10.013 ( -6.814 -2.767 7.939) 10.822 10.155 ( 6.541 0.014 7.196) 9.724 10.907 ( -3.739 -5.517 0.180) 6.667 11.243 ( 2.792 3.217 3.189) 5.321 11.463 ( 7.193 -16.552 -9.540) 20.413 11.735 ( -4.271 3.243 -2.505) 5.919 12.859 ( -2.502 -1.875 -2.138) 3.788 13.260 ( 1.222 4.146 4.251) 6.063 13.475 ( -1.219 3.754 -4.507) 5.991 13.862 ( -1.842 1.928 -1.125) 2.894 13.950 ( 5.367 -0.445 -1.443) 5.576 14.618 ( 5.629 -1.141 -11.062) 12.465 14.738 ( -3.479 6.077 -7.081) 9.958 15.417 ( 7.052 -9.616 -14.687) 18.919 17.298 ( 3.096 5.685 -9.116) 11.181 18.835 ( 6.474 -1.494 -44.138) 44.635 19.635 ( -3.442 4.316 7.030) 8.939 20.780 ( 5.493 0.527 -14.503) 15.517 23.955 ( -17.294 -5.857 54.626) 57.597 25.342 ( -3.777 -1.018 29.854) 30.109 28.199 ( 7.177 -4.573 -22.890) 24.420 28.393 ( 1.444 5.153 -17.516) 18.315 ======================= Grid point 289 (140/300) ======================= q-point: (-0.09 0.27 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.887 ( 7.539 16.545 -4.848) 18.817 2.124 ( 9.380 10.446 9.925) 17.193 2.445 ( 7.305 14.001 -16.739) 23.012 3.275 ( 0.924 5.711 -14.077) 15.219 3.486 ( -6.285 0.227 -7.454) 9.753 3.824 ( 6.649 -12.814 -12.110) 18.843 4.237 ( -7.174 5.992 8.509) 12.640 4.563 ( 5.981 -3.681 -2.180) 7.354 4.830 ( -2.428 6.949 6.903) 10.091 5.621 ( 3.466 -3.946 4.148) 6.693 5.850 ( -3.244 5.341 -3.021) 6.941 6.263 ( -2.698 -10.865 9.069) 14.407 6.442 ( -4.365 1.461 7.936) 9.174 6.629 ( -0.357 1.799 11.206) 11.355 7.195 ( 0.457 5.153 5.927) 7.867 7.836 ( 3.695 1.908 -2.916) 5.079 8.097 ( 2.255 16.156 -2.660) 16.528 8.479 ( -0.207 -11.589 -8.936) 14.636 9.204 ( -5.307 8.707 4.785) 11.263 9.441 ( -4.147 0.493 11.761) 12.480 9.899 ( 4.002 9.179 4.795) 11.102 10.349 ( -1.794 -13.187 10.625) 17.029 11.039 ( -2.182 -9.895 -0.431) 10.142 11.242 ( 2.411 -0.581 4.680) 5.297 11.638 ( -3.738 -1.808 -2.208) 4.703 11.816 ( 3.094 -13.676 -7.652) 15.974 12.870 ( -1.853 -1.497 -2.680) 3.586 13.196 ( -0.978 2.558 0.750) 2.839 13.353 ( -2.988 6.041 -6.373) 9.275 13.828 ( 3.795 2.969 1.560) 5.064 13.967 ( 3.466 2.190 -0.497) 4.130 14.601 ( 8.584 5.702 -10.975) 15.055 14.651 ( -2.300 0.335 -3.070) 3.850 15.684 ( 8.664 -15.349 -18.998) 25.915 17.217 ( 3.353 3.664 -6.174) 7.924 18.707 ( -7.161 8.333 -38.563) 40.098 19.579 ( 0.440 0.812 4.851) 4.938 20.805 ( 8.840 -0.256 -14.379) 16.881 24.053 ( -22.521 -9.557 54.711) 59.932 25.449 ( 0.747 -5.867 31.333) 31.886 28.271 ( -3.707 0.523 -18.893) 19.261 28.293 ( 9.534 0.243 -21.161) 23.211 ======================= Grid point 294 (141/300) ======================= q-point: ( 0.36 0.36 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.822 ( 5.966 0.000 30.023) 30.610 1.946 ( -8.174 -0.000 21.287) 22.802 2.773 ( 6.403 0.000 22.836) 23.716 2.984 ( 5.980 0.000 6.302) 8.688 3.491 ( 6.480 0.000 24.020) 24.878 3.778 ( 10.508 0.000 18.262) 21.069 4.151 ( -3.218 -0.000 3.403) 4.684 4.539 ( -5.380 -0.000 2.454) 5.913 4.916 ( 0.815 0.000 -11.027) 11.057 5.572 ( 3.376 0.000 -5.527) 6.477 5.789 ( 1.173 0.000 -12.646) 12.700 6.142 ( -3.939 -0.000 10.653) 11.358 6.389 ( 2.975 0.000 -12.620) 12.966 6.671 ( -11.596 -0.000 8.631) 14.455 7.094 ( -7.570 -0.000 2.927) 8.116 7.487 ( -10.154 -0.000 -8.087) 12.981 7.868 ( 12.058 0.000 4.493) 12.868 8.122 ( -3.845 -0.000 5.620) 6.809 8.470 ( -1.507 -0.000 15.050) 15.125 9.918 ( -9.118 -0.000 28.984) 30.384 10.085 ( 24.071 0.000 -9.746) 25.969 10.982 ( -3.572 -0.000 0.185) 3.576 11.149 ( -10.712 -0.000 0.679) 10.734 11.792 ( -9.294 -0.000 -7.916) 12.208 11.879 ( -11.520 -0.000 -2.164) 11.721 12.129 ( 11.719 0.000 -9.793) 15.272 12.909 ( 6.485 0.000 1.178) 6.591 13.061 ( 8.628 0.000 1.567) 8.769 13.286 ( 0.932 0.000 -7.733) 7.789 13.734 ( -18.578 -0.000 3.670) 18.937 13.846 ( -3.734 -0.000 3.823) 5.343 14.498 ( -3.037 -0.000 6.628) 7.291 14.599 ( -7.503 -0.000 14.181) 16.043 16.019 ( 39.030 0.000 -44.137) 58.918 17.411 ( -1.519 -0.000 12.538) 12.630 18.008 ( 20.795 0.000 -10.257) 23.187 19.813 ( 2.507 0.000 7.138) 7.565 21.095 ( 4.696 0.000 -19.263) 19.827 24.146 ( -19.141 -0.000 61.433) 64.346 27.215 ( 1.226 0.000 10.967) 11.035 27.663 ( 8.608 0.000 -2.599) 8.992 27.811 ( -1.436 -0.000 -7.931) 8.060 ======================= Grid point 295 (142/300) ======================= q-point: ( 0.45 0.36 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.724 ( 0.586 5.244 21.041) 21.692 2.186 ( -3.996 -14.748 20.781) 25.794 2.884 ( -0.670 -4.285 18.447) 18.950 3.030 ( 1.369 -0.847 7.976) 8.136 3.424 ( 9.557 10.402 18.422) 23.214 4.070 ( -0.685 -7.310 17.918) 19.364 4.142 ( 5.773 -7.634 6.137) 11.370 4.427 ( -5.163 6.948 -0.361) 8.664 4.923 ( 3.910 1.215 -7.529) 8.571 5.478 ( 2.154 4.715 -11.916) 12.995 5.757 ( -5.485 4.427 1.300) 7.168 6.256 ( 6.519 -8.818 -5.014) 12.058 6.470 ( 5.415 -3.812 -4.829) 8.196 6.593 ( -12.398 -1.844 8.249) 15.005 7.105 ( -7.392 -5.985 1.717) 9.665 7.432 ( -6.356 -2.340 -6.858) 9.639 7.937 ( 7.541 0.661 2.414) 7.945 8.153 ( -3.936 -6.084 4.822) 8.704 8.552 ( 0.352 -5.699 16.219) 17.195 9.885 ( -5.812 2.967 24.834) 25.677 10.132 ( 19.156 8.855 -5.461) 21.799 10.879 ( -8.877 8.172 -0.270) 12.069 11.043 ( -8.767 1.877 -0.137) 8.967 11.598 ( -7.970 8.134 -3.611) 11.947 11.872 ( -5.074 -2.854 -10.134) 11.687 12.137 ( 7.572 5.545 -5.212) 10.735 13.051 ( 6.955 -8.690 -0.699) 11.153 13.135 ( 8.054 -0.986 1.978) 8.352 13.171 ( -2.502 9.233 -5.450) 11.009 13.644 ( -11.340 -2.885 2.467) 11.958 13.848 ( -3.193 -1.352 3.599) 4.997 14.318 ( -3.372 5.996 1.296) 7.000 14.819 ( -6.358 -13.807 15.113) 21.435 16.160 ( 24.273 5.421 -33.267) 41.536 17.397 ( -2.566 0.647 9.086) 9.464 18.153 ( 27.835 -0.328 -16.726) 32.475 19.859 ( 0.555 -2.064 5.719) 6.105 21.056 ( 2.777 3.238 -19.607) 20.066 24.085 ( -15.024 4.475 62.169) 64.115 26.897 ( -1.650 26.425 15.050) 30.455 27.817 ( -0.114 -5.721 -10.681) 12.117 28.000 ( 10.181 -16.355 -3.374) 19.558 ======================= Grid point 296 (143/300) ======================= q-point: (-0.45 -0.64 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.792 ( 3.409 -8.088 7.338) 11.440 2.421 ( -5.688 -9.984 14.116) 18.202 2.931 ( -4.011 0.789 10.844) 11.589 3.042 ( -1.693 1.444 5.170) 5.629 3.422 ( 7.661 -1.752 12.679) 14.917 4.056 ( -6.436 -1.297 9.787) 11.785 4.246 ( -3.510 8.120 -2.296) 9.139 4.510 ( 9.343 -12.708 13.901) 21.024 4.848 ( 6.382 7.585 -6.886) 12.070 5.455 ( -0.588 -0.782 -11.437) 11.479 5.620 ( -5.379 3.317 2.465) 6.783 6.379 ( 1.666 1.388 -0.259) 2.184 6.461 ( -0.154 -0.899 -0.897) 1.279 6.717 ( 2.533 -8.219 2.428) 8.937 7.199 ( -5.604 -8.103 0.282) 9.856 7.457 ( -3.197 -4.603 -4.491) 7.182 7.977 ( 4.692 0.039 3.999) 6.165 8.326 ( -4.397 -14.335 3.920) 15.498 8.731 ( 0.099 -10.993 10.892) 15.475 9.782 ( 6.177 12.273 9.621) 16.774 10.085 ( 6.401 3.902 8.535) 11.360 10.613 ( -11.438 11.023 1.813) 15.988 10.916 ( -8.327 5.500 -4.126) 10.799 11.399 ( -4.265 8.197 -0.895) 9.283 11.818 ( 2.446 7.181 -10.532) 12.979 12.060 ( 1.401 3.251 -5.394) 6.452 12.960 ( -3.076 7.746 -3.448) 9.020 13.204 ( 6.745 -1.713 1.002) 7.031 13.298 ( 6.261 -9.061 2.436) 11.280 13.680 ( -3.931 -5.879 0.655) 7.102 13.863 ( -2.180 -2.183 1.560) 3.457 14.242 ( -5.026 -0.391 -4.879) 7.015 15.011 ( -5.788 -8.427 12.302) 15.996 15.996 ( 9.081 18.480 -16.656) 26.484 17.423 ( -3.237 -4.219 2.025) 5.690 18.357 ( 34.603 -1.539 -28.106) 44.606 19.898 ( -1.634 -1.245 3.812) 4.330 20.958 ( 0.281 4.351 -19.571) 20.051 24.003 ( -10.735 5.517 61.776) 62.944 26.380 ( -9.102 27.010 21.109) 35.468 27.918 ( 5.602 -4.535 -11.800) 13.827 28.330 ( 9.216 -11.784 -8.900) 17.407 ======================= Grid point 297 (144/300) ======================= q-point: (-0.36 -0.64 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.052 ( 3.812 -14.773 -4.940) 16.037 2.518 ( -4.619 -2.777 8.416) 9.994 2.860 ( -7.972 2.355 -0.857) 8.357 2.977 ( -0.868 3.565 0.066) 3.670 3.592 ( 3.810 -7.300 7.881) 11.398 4.070 ( 3.271 4.934 0.349) 5.930 4.122 ( -4.442 -3.312 5.401) 7.737 4.537 ( 0.621 9.808 -13.280) 16.521 4.959 ( 9.212 -9.707 12.387) 18.235 5.346 ( -3.086 7.308 0.709) 7.965 5.631 ( -3.199 -4.723 -3.972) 6.951 6.357 ( -0.079 -0.375 4.943) 4.958 6.457 ( 0.115 2.832 0.665) 2.911 6.853 ( 1.532 -3.516 4.953) 6.265 7.306 ( 0.266 -5.255 -1.784) 5.556 7.537 ( -3.502 -7.415 -3.747) 9.016 8.006 ( 2.625 0.839 5.286) 5.961 8.582 ( -5.555 -14.788 5.079) 16.594 8.999 ( -2.305 -15.035 6.387) 16.497 9.567 ( 13.790 16.814 -3.617) 22.045 10.140 ( 0.749 -4.328 15.842) 16.440 10.320 ( -12.967 12.029 3.031) 17.945 10.759 ( -2.222 3.943 -4.610) 6.461 11.216 ( -2.964 8.897 0.953) 9.426 11.634 ( 3.348 11.402 -4.834) 12.829 12.011 ( -0.780 1.964 -10.784) 10.990 12.845 ( -1.381 2.744 -0.884) 3.196 13.285 ( 6.417 -1.814 2.454) 7.106 13.469 ( 5.400 -3.811 4.344) 7.909 13.774 ( -1.879 -4.790 3.021) 5.967 13.917 ( -2.598 -5.590 -6.524) 8.976 14.231 ( -3.359 -3.659 -9.970) 11.139 15.075 ( -8.484 -1.512 6.208) 10.621 15.653 ( 6.230 18.734 -8.701) 21.575 17.475 ( -2.256 -2.660 -1.875) 3.959 18.579 ( 32.324 -2.240 -37.563) 49.607 19.887 ( -2.615 1.517 3.059) 4.301 20.849 ( -1.787 2.707 -18.507) 18.790 23.949 ( -8.050 4.471 59.792) 60.497 25.878 ( -13.296 21.557 26.582) 36.716 28.009 ( 7.517 -2.701 -15.581) 17.509 28.523 ( 8.065 -4.139 -12.405) 15.364 ======================= Grid point 298 (145/300) ======================= q-point: (-0.27 -0.64 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.266 ( -1.548 -5.108 -6.907) 8.729 2.521 ( -1.919 1.285 4.107) 4.712 2.813 ( -6.631 -8.124 -9.339) 14.043 2.934 ( 5.829 1.878 -10.251) 11.941 3.640 ( -0.213 4.822 -4.726) 6.755 4.056 ( 2.276 2.483 -3.669) 4.980 4.168 ( 8.496 -0.029 -2.493) 8.854 4.362 ( -6.227 1.301 -8.084) 10.287 5.140 ( -3.993 -2.313 8.033) 9.264 5.254 ( 7.147 1.530 8.195) 10.981 5.708 ( -2.307 -6.982 1.744) 7.557 6.350 ( 0.656 6.500 0.971) 6.605 6.416 ( -1.666 -2.038 9.440) 9.800 6.877 ( -3.354 1.360 8.669) 9.394 7.378 ( 4.213 -0.454 -0.499) 4.266 7.685 ( -5.539 -12.808 -5.155) 14.876 7.993 ( 0.977 2.417 2.057) 3.321 8.817 ( -3.530 -12.925 6.819) 15.034 9.087 ( -0.597 8.566 4.685) 9.782 9.497 ( 9.742 -3.373 -5.477) 11.675 9.995 ( -14.426 11.984 5.764) 19.620 10.253 ( 1.436 -2.303 13.622) 13.890 10.798 ( 5.900 -7.160 -4.122) 10.152 11.051 ( -1.618 5.322 1.327) 5.719 11.461 ( 2.407 8.477 -1.531) 8.944 11.917 ( -3.176 4.547 -11.705) 12.953 12.818 ( -0.429 0.036 1.255) 1.327 13.359 ( 5.557 -0.315 3.860) 6.774 13.539 ( 4.211 0.066 1.331) 4.417 13.831 ( -2.682 -2.395 5.988) 6.984 13.951 ( -2.914 -1.460 -10.733) 11.217 14.337 ( 1.554 -10.246 -14.561) 17.872 14.967 ( -11.123 4.941 0.420) 12.178 15.427 ( 9.205 9.668 -8.127) 15.628 17.474 ( 0.805 1.516 -5.338) 5.607 18.745 ( 23.017 -1.469 -43.152) 48.929 19.818 ( -3.217 4.085 4.190) 6.678 20.781 ( -0.988 0.136 -16.705) 16.734 23.920 ( -8.971 3.171 57.261) 58.046 25.516 ( -11.899 12.098 29.439) 33.979 28.076 ( 7.957 -2.093 -19.001) 20.706 28.561 ( 5.472 2.269 -15.266) 16.375 ======================= Grid point 299 (146/300) ======================= q-point: (-0.18 -0.64 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.227 ( -3.036 3.218 -5.740) 7.247 2.448 ( -0.631 5.711 4.210) 7.122 2.894 ( 11.557 3.636 -13.079) 17.828 3.084 ( 0.518 -17.864 -19.831) 26.696 3.486 ( -0.311 7.102 -14.364) 16.027 3.836 ( 4.015 15.193 -21.078) 26.291 4.314 ( -4.129 -2.799 -0.501) 5.014 4.342 ( 1.224 -6.133 3.154) 7.004 5.111 ( 1.225 4.167 8.284) 9.354 5.349 ( 1.457 -5.647 8.383) 10.211 5.866 ( -0.595 -8.904 6.614) 11.108 6.202 ( -1.489 8.508 4.243) 9.624 6.452 ( -2.110 -0.712 9.022) 9.292 6.804 ( -4.594 4.543 10.266) 12.130 7.371 ( 1.306 3.457 4.404) 5.749 7.870 ( -5.805 -7.366 -5.489) 10.867 7.994 ( 4.264 -5.757 -4.299) 8.355 8.798 ( 4.302 17.632 -5.550) 18.979 9.083 ( -1.794 -11.598 11.866) 16.690 9.558 ( -3.255 5.901 5.092) 8.447 9.822 ( -8.338 -6.110 7.263) 12.633 10.282 ( 2.624 2.317 10.736) 11.292 10.865 ( 1.243 2.316 -1.281) 2.924 11.188 ( 7.098 -15.798 -4.515) 17.898 11.347 ( 2.246 5.241 1.100) 5.808 11.768 ( -6.508 5.272 -9.540) 12.695 12.828 ( 0.145 -0.662 1.913) 2.030 13.356 ( 0.615 4.089 4.423) 6.055 13.537 ( 2.917 2.973 -2.690) 4.958 13.834 ( -5.030 -1.031 -0.147) 5.137 13.964 ( 4.032 -1.842 -5.063) 6.729 14.523 ( 2.875 -9.097 -14.080) 17.008 14.803 ( -5.649 4.847 -4.999) 8.966 15.371 ( 7.846 1.358 -9.277) 12.226 17.418 ( 4.221 4.822 -8.871) 10.944 18.801 ( 11.479 0.424 -45.978) 47.391 19.713 ( -4.009 5.065 6.365) 9.069 20.774 ( 2.868 -1.532 -14.990) 15.339 23.899 ( -12.777 1.090 55.468) 56.931 25.365 ( -7.339 2.603 29.814) 30.814 28.140 ( 7.114 -2.746 -21.399) 22.717 28.486 ( 3.699 5.475 -17.176) 18.403 ======================= Grid point 300 (147/300) ======================= q-point: (-0.09 0.36 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.146 ( 4.712 5.314 -3.853) 8.080 2.318 ( -0.160 7.893 1.830) 8.104 2.821 ( 19.487 15.347 -14.165) 28.564 3.262 ( -4.921 -4.555 -14.466) 15.945 3.450 ( -1.285 -1.996 -23.960) 24.077 3.633 ( 8.112 -1.404 -16.637) 18.563 4.263 ( -8.139 1.242 2.563) 8.623 4.500 ( 2.373 -6.152 1.817) 6.839 5.016 ( 3.408 9.400 7.998) 12.804 5.513 ( -0.083 -8.995 8.860) 12.626 5.940 ( -5.437 4.367 4.627) 8.370 6.119 ( 1.281 -3.543 3.872) 5.402 6.448 ( -3.742 0.521 10.248) 10.923 6.705 ( -2.018 4.533 10.093) 11.247 7.303 ( -0.029 4.753 7.443) 8.831 7.869 ( -0.713 0.381 -3.827) 3.912 8.230 ( 2.910 -12.414 -8.031) 15.069 8.460 ( 4.908 18.498 -6.590) 20.241 9.252 ( -5.473 -2.535 12.490) 13.870 9.415 ( -4.246 1.893 8.113) 9.351 9.963 ( -3.817 -7.048 8.692) 11.824 10.269 ( 4.545 1.994 8.047) 9.454 10.865 ( -1.130 -3.483 -1.837) 4.097 11.276 ( -0.508 1.795 2.982) 3.517 11.550 ( 9.359 -13.656 -8.988) 18.838 11.622 ( -9.019 1.113 -4.113) 9.975 12.845 ( 0.889 -0.567 0.945) 1.416 13.254 ( -4.002 5.256 3.428) 7.443 13.452 ( 0.904 6.267 -7.075) 9.495 13.839 ( -1.705 -1.702 2.820) 3.709 14.026 ( 6.321 -0.677 -4.329) 7.691 14.627 ( -0.835 -1.918 -6.279) 6.618 14.703 ( 4.764 2.820 -12.883) 14.022 15.470 ( 5.733 -8.864 -10.462) 14.863 17.338 ( 7.230 5.776 -10.259) 13.816 18.720 ( -0.184 4.826 -45.143) 45.401 19.620 ( -1.522 2.952 6.102) 6.947 20.818 ( 6.455 -1.926 -13.748) 15.310 23.899 ( -16.769 -2.292 54.705) 57.263 25.396 ( -3.759 -4.021 30.379) 30.873 28.192 ( 2.720 -2.234 -22.733) 23.004 28.384 ( 6.144 4.723 -17.826) 19.438 ======================= Grid point 306 (148/300) ======================= q-point: (-0.55 -0.55 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.867 ( -12.282 -0.000 17.915) 21.720 1.970 ( -0.124 -0.000 29.340) 29.340 2.856 ( -4.079 -0.000 19.446) 19.869 3.028 ( -2.969 -0.000 12.015) 12.376 3.700 ( 8.655 0.000 23.304) 24.860 3.956 ( -1.208 -0.000 15.086) 15.134 4.114 ( 2.593 0.000 4.491) 5.186 4.464 ( -4.970 -0.000 0.459) 4.991 4.925 ( 4.919 0.000 -9.303) 10.523 5.591 ( 1.414 0.000 -3.878) 4.128 5.773 ( 2.246 0.000 -11.020) 11.247 6.178 ( 3.354 0.000 12.046) 12.504 6.390 ( 3.261 0.000 -12.293) 12.718 6.557 ( -7.666 -0.000 6.629) 10.135 7.007 ( -5.289 -0.000 0.718) 5.337 7.346 ( -5.020 -0.000 -10.145) 11.319 7.996 ( 5.411 0.000 -0.039) 5.411 8.069 ( -5.970 -0.000 4.609) 7.542 8.560 ( 5.057 0.000 21.703) 22.284 9.893 ( -8.602 -0.000 30.228) 31.428 10.365 ( 20.278 0.000 -10.343) 22.764 10.912 ( -6.081 -0.000 -2.511) 6.579 10.969 ( -15.293 -0.000 -0.374) 15.298 11.666 ( -3.035 -0.000 -8.669) 9.185 11.715 ( -9.923 -0.000 -3.022) 10.373 12.253 ( 8.917 0.000 -6.643) 11.120 13.017 ( 7.841 0.000 0.642) 7.867 13.165 ( 4.012 0.000 -0.650) 4.065 13.275 ( 1.058 0.000 -5.049) 5.159 13.508 ( -13.058 -0.000 3.184) 13.440 13.807 ( -3.405 -0.000 2.202) 4.055 14.471 ( -3.638 -0.000 4.201) 5.557 14.554 ( -6.081 -0.000 15.929) 17.050 16.354 ( 28.233 0.000 -34.622) 44.674 17.421 ( -3.203 -0.000 12.157) 12.572 18.291 ( 24.393 0.000 -15.407) 28.851 19.849 ( -0.772 -0.000 6.491) 6.537 21.070 ( 1.388 0.000 -20.237) 20.285 24.142 ( -11.779 -0.000 62.971) 64.063 27.283 ( 2.515 0.000 12.239) 12.495 27.607 ( -6.060 -0.000 -13.094) 14.428 27.933 ( 13.012 0.000 3.114) 13.379 ======================= Grid point 307 (149/300) ======================= q-point: (-0.45 -0.55 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.747 ( -6.344 1.331 16.174) 17.424 2.171 ( -8.557 -12.768 21.084) 26.092 2.889 ( -6.231 -3.561 17.312) 18.741 3.016 ( -6.621 0.782 11.890) 13.631 3.627 ( 7.440 10.104 16.098) 20.410 3.967 ( -15.373 -2.171 14.726) 21.399 4.270 ( 0.478 -3.848 5.029) 6.351 4.437 ( 8.398 -3.558 4.605) 10.218 4.969 ( 5.418 0.144 -6.004) 8.089 5.466 ( 1.811 7.025 -12.154) 14.155 5.720 ( 0.248 6.303 1.348) 6.450 6.328 ( 5.741 -7.162 -6.889) 11.477 6.459 ( -9.947 0.749 7.632) 12.560 6.564 ( 9.146 -9.857 -0.294) 13.450 7.024 ( -4.017 -5.410 -0.244) 6.742 7.341 ( -2.358 -3.725 -9.341) 10.329 7.996 ( -0.105 0.239 1.548) 1.570 8.118 ( -2.098 -6.703 3.651) 7.915 8.662 ( 5.894 -2.369 18.966) 20.002 9.889 ( -6.070 0.142 29.000) 29.629 10.366 ( 16.586 11.502 -8.836) 22.033 10.714 ( -14.464 9.274 -0.349) 17.185 10.898 ( -10.166 0.175 -4.049) 10.944 11.513 ( -2.506 6.930 -2.610) 7.817 11.776 ( -2.726 -5.821 -10.336) 12.172 12.221 ( 5.803 7.783 -4.073) 10.528 13.074 ( -3.925 5.864 -4.910) 8.596 13.175 ( 4.987 -5.433 1.706) 7.570 13.235 ( 5.524 -0.074 -0.326) 5.534 13.537 ( -3.964 -6.467 2.135) 7.880 13.808 ( -3.807 -1.997 1.943) 4.717 14.281 ( -2.598 7.787 1.894) 8.425 14.768 ( -7.553 -13.592 13.985) 20.913 16.370 ( 19.904 12.500 -25.971) 35.027 17.384 ( -3.619 1.441 9.386) 10.163 18.481 ( 26.579 -3.899 -21.350) 34.314 19.860 ( -3.111 -1.172 5.794) 6.680 21.003 ( -0.354 3.551 -20.740) 21.045 24.140 ( -7.808 4.082 63.175) 63.786 26.882 ( -6.784 29.474 11.485) 32.352 27.810 ( 3.784 -11.399 -8.679) 14.818 28.145 ( 10.745 -11.951 -0.570) 16.081 ======================= Grid point 308 (150/300) ======================= q-point: (-0.36 -0.55 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.819 ( -2.475 -9.868 4.833) 11.264 2.348 ( -11.429 -10.321 12.845) 20.053 2.889 ( -9.422 5.361 11.795) 16.020 2.956 ( -7.801 -2.404 6.681) 10.549 3.596 ( 7.421 0.785 12.152) 14.260 3.961 ( -12.201 -6.193 13.566) 19.269 4.193 ( -1.863 5.944 -0.334) 6.238 4.664 ( 6.761 -2.428 4.294) 8.369 4.934 ( 6.111 2.199 -0.521) 6.515 5.418 ( 0.780 -1.303 -12.245) 12.339 5.597 ( 2.442 6.390 1.037) 6.919 6.365 ( -3.910 1.717 3.804) 5.719 6.455 ( 0.679 -3.306 -2.643) 4.287 6.801 ( 6.269 -5.825 3.314) 9.177 7.154 ( -0.200 -9.245 -1.208) 9.325 7.399 ( -1.817 -5.396 -7.578) 9.479 8.019 ( -1.223 -1.809 4.992) 5.449 8.295 ( -1.284 -12.708 4.256) 13.463 8.799 ( 3.943 -6.538 10.289) 12.813 9.891 ( 3.469 4.785 18.094) 19.035 10.193 ( 4.923 10.921 0.994) 12.020 10.433 ( -14.276 9.606 0.389) 17.212 10.796 ( -5.261 2.805 -5.276) 7.961 11.366 ( -0.879 8.037 -0.093) 8.085 11.793 ( 0.767 2.550 -12.564) 12.843 12.076 ( 2.234 8.206 -2.982) 9.012 12.908 ( -2.920 5.515 -1.487) 6.415 13.293 ( 5.701 -1.941 1.155) 6.132 13.379 ( 4.039 -9.235 0.030) 10.080 13.653 ( -0.780 -6.832 2.523) 7.325 13.822 ( -3.996 -2.305 0.057) 4.613 14.176 ( -1.718 1.776 -5.060) 5.632 14.935 ( -9.713 -7.756 11.039) 16.624 16.094 ( 11.260 22.638 -14.200) 28.999 17.395 ( -2.194 -3.199 2.873) 4.827 18.699 ( 27.116 -2.893 -30.430) 40.861 19.861 ( -5.375 -1.041 5.310) 7.627 20.877 ( -1.627 4.736 -20.568) 21.169 24.111 ( -4.299 5.835 62.152) 62.573 26.283 ( -13.803 27.976 18.566) 36.303 27.978 ( 7.882 -4.509 -10.523) 13.900 28.434 ( 9.142 -10.140 -7.160) 15.416 ======================= Grid point 309 (151/300) ======================= q-point: (-0.27 -0.55 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.045 ( -2.093 -14.008 -5.666) 15.254 2.436 ( -11.158 -6.031 7.193) 14.581 2.700 ( -13.608 3.668 1.236) 14.148 2.968 ( 1.286 -0.509 -0.334) 1.423 3.700 ( 5.820 -1.962 7.374) 9.597 4.040 ( -7.268 -4.129 1.115) 8.433 4.108 ( -0.916 -1.464 10.077) 10.223 4.524 ( 4.515 13.881 -15.267) 21.123 5.058 ( -1.457 -5.674 8.766) 10.543 5.408 ( 10.973 4.187 0.711) 11.766 5.567 ( -3.352 -3.543 -4.126) 6.388 6.363 ( -1.192 -2.509 4.813) 5.557 6.459 ( -0.100 3.004 1.072) 3.191 6.879 ( -0.888 -0.176 7.242) 7.298 7.320 ( 2.535 -7.776 -1.660) 8.345 7.483 ( -1.730 -5.907 -6.714) 9.109 8.026 ( -3.130 0.837 6.236) 7.027 8.554 ( -0.280 -14.075 5.157) 14.993 9.005 ( 0.258 -10.855 6.057) 12.433 9.732 ( 11.427 16.085 -5.982) 20.618 10.103 ( -15.874 7.587 6.403) 18.723 10.226 ( 0.552 -1.498 13.345) 13.440 10.752 ( 3.229 -1.047 -3.632) 4.971 11.192 ( -1.641 9.272 1.718) 9.572 11.652 ( 2.680 10.059 -7.141) 12.624 11.959 ( -1.806 4.709 -8.454) 9.844 12.835 ( -0.129 1.578 1.218) 1.998 13.379 ( 5.873 -2.080 2.131) 6.585 13.536 ( 2.242 -4.510 0.857) 5.109 13.763 ( -2.634 -4.321 7.261) 8.850 13.849 ( -2.738 -4.177 -8.073) 9.494 14.178 ( 0.990 -4.429 -11.531) 12.392 14.943 ( -11.174 0.265 5.273) 12.359 15.743 ( 9.162 18.517 -8.986) 22.529 17.448 ( -1.132 -2.919 -1.819) 3.621 18.843 ( 22.744 0.475 -38.165) 44.431 19.836 ( -5.921 0.599 5.095) 7.834 20.761 ( -1.218 2.283 -18.807) 18.984 24.073 ( -3.749 6.773 59.906) 60.404 25.762 ( -15.386 19.607 24.890) 35.223 28.069 ( 8.020 -1.873 -14.795) 16.933 28.589 ( 6.962 -1.904 -11.907) 13.924 ======================= Grid point 310 (152/300) ======================= q-point: (-0.18 -0.55 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.174 ( -7.964 -3.407 -5.880) 10.470 2.458 ( -8.671 -2.881 2.567) 9.491 2.693 ( -4.575 -12.361 -9.899) 16.484 3.011 ( 9.278 -1.312 -9.529) 13.364 3.662 ( 5.122 9.644 -6.167) 12.541 4.045 ( -1.276 2.637 -2.601) 3.918 4.201 ( -6.874 -4.616 2.513) 8.653 4.299 ( 5.301 5.571 -10.685) 13.164 5.113 ( -3.318 -3.419 7.877) 9.206 5.405 ( 9.001 5.416 3.298) 11.010 5.688 ( -1.219 -10.581 3.403) 11.181 6.354 ( -1.581 7.776 4.407) 9.077 6.425 ( -0.714 -2.647 6.009) 6.605 6.844 ( -5.580 2.377 10.344) 11.991 7.431 ( 2.214 -0.124 1.197) 2.520 7.603 ( -2.934 -11.503 -6.381) 13.478 7.989 ( -2.027 0.389 0.795) 2.212 8.831 ( 2.393 -13.338 6.739) 15.134 9.092 ( -0.964 5.389 4.860) 7.321 9.598 ( 7.191 2.201 -7.794) 10.831 9.804 ( -14.968 9.652 7.529) 19.336 10.320 ( 1.149 -0.970 13.805) 13.886 10.896 ( 9.302 -7.207 -3.733) 12.345 11.051 ( -0.024 2.208 3.367) 4.026 11.484 ( 2.397 8.330 -3.230) 9.250 11.814 ( -5.256 6.375 -11.193) 13.912 12.834 ( 1.580 -0.065 3.482) 3.824 13.421 ( 0.606 1.618 2.466) 3.011 13.599 ( 4.551 -0.163 0.278) 4.563 13.775 ( -6.717 -0.628 0.791) 6.792 13.914 ( 1.125 -4.405 -4.826) 6.630 14.320 ( 3.328 -10.585 -15.399) 18.980 14.829 ( -7.395 3.565 -0.239) 8.213 15.524 ( 7.796 10.240 -8.526) 15.438 17.468 ( 0.561 -0.149 -5.762) 5.791 18.866 ( 15.470 3.872 -43.862) 46.671 19.769 ( -5.386 3.119 5.493) 8.301 20.725 ( 1.245 -1.726 -16.126) 16.266 24.004 ( -7.236 7.150 57.646) 58.536 25.449 ( -11.582 8.389 27.889) 31.342 28.122 ( 7.473 -1.225 -18.814) 20.281 28.578 ( 4.296 4.045 -15.104) 16.216 ======================= Grid point 311 (153/300) ======================= q-point: (-0.09 -0.55 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.149 ( -4.835 -2.216 -5.328) 7.529 2.417 ( -4.444 2.417 0.686) 5.105 2.959 ( -0.180 -16.766 -14.513) 22.176 3.110 ( 14.803 -0.904 -15.904) 21.746 3.475 ( 5.708 10.504 -13.152) 17.773 3.815 ( 3.895 15.041 -22.400) 27.261 4.187 ( -9.856 -2.407 -0.509) 10.158 4.391 ( 1.254 -6.593 4.691) 8.188 5.182 ( 3.437 0.556 7.841) 8.579 5.387 ( 0.034 -1.800 6.552) 6.795 5.882 ( -0.454 -7.847 6.807) 10.398 6.186 ( -2.915 8.087 4.580) 9.740 6.449 ( -2.514 0.156 8.858) 9.210 6.773 ( -4.574 2.898 10.338) 11.670 7.391 ( -1.368 3.671 6.130) 7.275 7.777 ( -3.980 -7.919 -4.834) 10.096 8.052 ( 6.142 -7.862 -6.450) 11.880 8.826 ( 2.039 17.794 -5.888) 18.854 9.119 ( 1.391 -10.531 11.301) 15.509 9.483 ( -9.457 7.854 8.349) 14.860 9.785 ( -0.385 -8.956 4.679) 10.112 10.325 ( -2.300 1.352 12.279) 12.566 10.913 ( 5.801 4.374 -1.501) 7.418 11.238 ( 0.366 -8.161 -1.207) 8.258 11.416 ( 8.427 -2.590 -2.173) 9.080 11.620 ( -8.846 6.422 -10.451) 15.124 12.859 ( 2.803 -0.084 4.159) 5.016 13.333 ( -5.508 5.602 2.579) 8.269 13.570 ( 2.886 5.917 -5.286) 8.442 13.776 ( -2.516 -3.529 1.405) 4.556 14.003 ( 3.112 -4.201 -4.213) 6.715 14.511 ( 2.180 -8.855 -13.522) 16.310 14.748 ( 0.984 1.710 -6.501) 6.794 15.432 ( 4.642 2.514 -7.805) 9.422 17.446 ( 3.452 2.365 -9.088) 10.005 18.771 ( 8.066 6.749 -47.002) 48.165 19.678 ( -3.492 3.656 5.961) 7.816 20.775 ( 3.974 -3.841 -13.959) 15.013 23.918 ( -11.501 4.867 55.848) 57.227 25.363 ( -7.555 -0.413 29.010) 29.981 28.155 ( 5.541 -0.825 -22.061) 22.761 28.485 ( 4.336 5.134 -16.582) 17.892 ======================= Grid point 318 (154/300) ======================= q-point: (-0.45 -0.45 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.732 ( -14.785 -0.000 16.706) 22.309 2.004 ( -8.774 -0.000 24.948) 26.446 2.833 ( -7.034 -0.000 19.087) 20.341 3.012 ( -5.431 -0.000 15.566) 16.487 3.803 ( -22.489 -0.000 17.608) 28.562 3.817 ( -4.921 -0.000 21.162) 21.727 4.270 ( 10.790 0.000 4.398) 11.652 4.441 ( 2.710 0.000 0.060) 2.710 4.972 ( 5.116 0.000 -6.785) 8.498 5.601 ( 2.708 0.000 -4.599) 5.337 5.775 ( 3.308 0.000 -10.537) 11.044 6.279 ( 1.843 0.000 15.173) 15.284 6.398 ( 3.761 0.000 -12.191) 12.758 6.530 ( 2.537 0.000 5.108) 5.703 6.952 ( -2.367 -0.000 -0.881) 2.526 7.282 ( 1.589 0.000 -11.790) 11.896 7.993 ( -6.572 -0.000 3.952) 7.669 8.049 ( 3.286 0.000 -0.919) 3.412 8.738 ( 8.536 0.000 21.714) 23.332 9.891 ( -6.532 -0.000 32.309) 32.963 10.571 ( 10.508 0.000 -13.112) 16.803 10.727 ( -14.519 -0.000 0.296) 14.522 10.789 ( -9.440 -0.000 -4.533) 10.472 11.580 ( -7.815 -0.000 -2.929) 8.346 11.660 ( 6.060 0.000 -8.156) 10.161 12.329 ( 4.405 0.000 -4.739) 6.470 13.116 ( -8.447 -0.000 -3.643) 9.199 13.121 ( 6.948 0.000 -2.132) 7.267 13.291 ( 2.529 0.000 0.011) 2.529 13.445 ( 1.428 0.000 3.330) 3.624 13.763 ( -3.827 -0.000 1.754) 4.209 14.419 ( -5.449 -0.000 2.421) 5.963 14.539 ( -3.526 -0.000 15.713) 16.104 16.598 ( 21.776 0.000 -27.823) 35.331 17.402 ( -5.251 -0.000 11.442) 12.589 18.563 ( 21.415 0.000 -18.759) 28.469 19.836 ( -3.996 -0.000 5.618) 6.894 20.995 ( -1.821 -0.000 -21.271) 21.349 24.246 ( -4.293 -0.000 63.381) 63.526 27.366 ( 3.056 0.000 12.793) 13.153 27.472 ( -6.179 -0.000 -13.216) 14.589 28.123 ( 11.517 0.000 3.615) 12.071 ======================= Grid point 319 (155/300) ======================= q-point: (-0.36 -0.45 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.670 ( -11.101 -3.059 13.864) 18.022 2.074 ( -14.873 -9.946 17.692) 25.163 2.858 ( -5.783 -3.687 17.238) 18.552 2.950 ( -9.063 5.211 16.418) 19.464 3.653 ( -14.065 0.846 16.901) 22.004 3.796 ( -14.491 -2.193 17.127) 22.542 4.291 ( 3.599 4.568 0.631) 5.850 4.582 ( 6.699 -9.309 7.469) 13.686 5.019 ( 3.867 -0.266 -4.774) 6.149 5.450 ( 2.428 9.584 -12.850) 16.214 5.778 ( 7.475 4.768 -1.457) 8.985 6.356 ( -5.058 -3.414 10.371) 12.033 6.380 ( 2.271 0.128 -10.025) 10.280 6.716 ( 10.435 -10.393 4.489) 15.396 6.992 ( -0.247 -6.225 -1.625) 6.438 7.309 ( 3.125 -2.378 -10.804) 11.496 7.958 ( -5.582 -1.391 4.262) 7.160 8.133 ( 2.861 -6.201 1.013) 6.904 8.826 ( 7.811 0.642 16.358) 18.139 9.926 ( -3.042 -1.841 31.167) 31.369 10.461 ( -17.214 5.389 -5.244) 18.784 10.515 ( 3.334 15.173 -6.472) 16.829 10.767 ( -3.571 -0.850 -3.925) 5.374 11.477 ( -3.132 4.523 -1.688) 5.755 11.751 ( 5.326 -3.787 -10.392) 12.276 12.266 ( 2.248 7.970 -3.067) 8.831 12.983 ( -5.815 5.380 -2.937) 8.448 13.240 ( 4.117 -7.124 -2.683) 8.655 13.308 ( 4.904 -0.504 1.541) 5.165 13.535 ( 0.998 -5.780 2.910) 6.548 13.755 ( -4.298 -1.605 1.056) 4.708 14.254 ( -2.103 7.432 1.039) 7.794 14.711 ( -6.450 -11.134 12.544) 17.970 16.542 ( 15.617 16.326 -21.564) 31.232 17.359 ( -4.280 0.694 8.433) 9.483 18.730 ( 18.606 -5.326 -23.164) 30.185 19.817 ( -5.287 -0.531 5.165) 7.411 20.906 ( -2.798 3.369 -21.414) 21.857 24.299 ( -0.441 4.037 62.777) 62.908 26.794 ( -10.369 33.442 9.401) 36.253 27.856 ( 6.182 -15.459 -7.551) 18.282 28.289 ( 9.258 -9.217 0.603) 13.078 ======================= Grid point 320 (156/300) ======================= q-point: (-0.27 -0.45 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.762 ( -7.344 -11.558 3.822) 14.218 2.183 ( -16.978 -10.778 9.795) 22.369 2.728 ( -16.117 8.864 10.487) 21.173 2.939 ( -1.298 -3.325 12.599) 13.095 3.659 ( -5.323 -5.186 14.556) 16.343 3.824 ( -12.694 -8.632 11.935) 19.445 4.211 ( 3.658 6.320 2.041) 7.582 4.746 ( 4.770 2.766 -0.611) 5.548 4.976 ( -0.721 0.632 2.072) 2.284 5.379 ( -0.010 -2.842 -12.725) 13.039 5.707 ( 11.874 9.044 -1.415) 14.993 6.322 ( -3.901 -0.559 6.368) 7.489 6.460 ( 1.447 -2.989 -3.946) 5.157 6.889 ( 3.839 -1.560 5.531) 6.912 7.183 ( 4.301 -10.144 -1.783) 11.161 7.358 ( 0.247 -3.697 -8.225) 9.021 7.978 ( -7.059 -3.190 7.296) 10.641 8.331 ( 4.664 -11.598 2.668) 12.782 8.899 ( 5.434 -2.590 7.164) 9.357 10.012 ( 2.664 0.035 16.854) 17.063 10.171 ( -9.533 14.300 4.778) 17.839 10.254 ( -7.636 6.263 -3.111) 10.355 10.757 ( 2.046 0.005 -3.386) 3.956 11.342 ( -3.502 7.632 -0.050) 8.397 11.789 ( 5.774 2.822 -12.330) 13.904 12.089 ( 0.499 10.387 -1.650) 10.529 12.873 ( -1.228 2.875 -0.496) 3.166 13.375 ( 2.835 -3.208 2.048) 4.746 13.414 ( 4.187 -7.799 -3.999) 9.713 13.659 ( -1.258 -6.343 6.227) 8.977 13.757 ( -4.059 -2.182 -3.077) 5.542 14.154 ( 0.602 2.307 -5.056) 5.590 14.837 ( -8.198 -5.286 8.960) 13.245 16.193 ( 8.701 23.855 -13.054) 28.551 17.375 ( -2.091 -3.026 2.043) 4.207 18.894 ( 14.495 -3.630 -29.403) 32.982 19.801 ( -4.789 -0.603 4.239) 6.424 20.778 ( -2.070 3.889 -20.269) 20.743 24.308 ( 1.871 7.279 61.328) 61.787 26.126 ( -17.338 28.336 18.452) 38.000 28.055 ( 7.871 -4.001 -11.244) 14.296 28.532 ( 7.825 -8.201 -6.847) 13.242 ======================= Grid point 321 (157/300) ======================= q-point: (-0.18 -0.45 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.956 ( -7.729 -12.491 -5.024) 15.524 2.250 ( -17.537 -7.925 5.255) 19.949 2.527 ( -10.478 0.104 1.239) 10.552 3.014 ( 4.248 -2.603 2.024) 5.377 3.763 ( -1.432 -3.487 8.348) 9.160 3.928 ( -8.599 -7.706 1.053) 11.594 4.149 ( 2.327 2.143 9.165) 9.696 4.555 ( 6.939 15.312 -14.621) 22.280 5.023 ( -5.622 -3.827 5.679) 8.860 5.476 ( -3.066 -9.315 -3.444) 10.394 5.621 ( 12.553 8.381 -0.506) 15.102 6.364 ( -1.173 -3.754 6.708) 7.776 6.464 ( 0.351 3.116 0.194) 3.141 6.882 ( -2.520 3.472 8.761) 9.755 7.365 ( 4.304 -7.241 -1.133) 8.500 7.431 ( -2.607 -5.433 -6.702) 9.013 7.962 ( -8.402 -0.171 6.466) 10.603 8.614 ( 6.108 -13.521 4.203) 15.420 9.043 ( 2.153 -7.257 4.714) 8.918 9.824 ( 2.640 15.359 -12.952) 20.264 9.883 ( -14.919 9.065 8.468) 19.403 10.310 ( 3.643 -5.159 17.654) 18.750 10.819 ( 7.124 -4.858 -1.466) 8.747 11.157 ( -4.739 8.056 1.653) 9.492 11.682 ( 5.901 10.071 -8.236) 14.285 11.907 ( -1.805 8.304 -5.765) 10.269 12.853 ( 2.091 0.175 2.123) 2.985 13.429 ( -2.175 -1.071 1.224) 2.716 13.570 ( 5.261 -5.705 -1.780) 7.962 13.719 ( -5.660 -1.192 1.821) 6.064 13.810 ( -1.047 -6.031 -1.841) 6.392 14.173 ( 3.608 -4.645 -11.495) 12.913 14.826 ( -6.950 1.013 3.844) 8.007 15.825 ( 6.709 18.057 -10.367) 21.876 17.418 ( -2.315 -2.920 -2.425) 4.446 18.955 ( 11.604 1.021 -35.811) 37.658 19.776 ( -4.056 0.880 3.478) 5.415 20.691 ( 0.263 0.720 -17.608) 17.625 24.251 ( -0.501 10.877 59.725) 60.710 25.617 ( -16.995 15.956 24.319) 33.687 28.126 ( 7.161 -1.041 -15.517) 17.122 28.633 ( 4.877 0.394 -12.247) 13.188 ======================= Grid point 322 (158/300) ======================= q-point: (-0.09 -0.45 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.022 ( -10.351 -4.439 -3.715) 11.859 2.301 ( -12.871 -8.224 -0.906) 15.301 2.623 ( -0.769 -13.779 -11.442) 17.927 3.118 ( 9.573 -3.944 -7.228) 12.627 3.706 ( 3.178 8.722 -7.474) 11.918 4.007 ( -5.345 -4.982 1.845) 7.536 4.118 ( 0.137 9.006 -5.851) 10.741 4.352 ( 4.700 3.604 -5.130) 7.836 5.089 ( -4.236 -7.039 7.614) 11.201 5.490 ( 2.175 5.578 -0.437) 6.003 5.718 ( 3.388 -9.537 5.168) 11.364 6.337 ( -3.501 8.389 7.655) 11.884 6.440 ( 0.289 -1.535 4.228) 4.508 6.798 ( -5.887 2.871 10.928) 12.740 7.422 ( -4.772 0.449 2.233) 5.288 7.575 ( 2.238 -10.148 -5.419) 11.720 7.955 ( -2.090 -4.361 -1.120) 4.964 8.925 ( 7.064 -13.092 6.475) 16.225 9.085 ( -2.328 6.660 1.671) 7.250 9.574 ( -10.720 8.053 3.782) 13.931 9.710 ( 1.841 1.494 -0.558) 2.436 10.376 ( -0.132 2.735 13.971) 14.237 11.002 ( 3.917 0.268 -2.711) 4.772 11.070 ( 3.113 -8.520 3.839) 9.849 11.524 ( 5.542 8.387 -3.860) 10.768 11.708 ( -3.869 9.666 -9.940) 14.394 12.887 ( 3.910 -0.482 4.340) 5.861 13.375 ( -7.100 3.167 0.434) 7.786 13.666 ( -4.217 2.442 -4.559) 6.674 13.694 ( 5.102 -3.734 1.248) 6.445 13.912 ( -1.046 -5.756 -0.554) 5.876 14.325 ( 4.851 -9.769 -15.253) 18.752 14.765 ( -1.541 1.300 -1.147) 2.319 15.582 ( 5.024 10.951 -10.257) 15.823 17.437 ( -2.391 -1.695 -6.223) 6.879 18.899 ( 11.113 6.250 -42.060) 43.950 19.719 ( -3.822 2.656 4.118) 6.214 20.700 ( 2.509 -3.388 -14.874) 15.460 24.108 ( -6.498 11.715 57.977) 59.505 25.379 ( -11.571 4.218 26.707) 29.410 28.155 ( 6.584 -0.200 -19.887) 20.949 28.576 ( 2.672 4.759 -14.921) 15.888 ======================= Grid point 330 (159/300) ======================= q-point: (-0.36 -0.36 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.577 ( -15.047 -0.000 17.848) 23.344 1.890 ( -17.523 -0.000 18.872) 25.753 2.818 ( -4.722 -0.000 21.956) 22.458 2.994 ( -5.102 -0.000 18.010) 18.719 3.487 ( -31.622 -0.000 23.708) 39.522 3.717 ( -16.087 -0.000 14.728) 21.811 4.398 ( 4.883 0.000 4.127) 6.394 4.520 ( 5.748 0.000 3.156) 6.557 5.018 ( 4.587 0.000 -5.551) 7.201 5.641 ( 5.630 0.000 -7.129) 9.084 5.793 ( 4.575 0.000 -11.582) 12.453 6.317 ( -2.494 -0.000 15.488) 15.688 6.412 ( 4.124 0.000 -12.451) 13.116 6.662 ( 10.750 0.000 8.122) 13.474 6.937 ( 0.748 0.000 -0.964) 1.220 7.313 ( 8.677 0.000 -12.860) 15.513 7.918 ( -5.636 -0.000 3.988) 6.904 8.097 ( 4.205 0.000 -0.661) 4.257 8.928 ( 7.991 0.000 16.685) 18.500 9.940 ( -2.587 -0.000 33.892) 33.990 10.354 ( -22.652 -0.000 -7.342) 23.812 10.625 ( -11.148 -0.000 -3.105) 11.572 10.789 ( 11.855 0.000 -7.072) 13.804 11.466 ( -7.231 -0.000 -2.328) 7.597 11.767 ( 12.300 0.000 -7.820) 14.576 12.344 ( -0.056 -0.000 -3.760) 3.761 12.985 ( -6.790 -0.000 -3.656) 7.712 13.196 ( 4.737 0.000 -3.566) 5.929 13.340 ( 3.111 0.000 3.860) 4.958 13.496 ( 3.326 0.000 0.766) 3.413 13.714 ( -3.671 -0.000 2.068) 4.214 14.335 ( -7.077 -0.000 1.174) 7.174 14.566 ( 0.066 0.000 13.843) 13.843 16.782 ( 16.879 0.000 -24.830) 30.024 17.353 ( -6.826 -0.000 10.447) 12.480 18.740 ( 12.223 0.000 -21.111) 24.394 19.779 ( -6.467 -0.000 4.855) 8.086 20.877 ( -3.940 -0.000 -21.614) 21.971 24.456 ( 3.359 0.000 61.570) 61.662 27.346 ( -5.223 -0.000 -12.422) 13.475 27.454 ( 3.236 0.000 12.048) 12.475 28.275 ( 8.091 0.000 2.916) 8.600 ======================= Grid point 331 (160/300) ======================= q-point: (-0.27 -0.36 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.547 ( -12.708 -5.193 14.865) 20.234 1.878 ( -19.800 -8.876 14.036) 25.842 2.811 ( -12.046 6.728 15.124) 20.472 2.905 ( -4.914 0.762 24.061) 24.569 3.434 ( -22.315 -10.979 22.362) 33.445 3.643 ( -15.077 -3.072 11.919) 19.463 4.358 ( 3.690 5.565 1.928) 6.950 4.665 ( 1.662 -8.536 7.392) 11.414 5.047 ( 2.747 1.177 -5.071) 5.886 5.454 ( 4.870 12.263 -13.566) 18.925 5.896 ( 9.818 0.114 -5.176) 11.099 6.320 ( -3.766 1.449 10.707) 11.443 6.401 ( 4.026 -1.766 -9.387) 10.365 6.871 ( 8.045 -7.133 7.784) 13.274 7.000 ( 1.824 -7.551 -1.444) 7.902 7.362 ( 9.811 0.450 -11.286) 14.961 7.888 ( -6.556 -0.998 6.403) 9.218 8.200 ( 6.287 -7.045 -0.107) 9.443 8.972 ( 5.509 2.697 9.761) 11.528 10.005 ( -2.767 -1.437 24.030) 24.232 10.166 ( -19.288 0.470 1.797) 19.378 10.448 ( -7.020 10.916 -3.123) 13.349 10.806 ( 7.955 3.306 -4.077) 9.531 11.398 ( -6.637 2.332 -1.764) 7.253 11.852 ( 12.567 -0.078 -9.211) 15.582 12.264 ( -1.071 7.078 -2.480) 7.576 12.912 ( -2.372 2.476 -2.528) 4.260 13.265 ( 0.300 -4.902 -4.482) 6.649 13.391 ( 5.592 -2.221 3.876) 7.158 13.554 ( 0.022 -4.163 1.974) 4.607 13.702 ( -3.111 -0.672 0.102) 3.184 14.219 ( -3.245 4.932 -0.159) 5.906 14.688 ( -2.190 -7.301 10.843) 13.254 16.653 ( 9.609 19.398 -19.761) 29.311 17.324 ( -4.064 -0.951 6.268) 7.530 18.825 ( 5.266 -5.375 -22.772) 23.983 19.756 ( -5.282 -1.505 3.309) 6.412 20.787 ( -3.281 2.512 -20.822) 21.228 24.557 ( 6.694 4.339 59.640) 60.171 26.661 ( -13.015 38.128 10.094) 41.534 27.924 ( 7.192 -17.022 -8.900) 20.510 28.403 ( 6.442 -8.188 0.099) 10.419 ======================= Grid point 332 (161/300) ======================= q-point: (-0.18 -0.36 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.646 ( -10.824 -11.946 4.776) 16.813 1.952 ( -19.653 -10.726 8.870) 24.082 2.531 ( -16.616 8.631 11.832) 22.149 2.985 ( 0.913 -3.703 14.045) 14.554 3.578 ( -12.437 -12.208 17.901) 24.983 3.694 ( -10.410 -9.692 8.717) 16.682 4.276 ( 3.134 5.887 2.827) 7.243 4.806 ( 3.757 0.971 -0.014) 3.880 4.944 ( -3.409 4.415 -0.789) 5.633 5.348 ( 2.482 -0.345 -12.283) 12.536 5.870 ( 10.882 8.565 -3.928) 14.395 6.313 ( -0.513 -1.805 7.581) 7.810 6.466 ( 1.243 -2.600 -4.026) 4.951 6.954 ( 2.612 2.013 6.433) 7.229 7.213 ( -1.163 -11.129 -1.258) 11.260 7.380 ( 7.274 1.500 -5.864) 9.463 7.882 ( -9.982 -2.180 8.916) 13.561 8.437 ( 8.871 -11.666 1.102) 14.697 8.984 ( 3.536 -1.280 1.954) 4.238 9.872 ( -18.795 4.994 0.416) 19.451 10.114 ( -9.322 10.810 -6.392) 15.640 10.279 ( 10.361 -2.448 25.464) 27.600 10.816 ( 6.629 -0.209 -1.096) 6.723 11.258 ( -7.534 6.808 -0.780) 10.184 11.876 ( 11.362 5.531 -10.273) 16.286 12.081 ( -0.599 10.729 -1.221) 10.814 12.878 ( 2.144 0.662 -0.202) 2.253 13.335 ( -5.348 -4.869 -4.537) 8.538 13.513 ( 6.815 -4.744 2.010) 8.543 13.649 ( -2.709 -5.351 6.110) 8.562 13.689 ( -3.435 -1.879 -6.035) 7.194 14.148 ( 0.820 0.902 -4.417) 4.582 14.781 ( -3.372 -2.691 6.840) 8.087 16.238 ( 4.085 23.506 -14.193) 27.761 17.345 ( -2.791 -2.425 0.876) 3.800 18.910 ( 1.939 -5.255 -25.061) 25.679 19.761 ( -2.522 -0.999 0.141) 2.716 20.688 ( -0.689 2.213 -18.778) 18.920 24.582 ( 7.397 9.982 58.816) 60.114 25.919 ( -21.539 28.353 20.889) 41.281 28.117 ( 6.739 -3.206 -13.395) 15.334 28.601 ( 5.231 -6.139 -8.414) 11.655 ======================= Grid point 333 (162/300) ======================= q-point: (-0.09 -0.36 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.805 ( -10.958 -10.818 -3.215) 15.731 2.005 ( -18.799 -9.654 6.242) 22.036 2.413 ( -6.062 -4.803 -1.276) 7.838 3.090 ( 4.988 -4.098 2.781) 7.029 3.731 ( -6.636 -6.587 10.232) 13.860 3.817 ( -6.664 -7.903 -0.265) 10.341 4.218 ( 2.309 2.476 7.253) 8.004 4.611 ( 7.280 16.310 -13.208) 22.214 4.953 ( -6.238 -4.356 3.406) 8.336 5.428 ( -1.192 -7.670 -2.667) 8.207 5.772 ( 8.476 7.175 -1.678) 11.231 6.384 ( 0.239 -2.789 9.469) 9.874 6.467 ( 0.093 2.699 -0.865) 2.835 6.869 ( -3.952 6.851 9.687) 12.506 7.329 ( -8.015 -5.206 -1.436) 9.665 7.459 ( 8.440 -4.982 -3.784) 10.506 7.854 ( -8.899 -2.404 5.488) 10.728 8.738 ( 8.722 -13.205 3.393) 16.185 9.082 ( 1.069 -4.558 1.008) 4.789 9.632 ( -15.666 6.904 1.041) 17.151 9.840 ( -2.329 10.291 -2.627) 10.874 10.446 ( 6.393 -0.695 17.093) 18.263 10.938 ( 9.503 -7.165 1.246) 11.967 11.070 ( -7.193 6.073 0.105) 9.415 11.759 ( 6.970 11.782 -4.386) 14.375 11.880 ( 1.859 10.560 -6.784) 12.688 12.910 ( 4.593 -0.872 2.425) 5.267 13.340 ( -8.184 -1.179 -2.670) 8.688 13.588 ( -5.749 -1.855 -2.784) 6.652 13.712 ( 7.409 -2.641 -1.202) 7.956 13.771 ( -4.751 -7.302 1.940) 8.925 14.195 ( 4.791 -5.224 -10.317) 12.517 14.776 ( -2.128 1.050 2.521) 3.462 15.861 ( 4.510 17.118 -13.812) 22.452 17.362 ( -4.279 -2.152 -2.446) 5.378 18.952 ( 5.470 -1.213 -31.539) 32.033 19.739 ( -2.850 1.337 0.167) 3.153 20.648 ( 2.109 -0.857 -16.296) 16.454 24.459 ( 0.198 17.132 59.660) 62.072 25.451 ( -18.049 10.322 24.457) 32.101 28.163 ( 6.118 -0.519 -17.141) 18.208 28.637 ( 1.898 2.177 -13.423) 13.730 ======================= Grid point 342 (163/300) ======================= q-point: (-0.27 -0.27 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.443 ( -12.921 -0.000 21.379) 24.980 1.663 ( -22.012 -0.000 16.080) 27.260 2.829 ( -8.227 -0.000 23.562) 24.957 2.990 ( -4.718 -0.000 18.421) 19.015 3.107 ( -31.592 -0.000 30.648) 44.015 3.512 ( -17.415 -0.000 10.499) 20.335 4.439 ( -0.903 -0.000 4.956) 5.038 4.590 ( 1.976 0.000 4.175) 4.619 5.070 ( 5.310 0.000 -5.457) 7.615 5.705 ( 7.226 0.000 -9.103) 11.623 5.823 ( 5.695 0.000 -13.548) 14.697 6.343 ( -1.098 -0.000 15.957) 15.995 6.425 ( 3.833 0.000 -13.137) 13.685 6.837 ( 8.193 0.000 10.047) 12.964 6.971 ( 4.188 0.000 0.948) 4.294 7.436 ( 14.972 0.000 -13.496) 20.157 7.867 ( -3.506 -0.000 4.862) 5.994 8.168 ( 5.920 0.000 -0.270) 5.926 9.050 ( 2.160 0.000 6.907) 7.237 9.986 ( -25.092 -0.000 -7.883) 26.301 10.034 ( -1.322 -0.000 26.588) 26.621 10.496 ( -5.184 -0.000 10.034) 11.294 10.918 ( 9.988 0.000 -7.738) 12.635 11.362 ( -6.316 -0.000 -0.619) 6.346 11.934 ( 14.182 0.000 -7.542) 16.063 12.306 ( -3.309 -0.000 -3.323) 4.690 12.915 ( -1.214 -0.000 -3.487) 3.692 13.213 ( -0.829 -0.000 -4.325) 4.404 13.401 ( 2.231 0.000 6.556) 6.925 13.525 ( 0.670 0.000 -2.352) 2.446 13.687 ( -0.393 -0.000 2.131) 2.167 14.236 ( -7.034 -0.000 1.012) 7.106 14.636 ( 3.560 0.000 11.118) 11.674 16.893 ( 10.393 0.000 -25.864) 27.874 17.288 ( -6.907 -0.000 9.554) 11.789 18.731 ( -4.216 -0.000 -21.932) 22.333 19.693 ( -7.679 -0.000 4.452) 8.876 20.752 ( -2.669 -0.000 -20.285) 20.460 24.755 ( 9.544 0.000 55.266) 56.084 27.242 ( -3.711 -0.000 -11.140) 11.742 27.538 ( 3.202 0.000 9.121) 9.667 28.368 ( 4.026 0.000 1.427) 4.272 ======================= Grid point 343 (164/300) ======================= q-point: (-0.18 -0.27 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.422 ( -12.976 -4.249 18.324) 22.852 1.635 ( -20.457 -9.189 14.053) 26.466 2.612 ( -23.547 10.658 19.697) 32.496 2.957 ( -0.783 -2.176 24.958) 25.065 3.231 ( -17.130 -15.349 21.210) 31.287 3.477 ( -12.195 -6.529 10.726) 17.503 4.387 ( -0.805 4.193 3.390) 5.452 4.688 ( -1.645 -7.561 6.469) 10.086 5.066 ( 2.667 4.197 -6.186) 7.936 5.502 ( 8.495 13.239 -13.642) 20.821 5.996 ( 6.895 -3.671 -8.128) 11.273 6.326 ( 0.279 2.186 6.865) 7.210 6.429 ( 3.541 -0.819 -4.731) 5.966 6.991 ( 3.962 -5.858 8.950) 11.406 7.023 ( 2.050 -3.396 0.344) 3.981 7.505 ( 15.364 3.098 -10.453) 18.839 7.822 ( -6.502 1.575 8.624) 10.914 8.307 ( 8.722 -8.877 -0.793) 12.470 9.017 ( -2.512 2.708 -1.021) 3.832 9.783 ( -22.913 1.321 -5.393) 23.577 10.071 ( -9.856 -1.672 11.184) 15.001 10.470 ( 9.456 5.160 22.449) 24.900 10.910 ( 8.318 4.575 -4.015) 10.307 11.298 ( -6.321 3.125 -0.390) 7.062 12.013 ( 13.400 1.200 -8.165) 15.738 12.228 ( -1.967 5.355 -2.684) 6.305 12.904 ( 2.267 0.520 -2.394) 3.338 13.213 ( -4.789 -2.583 -5.815) 7.963 13.465 ( 0.536 -4.416 6.830) 8.151 13.540 ( -2.351 -2.851 -3.389) 5.014 13.683 ( 1.519 1.347 0.645) 2.130 14.169 ( -3.334 1.876 0.550) 3.865 14.724 ( 2.173 -3.461 8.298) 9.250 16.662 ( 1.067 21.393 -20.780) 29.844 17.291 ( -3.141 -2.117 4.056) 5.550 18.717 ( -9.841 -7.975 -20.005) 23.678 19.686 ( -6.126 -3.484 1.729) 7.257 20.691 ( 0.126 1.612 -18.841) 18.910 24.883 ( 11.323 4.077 51.542) 52.928 26.498 ( -15.888 44.732 14.227) 49.556 27.989 ( 6.988 -16.535 -12.785) 22.039 28.467 ( 3.028 -8.217 -2.180) 9.024 ======================= Grid point 344 (165/300) ======================= q-point: (-0.09 -0.27 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.499 ( -12.374 -11.083 7.827) 18.363 1.701 ( -20.372 -9.935 11.502) 25.417 2.355 ( -13.203 3.908 11.101) 17.687 3.050 ( 1.326 -3.660 12.689) 13.273 3.451 ( -13.979 -16.219 17.416) 27.600 3.609 ( -5.230 -10.637 9.790) 15.373 4.303 ( -0.914 4.515 3.543) 5.812 4.822 ( -4.170 -6.574 4.892) 9.195 4.907 ( 1.824 11.948 -8.236) 14.626 5.380 ( 7.882 3.518 -11.589) 14.450 5.966 ( 4.755 7.595 -4.856) 10.192 6.362 ( 3.657 -2.340 5.910) 7.333 6.470 ( 1.086 -1.465 -1.693) 2.488 7.001 ( -0.130 5.983 6.075) 8.527 7.145 ( -7.495 -7.416 2.166) 10.764 7.503 ( 10.544 3.009 -1.553) 11.074 7.772 ( -8.553 -0.258 7.366) 11.291 8.575 ( 9.819 -11.734 0.174) 15.302 8.993 ( -1.818 -3.971 -5.634) 7.129 9.594 ( -19.453 2.134 -3.295) 19.845 9.952 ( -11.442 5.870 4.868) 13.751 10.553 ( 15.519 1.877 21.463) 26.553 10.925 ( 8.572 -1.239 1.471) 8.785 11.147 ( -6.937 7.065 -1.205) 9.975 12.005 ( 8.178 8.404 -5.260) 12.852 12.083 ( 4.202 9.166 -4.827) 11.179 12.930 ( 4.958 -0.747 -0.026) 5.014 13.219 ( -7.619 -3.898 -6.475) 10.732 13.525 ( -5.793 -0.409 -3.976) 7.038 13.590 ( -6.331 -7.497 2.152) 10.046 13.714 ( 7.806 -2.243 0.924) 8.174 14.149 ( 1.314 -1.244 -2.967) 3.476 14.779 ( -0.550 -0.326 4.833) 4.875 16.213 ( 0.538 20.645 -18.006) 27.399 17.304 ( -3.380 -1.056 1.222) 3.746 18.807 ( -4.278 -10.036 -22.251) 24.782 19.704 ( -5.805 -2.193 -0.853) 6.264 20.643 ( 3.447 1.174 -17.285) 17.664 24.913 ( 11.449 13.387 53.871) 56.678 25.654 ( -27.598 27.969 26.042) 47.139 28.152 ( 5.291 -2.587 -15.883) 16.940 28.615 ( 1.505 -4.150 -11.619) 12.429 ======================= Grid point 354 (166/300) ======================= q-point: (-0.18 -0.18 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.369 ( -8.739 -0.000 26.173) 27.594 1.401 ( -22.660 -0.000 17.560) 28.668 2.564 ( -36.143 -0.000 31.309) 47.818 2.956 ( -9.006 -0.000 12.210) 15.172 3.008 ( -2.412 -0.000 29.998) 30.095 3.344 ( -10.324 -0.000 13.106) 16.684 4.423 ( -3.475 -0.000 5.698) 6.674 4.606 ( -1.274 -0.000 3.787) 3.996 5.123 ( 4.695 0.000 -5.724) 7.403 5.779 ( 7.438 0.000 -9.809) 12.311 5.858 ( 6.163 0.000 -15.348) 16.539 6.399 ( 1.184 0.000 16.644) 16.686 6.428 ( 3.187 0.000 -13.853) 14.215 6.941 ( 1.266 0.000 9.589) 9.673 7.056 ( 6.307 0.000 3.625) 7.275 7.641 ( 20.455 0.000 -13.097) 24.289 7.856 ( -0.845 -0.000 6.311) 6.367 8.253 ( 5.289 0.000 -0.045) 5.289 8.990 ( -11.867 -0.000 -7.554) 14.067 9.598 ( -25.195 -0.000 -9.286) 26.852 10.015 ( -9.663 -0.000 15.802) 18.523 10.650 ( 16.871 0.000 25.931) 30.936 11.022 ( 8.529 0.000 -7.371) 11.273 11.305 ( -1.313 -0.000 4.111) 4.315 12.074 ( 5.610 0.000 -5.374) 7.768 12.260 ( 1.825 0.000 -5.161) 5.474 12.922 ( 3.649 0.000 -3.184) 4.843 13.148 ( -5.489 -0.000 -5.613) 7.851 13.420 ( -2.883 -0.000 6.533) 7.141 13.481 ( -5.263 -0.000 -6.269) 8.186 13.732 ( 4.846 0.000 3.669) 6.078 14.161 ( -3.792 -0.000 2.637) 4.619 14.734 ( 5.135 0.000 8.298) 9.758 16.861 ( -3.187 -0.000 -31.161) 31.323 17.233 ( -5.088 -0.000 9.322) 10.620 18.458 ( -24.191 -0.000 -14.887) 28.405 19.600 ( -7.186 -0.000 4.471) 8.463 20.684 ( 2.913 0.000 -17.941) 18.176 25.071 ( 9.190 0.000 43.214) 44.180 27.167 ( -1.689 -0.000 -9.522) 9.670 27.596 ( 1.220 0.000 3.099) 3.331 28.399 ( 0.149 0.000 -0.630) 0.648 ======================= Grid point 355 (167/300) ======================= q-point: (-0.09 -0.18 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.300 ( -14.649 -3.429 21.975) 26.631 1.421 ( -16.623 -6.229 19.038) 26.030 2.337 ( -23.522 2.682 24.180) 33.840 3.041 ( 0.139 -1.603 25.231) 25.283 3.057 ( -15.757 -13.612 10.776) 23.446 3.411 ( -3.870 -8.947 16.979) 19.578 4.370 ( -3.034 3.323 4.650) 6.470 4.669 ( -3.521 -6.295 4.805) 8.667 5.078 ( 2.196 6.767 -7.159) 10.093 5.592 ( 10.240 12.050 -13.445) 20.757 6.030 ( 2.307 -4.040 -8.844) 9.993 6.365 ( 3.863 1.191 -3.852) 5.584 6.478 ( 3.773 -0.502 5.698) 6.852 6.985 ( -6.445 -3.228 5.617) 9.138 7.103 ( 5.113 1.076 5.861) 7.852 7.697 ( 8.149 9.727 1.817) 12.819 7.778 ( 2.897 2.709 1.042) 4.101 8.423 ( 6.920 -11.641 -1.623) 13.639 8.872 ( -13.770 -2.052 -12.570) 18.756 9.426 ( -23.530 -1.682 -9.129) 25.294 9.958 ( -10.042 2.133 17.218) 20.046 10.797 ( 22.245 3.910 21.003) 30.842 11.013 ( 7.968 4.118 -2.686) 9.362 11.236 ( -2.158 7.191 3.949) 8.483 12.113 ( 1.658 -1.083 -3.717) 4.211 12.247 ( 9.098 4.587 -7.482) 12.641 12.953 ( 5.427 -0.425 -1.915) 5.771 13.102 ( -7.135 -1.351 -7.061) 10.129 13.430 ( -7.639 -3.169 -4.279) 9.311 13.458 ( -5.177 -2.912 0.516) 5.963 13.759 ( 6.646 0.881 4.143) 7.881 14.143 ( -0.917 0.251 2.628) 2.795 14.784 ( 1.956 -0.134 5.936) 6.251 16.523 ( -10.213 17.881 -24.812) 32.244 17.264 ( -2.640 -2.234 4.410) 5.604 18.432 ( -20.868 -16.295 -12.808) 29.412 19.595 ( -7.191 -3.252 3.057) 8.464 20.673 ( 6.121 1.296 -17.163) 18.268 25.183 ( 6.614 1.022 37.590) 38.181 26.323 ( -16.579 53.777 23.181) 60.862 28.022 ( 4.593 -15.817 -17.822) 24.267 28.469 ( -1.019 -8.058 -5.788) 9.974 ======================= Grid point 366 (168/300) ======================= q-point: (-0.09 -0.09 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.157 ( -20.577 -0.000 21.780) 29.963 1.381 ( -3.316 -0.000 30.145) 30.326 2.193 ( -30.823 -0.000 38.436) 49.268 2.819 ( -12.193 -0.000 2.262) 12.401 3.109 ( 1.390 0.000 28.992) 29.025 3.316 ( -3.189 -0.000 19.661) 19.918 4.389 ( -4.183 -0.000 5.666) 7.043 4.592 ( -1.989 -0.000 3.280) 3.836 5.158 ( 2.934 0.000 -6.026) 6.703 5.832 ( 4.005 0.000 -9.534) 10.342 5.889 ( 5.815 0.000 -16.388) 17.389 6.422 ( 2.818 0.000 -14.164) 14.441 6.500 ( 5.147 0.000 16.573) 17.354 6.933 ( -6.603 -0.000 7.937) 10.324 7.162 ( 5.807 0.000 5.658) 8.108 7.878 ( 3.554 0.000 5.138) 6.247 7.925 ( 21.698 0.000 -7.857) 23.077 8.231 ( -15.152 -0.000 -2.109) 15.298 8.701 ( -16.180 -0.000 -12.787) 20.623 9.222 ( -22.228 -0.000 -11.546) 25.048 9.954 ( -7.615 -0.000 23.394) 24.602 10.988 ( 14.596 0.000 6.388) 15.933 11.115 ( 8.214 0.000 -6.449) 10.443 11.454 ( 23.367 0.000 15.124) 27.834 12.023 ( -7.604 -0.000 -2.501) 8.004 12.348 ( 10.393 0.000 -8.406) 13.367 12.989 ( 6.455 0.000 -1.847) 6.714 13.031 ( -7.566 -0.000 -6.477) 9.960 13.341 ( -9.071 -0.000 -9.072) 12.829 13.379 ( -4.635 -0.000 3.122) 5.588 13.823 ( 4.625 0.000 6.619) 8.075 14.151 ( 0.352 0.000 4.828) 4.841 14.823 ( 3.341 0.000 5.980) 6.850 16.507 ( -33.497 -0.000 -30.903) 45.574 17.215 ( -2.192 -0.000 10.016) 10.253 18.046 ( -25.894 -0.000 1.773) 25.955 19.530 ( -4.711 -0.000 4.837) 6.752 20.710 ( 8.682 0.000 -16.790) 18.902 25.252 ( -3.613 -0.000 31.230) 31.438 27.131 ( 0.861 0.000 -7.664) 7.712 27.566 ( -6.310 -0.000 -2.505) 6.789 28.371 ( -2.984 -0.000 -3.029) 4.252 ======================= Grid point 367 (169/300) ======================= q-point: ( 0.00 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.510 ( -7.477 -0.000 22.438) 23.651 2.062 ( 6.480 0.000 21.556) 22.509 2.612 ( -11.442 -0.000 -1.124) 11.497 2.724 ( -8.877 -0.000 24.821) 26.361 3.828 ( -0.531 -0.000 28.774) 28.779 3.853 ( -2.694 -0.000 25.256) 25.399 4.479 ( -7.192 -0.000 9.199) 11.676 4.645 ( -0.521 -0.000 2.970) 3.016 5.021 ( 0.249 0.000 -6.976) 6.981 5.541 ( 3.829 0.000 -18.171) 18.570 5.586 ( 0.180 0.000 -11.599) 11.600 6.051 ( 4.818 0.000 -20.447) 21.007 6.927 ( -17.724 -0.000 11.763) 21.272 7.109 ( 9.570 0.000 19.424) 21.653 7.361 ( 4.833 0.000 3.189) 5.790 7.789 ( -30.792 -0.000 1.965) 30.855 8.015 ( 16.868 0.000 -3.692) 17.267 8.145 ( 14.398 0.000 -0.246) 14.400 8.506 ( 3.257 0.000 -3.790) 4.997 8.585 ( -15.224 -0.000 -16.208) 22.237 10.451 ( -5.092 -0.000 18.937) 19.610 11.085 ( 10.908 0.000 -7.448) 13.208 11.196 ( 2.226 0.000 11.274) 11.492 11.838 ( -9.721 -0.000 -1.897) 9.904 11.950 ( 16.154 0.000 -1.081) 16.190 12.236 ( 3.791 0.000 -10.531) 11.192 12.778 ( -4.876 -0.000 -4.796) 6.839 12.956 ( -9.059 -0.000 -4.571) 10.147 13.185 ( 22.139 0.000 -4.173) 22.529 13.292 ( -8.015 -0.000 -2.295) 8.337 14.090 ( 1.905 0.000 9.613) 9.800 14.292 ( 3.288 0.000 3.496) 4.799 14.982 ( -1.536 -0.000 7.153) 7.316 15.598 ( -27.061 -0.000 -10.055) 28.869 17.479 ( 2.207 0.000 11.582) 11.790 17.882 ( -12.105 -0.000 1.478) 12.195 19.648 ( -0.336 -0.000 8.188) 8.195 20.443 ( 9.061 0.000 -16.834) 19.117 25.835 ( -17.916 -0.000 32.782) 37.359 27.010 ( 8.194 0.000 -7.271) 10.955 27.440 ( -5.260 -0.000 2.762) 5.942 28.117 ( -6.980 -0.000 -11.947) 13.837 ======================= Grid point 368 (170/300) ======================= q-point: ( 0.09 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.567 ( -1.631 -4.232 20.571) 21.065 2.063 ( 5.008 8.877 29.993) 31.678 2.411 ( -0.718 6.012 -0.441) 6.071 2.908 ( -5.061 -10.941 11.372) 16.572 3.745 ( -4.113 6.502 27.016) 28.090 3.976 ( 1.844 -3.792 18.441) 18.917 4.416 ( -7.691 2.970 8.379) 11.755 4.666 ( -1.925 -0.952 2.894) 3.604 4.904 ( -1.575 7.601 -4.724) 9.087 5.398 ( 2.534 5.030 -13.790) 14.896 5.734 ( -0.787 -7.367 -11.623) 13.783 6.069 ( 4.722 -3.430 -18.412) 19.315 6.796 ( -19.497 1.213 10.950) 22.394 7.198 ( 12.762 2.314 19.278) 23.235 7.337 ( -2.887 4.598 5.460) 7.700 7.653 ( -13.951 -4.569 5.162) 15.562 8.045 ( 1.428 11.853 -5.600) 13.187 8.233 ( 3.493 -14.387 -2.723) 15.053 8.540 ( 0.814 -1.445 -13.365) 13.468 8.697 ( 7.471 -12.712 -1.307) 14.803 10.417 ( -4.220 3.179 18.165) 18.918 11.086 ( 6.425 4.623 -3.698) 8.736 11.290 ( 4.680 -3.883 8.892) 10.773 11.627 ( -5.102 12.086 5.153) 14.094 12.066 ( 5.426 0.042 -6.090) 8.157 12.172 ( -1.287 5.751 -11.807) 13.196 12.746 ( -0.717 -0.641 -4.621) 4.720 12.888 ( -4.615 0.454 -4.086) 6.181 13.232 ( -4.680 0.155 -4.101) 6.225 13.391 ( 22.371 -2.941 -4.977) 23.105 14.128 ( 2.947 -1.285 8.050) 8.668 14.284 ( -0.562 3.209 4.816) 5.815 14.842 ( -7.598 8.904 7.085) 13.683 15.506 ( -11.221 -5.725 -13.808) 18.691 17.497 ( 0.942 2.335 12.157) 12.415 17.867 ( -12.030 -6.331 -1.002) 13.630 19.669 ( 1.161 -0.133 8.035) 8.120 20.469 ( 9.937 1.040 -17.489) 20.141 25.708 ( -22.437 4.890 34.382) 41.346 26.785 ( 6.832 20.519 13.806) 25.658 27.589 ( 1.785 -10.529 -10.758) 15.158 28.039 ( -8.056 0.592 -14.182) 16.321 ======================= Grid point 369 (171/300) ======================= q-point: ( 0.18 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.614 ( -0.362 3.116 18.012) 18.284 2.071 ( 9.130 -3.141 27.364) 29.017 2.357 ( 6.994 4.367 -2.275) 8.554 3.021 ( -1.936 -2.581 2.640) 4.169 3.610 ( -3.978 9.751 10.051) 14.558 4.044 ( 6.092 3.410 5.308) 8.770 4.308 ( -7.242 2.556 6.514) 10.070 4.639 ( -0.532 2.087 0.353) 2.182 4.806 ( -4.050 -0.185 4.413) 5.992 5.394 ( 1.863 -4.886 -5.452) 7.554 5.765 ( -0.361 0.077 -8.751) 8.759 6.203 ( 3.356 -9.205 -12.628) 15.983 6.674 ( -16.276 -0.081 11.995) 20.219 7.196 ( -6.450 8.301 10.377) 14.771 7.275 ( 12.154 1.947 15.781) 20.013 7.706 ( -3.242 -4.032 3.588) 6.297 7.862 ( -3.188 3.102 -5.894) 7.384 8.510 ( 12.839 0.612 -16.241) 20.712 8.599 ( -9.023 -19.074 2.228) 21.218 8.989 ( 6.006 -12.964 1.416) 14.358 10.346 ( -2.391 5.176 18.995) 19.832 10.992 ( 0.870 8.704 -0.888) 8.793 11.354 ( 3.726 6.204 6.132) 9.485 11.427 ( -3.406 2.649 9.425) 10.366 11.923 ( -6.182 11.787 -8.050) 15.555 12.038 ( 0.620 6.552 -7.804) 10.209 12.799 ( 3.367 -3.251 -7.034) 8.449 12.884 ( 2.884 -2.917 -4.736) 6.266 13.175 ( -8.029 -0.211 -4.029) 8.985 13.578 ( 16.571 -2.378 -3.052) 17.016 14.120 ( -3.097 4.164 7.406) 9.044 14.307 ( 7.398 -4.788 1.488) 8.937 14.683 ( -5.075 4.671 2.477) 7.329 15.507 ( 6.361 1.259 -22.989) 23.887 17.424 ( -2.806 6.933 11.958) 14.105 17.907 ( -13.377 -7.494 -7.295) 16.979 19.689 ( 1.621 0.578 6.706) 6.923 20.497 ( 10.526 0.243 -16.167) 19.293 25.462 ( -24.101 9.587 39.082) 46.906 26.529 ( 7.595 16.004 26.527) 31.898 27.741 ( 7.362 -5.144 -17.980) 20.098 27.926 ( -8.013 2.403 -18.484) 20.289 ======================= Grid point 370 (172/300) ======================= q-point: ( 0.27 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.634 ( 4.738 -4.277 8.222) 10.409 2.296 ( 8.437 6.813 0.160) 10.845 2.345 ( 13.520 -9.888 16.964) 23.840 3.017 ( -1.235 0.995 -2.928) 3.330 3.352 ( 0.131 14.800 -11.609) 18.810 3.894 ( 5.771 16.533 -9.563) 19.953 4.252 ( -7.754 -0.374 2.284) 8.092 4.641 ( 4.825 0.198 1.555) 5.073 4.866 ( -4.328 -7.855 10.643) 13.918 5.558 ( 1.056 -10.829 1.697) 11.012 5.755 ( -1.222 -1.361 -2.905) 3.432 6.356 ( 1.859 -5.552 -6.320) 8.615 6.618 ( -12.387 -2.468 12.554) 17.808 6.987 ( -5.285 10.158 12.685) 17.088 7.362 ( 7.248 -1.359 12.940) 14.893 7.718 ( -0.317 -0.748 -7.459) 7.503 7.898 ( -1.666 -6.332 2.781) 7.114 8.467 ( 12.047 8.054 -10.899) 18.133 8.950 ( -6.072 -19.821 0.656) 20.741 9.283 ( 0.458 -16.175 1.426) 16.244 10.263 ( 0.537 6.092 18.964) 19.925 10.770 ( -2.726 13.341 3.428) 14.042 11.203 ( -4.113 9.857 2.296) 10.925 11.399 ( -0.155 2.793 4.313) 5.141 11.653 ( -7.901 8.585 -3.689) 12.237 11.870 ( 1.220 10.378 -8.152) 13.253 12.830 ( 4.527 0.437 -2.517) 5.198 13.029 ( 4.815 -7.582 -8.624) 12.452 13.149 ( -6.110 -3.638 0.685) 7.144 13.704 ( 8.500 -3.219 -5.165) 10.454 14.055 ( -3.814 1.534 5.705) 7.032 14.467 ( 10.828 -3.565 -2.993) 11.786 14.569 ( -2.670 4.855 -2.194) 5.960 15.478 ( 15.858 5.397 -23.346) 28.734 17.271 ( -3.750 7.379 8.398) 11.791 17.908 ( -12.980 -4.439 -15.078) 20.384 19.695 ( 0.968 0.682 5.299) 5.430 20.556 ( 10.197 -1.071 -13.443) 16.907 25.188 ( -21.161 9.370 44.238) 49.926 26.360 ( 4.709 12.736 29.007) 32.028 27.780 ( -6.048 3.116 -22.625) 23.626 27.844 ( 11.270 -2.331 -20.699) 23.683 ======================= Grid point 371 (173/300) ======================= q-point: ( 0.36 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.883 ( 8.508 -15.372 -4.186) 18.061 2.203 ( 6.854 7.663 -3.047) 10.723 2.662 ( 11.840 -9.603 9.346) 17.881 2.956 ( -0.496 4.233 -9.703) 10.598 3.093 ( 4.771 9.659 -17.867) 20.864 3.546 ( 7.416 20.834 -18.514) 28.842 4.189 ( -9.392 0.785 -3.185) 9.948 4.650 ( 1.553 2.072 2.700) 3.741 5.049 ( 0.522 -10.103 9.675) 13.998 5.736 ( 4.679 -0.860 0.163) 4.760 5.826 ( -7.400 -12.200 8.612) 16.666 6.366 ( -1.279 4.424 1.577) 4.868 6.628 ( -7.128 -3.778 13.198) 15.469 6.863 ( -3.007 1.183 10.152) 10.653 7.458 ( 0.602 -2.768 9.988) 10.382 7.733 ( 3.200 -1.104 -7.687) 8.400 8.024 ( -2.247 -7.832 -1.540) 8.292 8.362 ( 14.380 10.591 -9.444) 20.202 9.225 ( -6.427 -14.222 4.856) 16.345 9.562 ( -4.576 -11.972 4.173) 13.479 10.217 ( 4.351 3.328 13.660) 14.717 10.518 ( -0.961 11.264 3.417) 11.810 10.944 ( -8.049 10.680 0.062) 13.374 11.354 ( -2.211 2.288 3.552) 4.769 11.470 ( -8.390 5.434 -3.820) 10.701 11.668 ( 5.249 10.736 -9.263) 15.120 12.872 ( 4.484 -1.845 0.071) 4.849 13.129 ( -6.449 -5.921 -2.888) 9.219 13.240 ( 6.114 -4.220 0.795) 7.472 13.819 ( 6.113 -4.441 -10.606) 13.022 13.998 ( -3.243 3.106 3.354) 5.605 14.475 ( -3.220 1.320 -5.884) 6.836 14.535 ( 8.754 3.246 -6.787) 11.543 15.456 ( 14.616 5.725 -12.408) 20.009 17.182 ( 2.562 1.409 0.109) 2.926 17.843 ( -10.505 -1.526 -21.935) 24.368 19.706 ( -0.386 -0.872 5.147) 5.234 20.616 ( 8.261 -0.111 -11.048) 13.795 24.990 ( -16.711 5.431 46.662) 49.861 26.204 ( -0.302 10.956 28.493) 30.528 27.652 ( -2.059 2.356 -27.005) 27.186 27.936 ( 12.011 -2.348 -20.665) 24.017 ======================= Grid point 372 (174/300) ======================= q-point: ( 0.45 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.098 ( 3.379 6.826 -6.166) 9.800 2.202 ( 4.072 -10.759 -6.274) 13.103 2.762 ( -3.191 1.409 -14.466) 14.881 2.860 ( 0.173 3.608 -19.542) 19.873 3.113 ( 21.712 -5.323 0.512) 22.361 3.260 ( 6.839 9.123 -21.639) 24.459 4.084 ( -10.070 1.820 -5.653) 11.691 4.601 ( -0.512 3.722 3.583) 5.192 5.248 ( 2.742 -7.880 6.308) 10.460 5.687 ( -2.977 6.313 6.814) 9.755 6.041 ( -4.427 -11.598 9.416) 15.581 6.251 ( -0.515 5.977 5.540) 8.166 6.676 ( -3.053 -1.618 12.938) 13.391 6.899 ( -3.062 -4.130 9.361) 10.680 7.478 ( -3.896 0.512 2.535) 4.676 7.764 ( 3.167 0.362 -0.807) 3.288 8.059 ( 4.409 6.454 -10.845) 13.368 8.358 ( 6.268 -7.281 -8.048) 12.533 9.424 ( -6.587 -10.628 10.380) 16.251 9.620 ( -2.782 2.588 10.902) 11.545 10.126 ( 0.069 12.275 5.397) 13.409 10.470 ( 1.502 -4.133 3.776) 5.796 10.805 ( 0.165 -1.731 -1.451) 2.265 11.255 ( -8.874 4.982 -1.784) 10.332 11.324 ( -5.300 2.661 -3.421) 6.847 11.554 ( 9.604 5.935 -5.748) 12.669 12.947 ( 2.552 -2.740 0.849) 3.839 13.181 ( -6.184 -4.703 -0.421) 7.780 13.357 ( 5.930 -3.897 -0.496) 7.114 13.880 ( 3.061 0.226 -12.090) 12.474 13.913 ( -1.823 3.642 1.815) 4.459 14.417 ( -1.553 5.372 -8.905) 10.515 14.527 ( 7.381 -1.958 -8.163) 11.178 15.407 ( 3.996 5.309 -1.618) 6.839 17.242 ( 6.899 -2.635 -5.958) 9.489 17.790 ( -2.742 -4.553 -28.215) 28.711 19.738 ( -1.712 -2.136 5.377) 6.034 20.624 ( 5.165 2.715 -9.261) 10.947 24.922 ( -12.229 -0.716 46.814) 48.391 26.052 ( -4.992 8.217 27.761) 29.379 27.582 ( 2.040 -0.298 -29.532) 29.604 28.028 ( 9.681 -3.057 -20.317) 22.712 ======================= Grid point 373 (175/300) ======================= q-point: (-0.45 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.962 ( -2.201 7.047 -6.257) 9.678 2.259 ( -4.264 1.015 -4.593) 6.348 2.534 ( -3.503 11.217 -12.413) 17.093 2.970 ( 6.830 -8.707 -14.611) 18.329 3.220 ( 1.659 -5.082 -22.366) 22.996 3.449 ( 16.301 -15.379 -8.319) 23.905 3.976 ( -6.423 1.836 -5.339) 8.552 4.531 ( -0.734 3.897 5.270) 6.595 5.382 ( 2.778 -2.023 3.540) 4.934 5.515 ( -6.620 7.831 9.047) 13.675 6.104 ( -0.273 6.876 10.051) 12.181 6.264 ( -1.801 -8.387 4.715) 9.789 6.683 ( -1.968 0.893 13.203) 13.379 6.960 ( -3.827 -2.443 10.359) 11.310 7.410 ( -4.369 3.050 -3.106) 6.167 7.728 ( 1.377 5.890 3.575) 7.027 7.928 ( 5.013 6.039 -10.034) 12.739 8.596 ( -2.055 -15.582 -12.006) 19.778 9.436 ( 1.607 10.766 12.409) 16.507 9.660 ( -5.512 -9.442 14.001) 17.764 9.870 ( 2.790 14.894 0.036) 15.153 10.556 ( -4.999 -6.109 10.389) 13.048 10.989 ( 10.606 -8.746 -2.943) 14.059 11.097 ( -8.140 2.488 -8.226) 11.837 11.297 ( -0.563 -3.079 -1.274) 3.380 11.535 ( 7.106 2.019 -1.611) 7.561 12.994 ( 0.920 -0.894 -1.024) 1.641 13.211 ( -6.171 -3.144 -0.823) 6.974 13.469 ( 3.157 -4.137 -1.424) 5.395 13.799 ( 0.293 5.459 -2.896) 6.186 13.890 ( -0.360 -0.620 -6.826) 6.863 14.256 ( 3.210 9.278 -8.426) 12.938 14.640 ( 4.384 -5.010 -6.124) 9.046 15.333 ( -3.655 1.353 -1.706) 4.255 17.281 ( -0.631 -0.266 -5.462) 5.505 17.927 ( 10.320 -11.824 -32.057) 35.693 19.770 ( -2.458 -1.710 5.243) 6.038 20.560 ( 2.092 4.972 -8.031) 9.675 25.009 ( -8.435 -7.925 45.643) 47.087 25.934 ( -7.981 4.348 27.309) 28.782 27.588 ( 5.051 -2.930 -30.180) 30.739 28.115 ( 5.205 -4.274 -19.598) 20.723 ======================= Grid point 374 (176/300) ======================= q-point: (-0.36 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.800 ( -7.239 5.044 -2.590) 9.195 2.161 ( -6.208 4.747 1.603) 7.978 2.356 ( -6.776 1.985 -3.272) 7.782 3.087 ( 2.539 -3.243 -7.905) 8.913 3.382 ( 2.641 -12.603 -17.402) 21.648 3.779 ( -6.752 -10.598 -15.573) 20.011 4.001 ( 13.653 -9.768 -5.042) 17.528 4.466 ( -0.970 3.511 6.514) 7.463 5.239 ( -7.274 11.691 12.325) 18.479 5.484 ( 1.658 -0.401 -1.877) 2.536 5.952 ( -0.086 9.702 10.080) 13.991 6.387 ( 0.559 -3.125 -1.018) 3.334 6.681 ( 0.261 0.581 14.294) 14.308 6.979 ( -5.226 -2.057 10.278) 11.712 7.308 ( -3.917 3.600 -3.480) 6.357 7.613 ( 4.007 7.379 2.212) 8.683 7.883 ( -2.832 -0.318 -1.472) 3.208 8.802 ( -8.061 -11.397 -14.538) 20.155 9.208 ( 4.451 16.727 8.370) 19.226 9.608 ( 2.842 13.120 -1.717) 13.534 9.866 ( -3.105 -10.533 15.498) 18.994 10.695 ( -1.443 -8.837 13.001) 15.786 10.970 ( -4.757 1.767 -1.332) 5.247 11.187 ( 6.867 -1.780 -0.710) 7.129 11.463 ( 9.993 -10.629 -4.441) 15.250 11.594 ( 1.815 -6.378 -2.103) 6.956 12.996 ( -0.080 0.316 -3.288) 3.304 13.198 ( -6.631 -0.187 -1.762) 6.864 13.479 ( -4.061 3.840 -3.238) 6.459 13.741 ( 2.934 0.447 -6.059) 6.746 13.884 ( -0.901 0.383 0.652) 1.176 14.128 ( 5.585 5.679 -5.487) 9.672 14.722 ( 0.787 -2.799 -2.481) 3.822 15.337 ( -4.109 -6.242 -10.309) 12.733 17.270 ( -2.965 -1.594 -2.203) 4.023 18.184 ( 11.271 -11.167 -30.332) 34.231 19.781 ( -2.548 -0.349 4.973) 5.598 20.457 ( 0.295 4.926 -8.053) 9.445 25.252 ( -5.782 -15.130 43.316) 46.245 25.873 ( -9.252 0.774 27.328) 28.862 27.645 ( 6.380 -3.861 -28.934) 29.879 28.193 ( 0.400 -5.419 -18.790) 19.560 ======================= Grid point 375 (177/300) ======================= q-point: (-0.27 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.701 ( -9.966 -1.186 8.605) 13.220 2.004 ( -7.311 7.831 9.644) 14.415 2.338 ( -10.211 -5.553 3.105) 12.031 3.143 ( -2.562 -4.015 -1.415) 4.969 3.610 ( 0.514 -11.835 -11.178) 16.287 3.779 ( -3.326 0.480 -1.301) 3.603 4.375 ( 5.571 -10.994 -4.090) 12.986 4.430 ( 1.407 -6.712 -2.917) 7.452 4.995 ( -6.568 10.402 12.411) 17.475 5.432 ( 1.331 7.437 0.113) 7.556 5.837 ( 1.024 2.874 2.015) 3.657 6.358 ( 1.759 5.825 -7.870) 9.948 6.719 ( 5.421 0.264 13.641) 14.681 7.030 ( -6.219 -5.492 9.403) 12.540 7.224 ( -4.102 1.596 0.778) 4.470 7.559 ( 7.827 2.565 1.070) 8.306 7.869 ( -7.889 -1.568 5.659) 9.835 8.812 ( -10.754 1.035 -13.972) 17.662 8.949 ( 7.564 15.508 2.461) 17.429 9.379 ( -5.758 10.104 -5.173) 12.728 10.075 ( -1.699 -10.245 18.043) 20.819 10.879 ( 8.186 -3.898 10.984) 14.243 10.963 ( -8.124 -7.627 1.408) 11.232 11.218 ( 8.244 3.319 8.058) 11.996 11.727 ( 12.214 -9.766 -8.240) 17.676 11.801 ( 0.165 -13.709 -2.850) 14.004 12.980 ( -1.241 0.020 -4.089) 4.273 13.098 ( -6.583 5.409 -4.738) 9.748 13.336 ( -3.481 5.340 -6.749) 9.283 13.690 ( -8.743 3.563 -1.772) 9.606 13.902 ( 7.479 0.530 6.343) 9.821 14.110 ( 4.601 -0.241 -2.165) 5.091 14.772 ( -2.003 -3.738 -0.856) 4.326 15.465 ( -2.574 -12.175 -18.712) 22.472 17.304 ( -1.564 -3.558 2.654) 4.706 18.344 ( 3.899 -4.249 -24.235) 24.911 19.762 ( -3.520 1.126 5.375) 6.523 20.373 ( 1.392 2.557 -10.074) 10.486 25.633 ( -5.386 -22.087 38.260) 44.504 25.862 ( -8.308 -0.955 28.498) 29.700 27.706 ( 5.940 -2.647 -26.270) 27.063 28.251 ( -3.201 -4.845 -17.859) 18.779 ======================= Grid point 376 (178/300) ======================= q-point: (-0.18 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.727 ( -12.496 -4.337 16.132) 20.861 1.827 ( -5.403 5.588 22.347) 23.661 2.395 ( -10.629 -7.452 2.922) 13.306 3.174 ( -8.980 -1.463 3.397) 9.712 3.670 ( -5.629 1.486 11.150) 12.578 3.828 ( 4.720 -3.296 7.338) 9.327 4.412 ( -2.795 -3.702 5.109) 6.901 4.710 ( -1.846 -8.872 -8.727) 12.581 4.857 ( -1.923 0.358 6.677) 6.957 5.299 ( 5.559 5.390 -2.937) 8.282 5.840 ( 0.859 -1.171 -7.947) 8.078 6.201 ( 3.127 9.671 -13.632) 17.004 6.810 ( 9.121 -2.088 15.023) 17.699 7.061 ( -10.393 -2.106 8.389) 13.521 7.232 ( 0.816 -2.790 4.713) 5.538 7.636 ( 13.360 -2.613 -2.257) 13.799 7.851 ( -9.464 -2.204 8.855) 13.146 8.624 ( -8.598 7.941 -14.492) 18.627 8.712 ( 5.929 15.636 0.608) 16.733 9.120 ( -17.120 7.778 -7.726) 20.330 10.272 ( -2.207 -8.380 19.739) 21.557 10.951 ( 5.952 -0.415 -2.621) 6.517 11.140 ( 1.680 -5.736 10.164) 11.791 11.279 ( 7.974 -6.096 12.921) 16.362 11.962 ( 8.134 -7.957 -8.710) 14.329 12.017 ( 2.667 -8.127 -4.813) 9.815 12.919 ( -8.362 3.568 -7.965) 12.087 12.981 ( 0.609 0.562 -1.876) 2.050 13.222 ( -0.924 4.412 -8.311) 9.455 13.527 ( -10.859 4.804 -0.392) 11.881 13.963 ( 7.861 0.273 8.946) 11.912 14.176 ( 2.565 -3.313 2.578) 4.919 14.828 ( -3.284 -4.199 1.488) 5.535 15.658 ( -4.783 -13.722 -22.694) 26.948 17.376 ( 0.207 -3.349 6.877) 7.652 18.292 ( -6.506 5.151 -14.281) 16.516 19.708 ( -5.010 2.134 6.755) 8.677 20.357 ( 5.104 -0.417 -13.080) 14.046 25.866 ( -15.007 -3.790 29.194) 33.043 26.133 ( 2.362 -24.698 29.214) 38.327 27.720 ( 4.088 1.047 -22.529) 22.920 28.254 ( -5.503 -1.717 -15.792) 16.811 ======================= Grid point 377 (179/300) ======================= q-point: (-0.09 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.599 ( -11.663 5.404 19.487) 23.345 1.928 ( 0.194 -6.454 26.600) 27.373 2.484 ( -11.143 -10.323 5.299) 16.088 3.005 ( -13.307 11.406 8.030) 19.278 3.697 ( -2.664 -4.304 28.074) 28.527 3.884 ( 1.956 2.280 18.787) 19.026 4.476 ( -4.860 -3.378 7.700) 9.711 4.695 ( -3.262 3.183 1.816) 4.906 4.935 ( -0.890 -7.083 -3.805) 8.089 5.374 ( 7.532 -7.629 -14.093) 17.708 5.781 ( 0.300 7.873 -11.957) 14.319 6.066 ( 4.854 3.091 -18.867) 19.725 6.951 ( 5.143 -2.318 19.351) 20.157 7.033 ( -10.039 -2.331 9.547) 14.049 7.302 ( 4.324 -1.572 3.836) 5.991 7.804 ( 10.739 -3.941 -3.993) 12.116 7.888 ( -0.558 -6.780 4.218) 8.005 8.295 ( -11.424 15.485 -5.897) 20.126 8.547 ( 5.047 6.224 -4.863) 9.373 8.829 ( -19.823 7.212 -11.033) 23.805 10.409 ( -4.067 -4.595 20.433) 21.335 11.005 ( 7.466 -1.510 -6.180) 9.809 11.187 ( 4.969 2.336 9.669) 11.119 11.594 ( 6.956 -15.574 9.247) 19.402 12.022 ( 2.165 3.687 -5.365) 6.860 12.165 ( 6.785 -5.063 -9.724) 12.893 12.822 ( -6.844 -0.214 -6.185) 9.227 12.991 ( -3.666 -2.214 -1.745) 4.625 13.129 ( 7.311 5.017 -7.779) 11.796 13.385 ( -9.352 2.531 -1.478) 9.800 14.036 ( 5.906 -0.866 9.653) 11.349 14.251 ( 2.318 -1.731 4.416) 5.279 14.903 ( -3.631 -6.118 5.330) 8.890 15.755 ( -14.828 -5.867 -19.411) 25.121 17.440 ( 1.358 -1.145 9.818) 9.977 18.058 ( -13.467 8.120 -2.973) 16.004 19.656 ( -3.134 1.217 7.758) 8.455 20.398 ( 7.769 -1.192 -15.277) 17.180 25.870 ( -15.134 -2.343 31.377) 34.915 26.665 ( 3.496 -24.624 11.190) 27.273 27.619 ( 0.150 8.433 -14.041) 16.379 28.191 ( -6.614 0.502 -12.637) 14.272 ======================= Grid point 379 (180/300) ======================= q-point: ( 0.09 0.09 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.577 ( 6.121 0.000 22.673) 23.485 2.274 ( 11.772 0.000 24.231) 26.940 2.491 ( -4.349 -0.000 -3.312) 5.467 2.759 ( 1.001 0.000 25.013) 25.033 3.884 ( -5.172 -0.000 25.445) 25.965 3.914 ( -0.984 -0.000 26.745) 26.763 4.397 ( -8.622 -0.000 10.542) 13.619 4.660 ( 0.748 0.000 3.885) 3.956 4.977 ( -2.993 -0.000 -7.729) 8.288 5.517 ( -4.113 -0.000 -8.672) 9.598 5.521 ( 2.683 0.000 -19.755) 19.937 6.050 ( 4.992 0.000 -19.995) 20.609 6.687 ( -18.564 -0.000 9.658) 20.926 7.340 ( 7.931 0.000 19.349) 20.911 7.405 ( -0.448 -0.000 3.748) 3.774 7.439 ( -16.028 -0.000 5.323) 16.889 8.095 ( -16.278 -0.000 -4.107) 16.788 8.139 ( 3.135 0.000 -2.064) 3.753 8.539 ( 2.716 0.000 -1.707) 3.208 8.700 ( 32.417 0.000 -12.252) 34.656 10.439 ( -5.010 -0.000 15.984) 16.750 11.229 ( 12.753 0.000 -6.957) 14.527 11.243 ( -1.964 -0.000 13.818) 13.956 11.688 ( -9.991 -0.000 -2.207) 10.232 12.094 ( 5.627 0.000 -5.817) 8.093 12.185 ( -5.281 -0.000 -12.755) 13.805 12.740 ( 1.069 0.000 -1.608) 1.931 12.859 ( -2.290 -0.000 -2.774) 3.597 13.195 ( -3.732 -0.000 -4.962) 6.209 13.578 ( 34.885 0.000 -8.328) 35.866 14.110 ( -3.223 -0.000 7.741) 8.385 14.336 ( 1.358 0.000 1.555) 2.064 14.978 ( -2.827 -0.000 9.938) 10.332 15.203 ( -25.299 -0.000 1.141) 25.325 17.553 ( 1.923 0.000 13.151) 13.291 17.748 ( -7.172 -0.000 0.521) 7.191 19.702 ( 3.542 0.000 8.531) 9.237 20.520 ( 10.239 0.000 -19.056) 21.633 25.657 ( -22.921 -0.000 36.054) 42.724 27.126 ( 11.051 0.000 -4.584) 11.964 27.398 ( -3.379 -0.000 8.607) 9.247 27.966 ( -7.955 -0.000 -13.585) 15.742 ======================= Grid point 380 (181/300) ======================= q-point: ( 0.18 0.09 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.697 ( 8.991 -0.607 20.944) 22.800 2.248 ( 4.214 9.312 30.252) 31.932 2.470 ( 11.596 1.589 -3.861) 12.325 2.936 ( 2.379 -7.636 14.139) 16.244 3.766 ( -5.677 7.780 25.807) 27.546 4.062 ( 1.568 -5.850 17.205) 18.239 4.329 ( -8.186 3.104 9.938) 13.245 4.656 ( -1.470 1.363 3.054) 3.653 4.859 ( -2.364 6.413 -4.325) 8.089 5.355 ( -1.687 2.434 -12.581) 12.925 5.691 ( 0.700 -7.931 -11.830) 14.260 6.072 ( 4.424 -3.494 -17.634) 18.513 6.583 ( -14.681 0.102 9.705) 17.599 7.239 ( -12.164 3.370 4.979) 13.569 7.424 ( 5.430 -0.309 12.706) 13.821 7.568 ( 1.752 -7.185 11.360) 13.555 7.890 ( -14.333 5.932 -10.371) 18.660 8.250 ( -0.231 -10.219 2.989) 10.650 8.595 ( 6.768 -2.330 -5.915) 9.285 8.931 ( 24.780 -2.135 -4.896) 25.349 10.415 ( -4.293 1.778 16.118) 16.775 11.148 ( 1.532 6.870 3.673) 7.940 11.381 ( 4.840 -3.965 3.961) 7.405 11.536 ( -7.250 7.933 1.246) 10.819 12.039 ( -8.468 7.283 -11.897) 16.318 12.103 ( 0.041 1.426 -7.526) 7.660 12.764 ( 4.353 -1.577 -2.237) 5.142 12.863 ( 2.531 -1.348 -1.638) 3.302 13.149 ( -3.213 1.965 -6.097) 7.166 13.743 ( 25.002 4.775 -4.995) 25.939 14.189 ( 4.381 -4.124 1.215) 6.138 14.250 ( -6.737 4.301 3.646) 8.785 14.772 ( -4.231 7.594 9.810) 13.108 15.353 ( -5.372 -15.486 -7.527) 18.037 17.542 ( -0.854 4.635 13.245) 14.059 17.728 ( -6.611 -2.334 -0.639) 7.040 19.740 ( 4.686 0.702 7.527) 8.895 20.551 ( 10.116 0.677 -18.746) 21.312 25.503 ( -23.451 5.485 38.919) 45.769 26.941 ( 7.600 17.677 15.399) 24.644 27.600 ( 4.200 -11.854 -7.050) 14.418 27.873 ( -7.965 1.304 -15.249) 17.253 ======================= Grid point 381 (182/300) ======================= q-point: ( 0.27 0.09 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.715 ( 4.666 5.588 19.104) 20.443 2.322 ( 12.800 -5.520 21.112) 25.299 2.496 ( 13.544 5.632 0.465) 14.676 3.038 ( 2.323 0.314 5.045) 5.563 3.597 ( -2.370 11.144 8.744) 14.361 4.137 ( 5.020 4.842 2.438) 7.389 4.221 ( -7.806 3.091 5.767) 10.186 4.652 ( 1.268 -2.284 4.453) 5.163 4.757 ( -4.712 0.509 3.922) 6.152 5.379 ( -1.177 -7.153 -5.153) 8.894 5.743 ( 1.327 -0.124 -8.893) 8.992 6.208 ( 3.212 -9.480 -11.560) 15.291 6.517 ( -11.008 -1.132 10.397) 15.184 7.101 ( -10.012 4.903 7.145) 13.241 7.470 ( 4.487 2.834 12.289) 13.386 7.661 ( -5.253 -0.988 -3.141) 6.200 7.784 ( -0.801 -5.238 2.692) 5.944 8.512 ( -4.885 -18.257 2.770) 19.101 8.673 ( 14.087 0.912 -9.773) 17.169 9.103 ( 9.786 -4.437 1.212) 10.814 10.373 ( -2.733 3.108 17.850) 18.324 10.990 ( -2.340 10.920 3.349) 11.659 11.333 ( -8.305 7.603 5.297) 12.443 11.450 ( 4.170 1.364 1.182) 4.544 11.767 ( -10.591 10.946 -9.160) 17.773 12.019 ( -0.274 6.108 -7.196) 9.443 12.856 ( 7.185 -3.007 -2.847) 8.293 12.952 ( 7.404 -3.808 -3.126) 8.893 13.063 ( -5.058 0.616 -4.469) 6.778 13.774 ( 10.664 4.255 -0.624) 11.498 14.060 ( -7.822 3.012 5.566) 10.062 14.396 ( 2.876 -7.428 -5.223) 9.525 14.695 ( 7.573 5.172 4.981) 10.436 15.547 ( 9.034 -5.860 -20.467) 23.126 17.418 ( -2.976 8.614 11.362) 14.566 17.721 ( -9.247 -3.138 -3.833) 10.490 19.759 ( 5.148 2.226 4.636) 7.277 20.584 ( 9.105 -0.369 -15.922) 18.345 25.279 ( -21.549 8.255 43.276) 49.044 26.712 ( 5.322 15.766 24.912) 29.958 27.754 ( -5.323 2.275 -18.507) 19.391 27.803 ( 8.101 -6.636 -14.953) 18.255 ======================= Grid point 382 (183/300) ======================= q-point: ( 0.36 0.09 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.752 ( 7.346 -4.140 8.064) 11.668 2.431 ( 10.151 8.968 0.696) 13.563 2.608 ( 14.527 -7.785 13.129) 21.072 3.005 ( 0.298 4.008 1.017) 4.145 3.360 ( 6.778 14.038 -10.816) 18.974 3.937 ( 5.090 17.687 -11.051) 21.468 4.132 ( -9.255 1.110 -0.639) 9.343 4.677 ( -1.807 0.718 4.027) 4.472 4.875 ( 1.237 -10.836 9.582) 14.517 5.552 ( -3.157 -12.179 3.575) 13.080 5.742 ( 0.534 -0.885 -3.643) 3.787 6.359 ( 1.398 -4.778 -5.706) 7.573 6.515 ( -7.506 -3.917 11.435) 14.229 6.943 ( -5.721 6.272 9.372) 12.646 7.440 ( -2.421 0.750 5.754) 6.288 7.691 ( 0.698 -4.243 -6.554) 7.839 7.904 ( 0.885 -4.727 8.960) 10.169 8.659 ( 18.137 8.246 -7.978) 21.462 8.872 ( -5.119 -19.045 0.595) 19.730 9.280 ( -1.820 -11.882 2.397) 12.257 10.330 ( -0.266 3.378 17.860) 18.179 10.741 ( -3.869 13.009 4.436) 14.278 11.096 ( -10.394 11.627 -0.231) 15.597 11.414 ( 0.916 4.210 1.042) 4.433 11.514 ( -9.060 6.942 -3.743) 12.012 11.865 ( 1.995 8.712 -9.039) 12.712 12.900 ( 2.911 2.080 -2.986) 4.660 13.002 ( 0.466 -4.397 -0.778) 4.489 13.189 ( 8.030 -7.389 0.266) 10.916 13.775 ( 3.808 -0.847 -5.442) 6.696 14.012 ( -4.273 0.355 4.235) 6.026 14.448 ( -5.953 -0.664 -7.230) 9.389 14.685 ( 14.335 5.105 -0.779) 15.237 15.621 ( 12.321 2.701 -18.644) 22.510 17.276 ( 2.992 6.078 3.752) 7.745 17.692 ( -10.585 -2.396 -9.844) 14.653 19.750 ( 4.529 2.825 2.779) 6.017 20.635 ( 6.942 -1.272 -12.619) 14.459 25.067 ( -17.841 7.167 46.513) 50.330 26.495 ( 0.125 14.673 27.307) 31.000 27.640 ( -2.002 2.702 -22.734) 22.981 27.939 ( 11.421 -3.413 -17.934) 21.534 ======================= Grid point 383 (184/300) ======================= q-point: ( 0.45 0.09 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.987 ( 7.968 -12.840 -3.926) 15.613 2.311 ( 8.909 10.422 -0.699) 13.728 2.765 ( 2.210 1.474 -3.379) 4.298 2.901 ( -2.473 4.979 -7.693) 9.492 3.251 ( 21.396 3.750 -7.070) 22.844 3.584 ( 6.738 20.291 -19.005) 28.606 4.030 ( -10.598 1.391 -5.350) 11.953 4.643 ( -3.543 1.534 3.487) 5.202 5.109 ( 3.256 -10.102 7.784) 13.162 5.708 ( -9.577 -3.001 6.767) 12.104 5.813 ( 1.158 -9.511 4.843) 10.736 6.353 ( -1.096 3.948 1.301) 4.299 6.598 ( -3.148 -6.103 12.617) 14.365 6.868 ( -0.472 0.791 7.647) 7.702 7.437 ( -5.297 -1.647 2.280) 5.997 7.775 ( 4.159 -3.306 -4.906) 7.232 7.995 ( -1.910 -4.471 4.053) 6.329 8.560 ( 17.335 13.392 -9.935) 24.053 9.153 ( -6.209 -14.725 5.908) 17.037 9.510 ( -4.763 -12.604 4.608) 14.240 10.300 ( 1.247 4.493 12.145) 13.009 10.512 ( -2.583 8.133 3.811) 9.346 10.826 ( -7.738 7.021 -0.422) 10.458 11.297 ( -7.918 6.334 -0.032) 10.140 11.356 ( -3.079 4.723 -2.175) 6.043 11.726 ( 6.233 6.936 -9.576) 13.367 12.893 ( -2.343 -2.176 -3.711) 4.898 13.105 ( 4.736 -3.335 4.844) 7.551 13.343 ( 6.710 -3.072 2.581) 7.818 13.845 ( 3.091 -4.245 -11.933) 13.038 13.962 ( -2.803 2.909 1.458) 4.295 14.378 ( -6.326 0.197 -8.340) 10.469 14.670 ( 12.809 6.220 -6.363) 15.596 15.550 ( 1.816 7.607 -6.162) 9.956 17.278 ( 12.197 0.565 -5.654) 13.455 17.644 ( -6.377 -3.041 -18.282) 19.599 19.741 ( 3.141 1.335 3.417) 4.830 20.667 ( 3.870 0.253 -10.542) 11.233 24.935 ( -13.888 3.277 47.408) 49.509 26.264 ( -5.275 12.856 27.738) 31.024 27.558 ( 2.472 1.458 -26.566) 26.720 28.031 ( 10.926 -1.422 -19.402) 22.312 ======================= Grid point 384 (185/300) ======================= q-point: (-0.45 0.09 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.132 ( 4.266 8.267 -6.889) 11.576 2.240 ( 3.957 -1.118 -2.604) 4.868 2.679 ( -2.192 5.762 -12.682) 14.101 2.800 ( 1.552 -3.110 -19.234) 19.545 3.272 ( 5.619 12.378 -22.581) 26.357 3.412 ( 18.376 -2.911 -3.978) 19.026 3.942 ( -5.471 -0.245 -4.331) 6.982 4.586 ( -3.184 2.500 3.219) 5.172 5.310 ( 3.177 -7.578 4.965) 9.601 5.612 ( -10.809 5.619 8.705) 14.973 6.028 ( -2.312 -11.277 9.894) 15.179 6.264 ( -0.211 5.027 4.792) 6.948 6.683 ( -2.539 -1.842 13.542) 13.900 6.913 ( 0.907 -2.885 8.522) 9.042 7.410 ( -5.126 0.756 -0.823) 5.246 7.813 ( 3.233 2.443 0.197) 4.056 8.059 ( -0.198 -1.820 -7.862) 8.073 8.429 ( 7.830 5.404 -9.536) 13.470 9.378 ( -5.199 -12.598 11.194) 17.636 9.632 ( -0.755 -0.558 10.165) 10.209 10.155 ( 1.727 12.412 4.237) 13.229 10.429 ( -8.929 -1.561 5.509) 10.607 10.839 ( 4.772 -9.568 -3.746) 11.329 11.120 ( -8.200 5.021 -2.067) 9.835 11.264 ( -1.688 2.874 -0.702) 3.406 11.662 ( 7.866 4.167 -6.549) 11.051 12.920 ( -4.797 -3.578 -3.760) 7.068 13.189 ( 5.537 -0.399 5.540) 7.843 13.430 ( 3.662 -2.473 1.271) 4.598 13.875 ( 2.015 0.571 -12.183) 12.362 13.882 ( -2.260 3.612 -1.325) 4.462 14.345 ( -2.891 -0.392 -8.941) 9.405 14.646 ( 12.084 2.953 -8.458) 15.043 15.375 ( -7.792 7.144 -0.250) 10.574 17.300 ( 2.633 2.903 -5.559) 6.802 17.740 ( 10.703 -10.336 -28.367) 32.033 19.756 ( 1.676 -0.092 4.963) 5.239 20.635 ( 0.893 3.159 -9.447) 10.001 24.921 ( -10.814 -2.558 46.663) 47.968 26.054 ( -8.252 9.188 27.939) 30.547 27.535 ( 6.066 -1.038 -29.259) 29.900 28.081 ( 7.359 -0.703 -20.205) 21.515 ======================= Grid point 385 (186/300) ======================= q-point: (-0.36 0.09 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.929 ( 0.721 11.942 -6.692) 13.709 2.216 ( 0.301 3.481 -1.004) 3.636 2.441 ( -3.783 11.018 -11.717) 16.522 3.016 ( 7.369 -10.147 -16.852) 21.006 3.153 ( 0.374 -4.242 -22.913) 23.306 3.535 ( -0.959 -5.446 -14.095) 15.141 3.992 ( 11.352 -3.544 0.061) 11.892 4.522 ( -2.845 2.700 4.111) 5.682 5.399 ( -8.101 8.479 10.542) 15.769 5.456 ( 0.578 -3.258 1.929) 3.830 6.135 ( -0.160 6.871 8.970) 11.300 6.251 ( -2.761 -9.052 6.561) 11.515 6.698 ( -2.797 -0.140 13.829) 14.110 6.962 ( -1.384 0.058 11.766) 11.848 7.341 ( -3.437 2.924 -2.718) 5.268 7.745 ( -0.006 5.301 2.074) 5.692 7.987 ( 7.686 8.340 -10.626) 15.542 8.492 ( -6.531 -10.860 -11.259) 16.952 9.506 ( 2.272 7.910 11.029) 13.761 9.644 ( -4.363 -8.659 15.211) 18.038 9.929 ( 5.663 14.221 -0.900) 15.333 10.480 ( -10.147 -9.990 9.189) 16.947 10.993 ( -2.815 1.971 -5.346) 6.355 11.128 ( 9.860 -10.716 -3.072) 14.882 11.255 ( -3.437 -6.109 -0.120) 7.011 11.647 ( 7.850 2.675 -2.518) 8.667 12.932 ( -6.116 -2.520 -4.865) 8.211 13.210 ( 3.519 2.244 2.529) 4.880 13.485 ( -0.422 -1.122 -0.354) 1.250 13.779 ( -1.593 4.497 -7.604) 8.977 13.878 ( 2.876 -1.263 -3.948) 5.045 14.279 ( 4.247 5.805 -7.650) 10.500 14.699 ( 5.854 -1.129 -5.755) 8.286 15.223 ( -9.028 0.689 -5.777) 10.740 17.240 ( -2.341 1.378 -3.325) 4.294 18.003 ( 14.391 -11.742 -31.070) 36.198 19.776 ( 0.279 -0.026 6.281) 6.287 20.539 ( -0.467 5.035 -9.354) 10.634 25.039 ( -9.832 -9.308 45.258) 47.239 25.914 ( -7.952 4.557 28.064) 29.523 27.578 ( 8.482 -3.235 -30.199) 31.534 28.098 ( 2.095 -1.566 -20.379) 20.546 ======================= Grid point 386 (187/300) ======================= q-point: (-0.27 0.09 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.717 ( -2.923 8.229 -1.870) 8.931 2.130 ( 0.665 6.428 4.290) 7.756 2.256 ( -5.319 3.109 -3.648) 7.160 3.071 ( 0.457 -1.991 -11.637) 11.815 3.366 ( 2.908 -12.267 -17.021) 21.182 3.619 ( -6.893 -11.132 -16.263) 20.879 4.203 ( 15.683 -8.076 -3.304) 17.947 4.456 ( -3.270 2.960 4.937) 6.620 5.164 ( -9.185 10.587 13.363) 19.365 5.515 ( 3.653 0.235 -1.870) 4.110 5.971 ( -1.976 9.706 8.309) 12.928 6.386 ( -0.299 -3.556 -0.000) 3.568 6.730 ( -1.581 -3.313 16.601) 17.002 6.946 ( -5.091 0.620 12.869) 13.854 7.248 ( -2.520 4.063 -1.021) 4.889 7.662 ( 2.413 3.691 0.431) 4.431 7.888 ( 4.768 5.350 -3.772) 8.099 8.605 ( -11.921 -9.234 -13.706) 20.377 9.294 ( 3.238 15.326 6.444) 16.938 9.631 ( 0.884 15.316 -0.524) 15.350 9.901 ( 0.300 -10.068 15.386) 18.390 10.662 ( -8.078 -13.533 10.111) 18.725 10.962 ( 3.864 0.725 0.011) 3.932 11.271 ( 3.771 -3.240 2.001) 5.359 11.512 ( 1.965 -16.601 -4.558) 17.327 11.680 ( 8.037 -1.686 -2.095) 8.475 12.914 ( -6.269 -1.547 -6.673) 9.286 13.162 ( -0.686 4.494 -1.285) 4.724 13.431 ( -1.406 5.171 -1.867) 5.675 13.688 ( -3.303 2.755 -7.787) 8.896 13.942 ( 5.232 -2.049 3.465) 6.601 14.199 ( 7.608 5.299 -5.954) 11.018 14.712 ( -1.992 -0.440 -2.015) 2.867 15.235 ( -2.324 -7.769 -16.449) 18.339 17.231 ( -2.286 -2.562 1.100) 3.605 18.223 ( 7.989 -7.886 -28.959) 31.059 19.773 ( -2.169 1.176 7.354) 7.757 20.432 ( 1.520 4.293 -10.819) 11.738 25.274 ( -12.692 -15.596 42.985) 47.455 25.874 ( -3.753 0.316 28.795) 29.040 27.656 ( 9.458 -3.293 -29.007) 30.688 28.107 ( -2.895 -3.593 -20.172) 20.693 ======================= Grid point 387 (188/300) ======================= q-point: (-0.18 0.09 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.605 ( -7.213 -0.051 9.034) 11.560 1.998 ( 0.449 9.697 15.648) 18.415 2.239 ( -4.056 -4.434 -0.895) 6.076 3.095 ( -2.652 -2.223 -2.994) 4.576 3.535 ( -4.348 -9.970 -13.098) 17.025 3.785 ( 3.868 -7.989 -2.453) 9.209 4.388 ( -3.773 1.931 5.790) 7.176 4.473 ( 7.364 -11.949 -8.727) 16.528 4.947 ( -6.373 8.348 12.764) 16.530 5.467 ( 3.429 7.334 -0.055) 8.096 5.835 ( -1.780 3.083 -0.042) 3.561 6.353 ( 1.554 5.960 -7.566) 9.756 6.859 ( 5.698 -4.339 18.510) 19.847 6.927 ( -12.999 -2.835 12.495) 18.252 7.184 ( -1.600 -0.026 2.812) 3.235 7.667 ( 6.778 -1.017 -2.317) 7.235 7.831 ( 0.507 3.025 4.148) 5.159 8.601 ( -10.805 -1.838 -15.641) 19.099 9.039 ( 2.865 15.376 2.717) 15.875 9.290 ( -3.905 18.552 -3.580) 19.294 10.125 ( -0.527 -9.869 19.206) 21.600 10.865 ( -6.274 -11.045 3.134) 13.084 11.039 ( 9.133 -4.228 7.986) 12.848 11.339 ( 4.343 0.008 7.646) 8.793 11.782 ( -0.136 -12.440 -4.086) 13.095 11.852 ( 6.977 -10.463 -6.679) 14.240 12.885 ( -5.519 -0.959 -7.763) 9.573 13.024 ( -3.095 7.053 -6.413) 10.023 13.329 ( 2.019 4.891 -1.547) 5.512 13.563 ( -5.076 6.165 -4.278) 9.060 14.019 ( 4.430 -1.184 7.840) 9.082 14.182 ( 7.346 1.459 -2.435) 7.876 14.723 ( -4.552 -3.668 -1.589) 6.059 15.381 ( 1.828 -10.797 -22.906) 25.389 17.301 ( -1.360 -5.212 6.002) 8.065 18.281 ( -1.905 -0.061 -22.146) 22.228 19.726 ( -4.872 2.201 8.060) 9.672 20.383 ( 6.180 1.480 -13.286) 14.728 25.542 ( -21.404 -16.545 37.419) 46.174 25.978 ( 5.630 -6.673 31.529) 32.716 27.717 ( 8.441 -1.130 -25.826) 27.194 28.119 ( -6.032 -4.347 -19.604) 20.966 ======================= Grid point 388 (189/300) ======================= q-point: (-0.09 0.09 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.619 ( -8.856 -1.981 16.580) 18.901 1.895 ( 2.177 2.596 27.339) 27.548 2.317 ( -0.939 -5.169 -0.695) 5.300 3.072 ( -6.136 2.488 1.885) 6.885 3.636 ( -4.781 -5.267 10.980) 13.083 3.934 ( 6.161 -2.904 7.399) 10.056 4.375 ( -5.062 -3.270 5.582) 8.214 4.662 ( -1.714 -5.374 -3.902) 6.859 4.840 ( -3.219 0.234 5.497) 6.375 5.363 ( 4.865 3.812 -5.043) 7.977 5.808 ( -1.043 -0.440 -8.455) 8.530 6.200 ( 3.316 9.256 -13.325) 16.560 6.877 ( -16.987 -1.756 12.337) 21.068 7.027 ( 10.989 -3.218 18.425) 21.693 7.245 ( -2.049 -5.647 5.684) 8.270 7.745 ( -2.781 -0.916 2.091) 3.598 7.831 ( 7.358 -4.060 0.580) 8.424 8.485 ( -1.132 6.924 -18.229) 19.533 8.732 ( -7.043 15.414 1.376) 17.003 8.940 ( -1.923 14.593 -2.738) 14.971 10.310 ( -2.123 -7.049 19.860) 21.181 10.982 ( 1.743 -4.621 -4.215) 6.493 11.246 ( 6.201 -5.513 11.230) 13.963 11.403 ( 2.639 -5.763 11.164) 12.838 11.982 ( 0.393 -8.835 -6.153) 10.774 12.052 ( 2.862 -8.083 -8.887) 12.350 12.812 ( -2.042 3.944 -8.542) 9.627 12.917 ( -4.376 -0.122 -5.445) 6.986 13.269 ( 1.916 2.861 -2.251) 4.114 13.412 ( 1.699 6.457 -4.468) 8.034 14.083 ( 4.078 -0.985 9.139) 10.056 14.225 ( 3.260 -1.420 3.101) 4.718 14.764 ( -6.206 -4.772 1.508) 7.972 15.540 ( 0.210 -7.882 -23.843) 25.113 17.408 ( -0.313 -4.870 9.822) 10.967 18.121 ( -11.470 8.065 -10.794) 17.695 19.674 ( -2.958 1.319 7.938) 8.573 20.410 ( 9.109 -0.742 -15.483) 17.980 25.679 ( -23.617 -9.572 33.527) 42.113 26.323 ( 7.834 -17.910 28.342) 34.430 27.714 ( 5.838 3.072 -21.078) 22.086 28.101 ( -7.685 -2.157 -17.319) 19.070 ======================= Grid point 391 (190/300) ======================= q-point: ( 0.18 0.18 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.818 ( 15.640 0.000 21.983) 26.979 2.396 ( -5.720 -0.000 13.420) 14.588 2.609 ( 20.526 0.000 8.956) 22.395 2.901 ( 6.502 0.000 23.277) 24.168 3.889 ( -5.952 -0.000 25.159) 25.853 3.981 ( -1.709 -0.000 23.503) 23.565 4.330 ( -5.734 -0.000 12.484) 13.738 4.683 ( -0.196 -0.000 4.982) 4.986 4.882 ( -6.183 -0.000 -8.656) 10.637 5.442 ( -2.120 -0.000 -5.417) 5.817 5.485 ( 2.381 0.000 -21.125) 21.258 6.053 ( 5.044 0.000 -19.539) 20.180 6.505 ( -11.541 -0.000 8.645) 14.420 7.165 ( -16.987 -0.000 5.145) 17.749 7.371 ( -6.026 -0.000 2.984) 6.724 7.626 ( 13.710 0.000 16.085) 21.135 7.803 ( -18.147 -0.000 -8.481) 20.031 8.194 ( 2.599 0.000 1.657) 3.082 8.581 ( 3.298 0.000 3.384) 4.726 9.140 ( 32.884 0.000 -10.331) 34.469 10.421 ( -4.807 -0.000 14.127) 14.923 11.233 ( -6.227 -0.000 14.581) 15.855 11.369 ( 5.593 0.000 -2.217) 6.016 11.577 ( 0.279 0.000 -7.106) 7.112 12.016 ( -11.342 -0.000 -14.195) 18.170 12.082 ( -3.603 -0.000 -6.261) 7.224 12.784 ( 4.655 0.000 1.425) 4.868 12.873 ( 4.584 0.000 0.053) 4.584 13.152 ( 0.031 0.000 -6.087) 6.087 14.018 ( 23.475 0.000 -9.368) 25.275 14.060 ( -6.453 -0.000 5.002) 8.165 14.358 ( 8.141 0.000 -11.812) 14.345 14.936 ( -12.903 -0.000 11.427) 17.236 14.975 ( -3.603 -0.000 14.494) 14.935 17.619 ( 0.627 0.000 14.106) 14.120 17.691 ( -0.426 -0.000 -1.181) 1.255 19.797 ( 5.271 0.000 8.475) 9.980 20.595 ( 9.733 0.000 -20.405) 22.608 25.461 ( -22.447 -0.000 39.895) 45.776 27.286 ( 13.097 0.000 -3.381) 13.526 27.403 ( -1.363 -0.000 13.393) 13.462 27.806 ( -7.569 -0.000 -14.090) 15.994 ======================= Grid point 392 (191/300) ======================= q-point: ( 0.27 0.18 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.920 ( 10.175 5.966 21.576) 24.589 2.365 ( 2.981 -0.779 14.472) 14.797 2.718 ( 19.761 4.921 9.509) 22.475 3.054 ( 6.379 -3.820 14.481) 16.279 3.766 ( -6.367 8.372 24.555) 26.713 4.138 ( 1.571 -7.210 13.555) 15.433 4.278 ( -3.414 4.326 11.180) 12.464 4.625 ( -4.498 2.281 1.909) 5.392 4.823 ( -0.844 3.424 -1.009) 3.668 5.281 ( -2.130 1.868 -12.486) 12.803 5.674 ( 2.620 -8.496 -11.632) 14.641 6.072 ( 3.734 -3.441 -16.302) 17.074 6.455 ( -7.709 -0.459 8.124) 11.209 7.066 ( -13.772 -0.125 4.625) 14.529 7.393 ( -8.107 -6.759 3.145) 11.013 7.644 ( -14.024 2.526 -8.749) 16.721 7.760 ( 11.259 -1.877 14.277) 18.279 8.259 ( -0.154 -6.450 2.455) 6.904 8.667 ( 4.720 -4.738 3.650) 7.619 9.283 ( 26.413 6.060 -7.712) 28.176 10.408 ( -4.149 0.560 14.862) 15.441 11.139 ( -5.743 6.686 8.725) 12.402 11.361 ( -9.706 1.728 5.524) 11.300 11.555 ( 11.255 4.364 -7.005) 13.956 11.839 ( -12.297 6.784 -13.643) 19.580 12.048 ( -4.252 -0.068 -6.892) 8.098 12.846 ( 7.254 -2.560 0.927) 7.748 12.935 ( 7.106 -2.455 0.614) 7.543 13.102 ( -0.463 4.501 -6.041) 7.548 13.945 ( 3.267 4.244 2.616) 5.960 14.110 ( -13.347 6.846 1.473) 15.073 14.289 ( 9.256 -0.050 -8.364) 12.475 14.862 ( 13.936 3.092 7.521) 16.135 15.288 ( -1.527 -20.492 -3.168) 20.792 17.576 ( 0.315 6.647 11.543) 13.324 17.682 ( -0.021 1.700 0.432) 1.754 19.841 ( 5.536 0.975 6.739) 8.775 20.618 ( 8.439 0.543 -19.273) 21.047 25.329 ( -20.549 4.931 42.492) 47.457 27.091 ( 5.275 16.614 15.438) 23.284 27.660 ( 6.887 -11.972 -5.382) 14.823 27.722 ( -5.123 1.060 -13.745) 14.707 ======================= Grid point 393 (192/300) ======================= q-point: ( 0.36 0.18 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.853 ( 4.894 6.734 18.314) 20.117 2.525 ( 8.567 -5.666 8.374) 13.252 2.753 ( 18.619 6.950 9.068) 21.845 3.114 ( 4.369 3.596 9.937) 11.435 3.601 ( -1.425 9.128 8.236) 12.377 4.132 ( -5.320 6.170 0.535) 8.165 4.207 ( 3.917 7.346 0.272) 8.330 4.691 ( -3.266 -8.729 9.919) 13.611 4.719 ( 1.632 3.819 2.903) 5.067 5.331 ( -2.868 -9.134 -4.986) 10.795 5.729 ( 0.322 0.102 -8.131) 8.138 6.214 ( 2.977 -9.826 -10.014) 14.342 6.443 ( -3.647 -1.281 8.133) 9.005 6.977 ( -10.374 1.598 6.529) 12.361 7.436 ( -9.291 -0.279 -0.806) 9.330 7.558 ( -5.475 -5.670 -5.832) 9.805 7.894 ( 7.820 -2.267 14.319) 16.472 8.468 ( -2.955 -16.593 2.550) 17.046 8.809 ( 7.477 -4.862 0.076) 8.919 9.277 ( 14.999 8.252 -3.849) 17.547 10.393 ( -2.877 1.381 16.766) 17.067 10.938 ( -7.309 10.884 5.896) 14.375 11.203 ( -11.621 7.683 2.851) 14.220 11.528 ( 6.170 5.361 -2.410) 8.522 11.586 ( -9.037 8.220 -9.716) 15.609 11.975 ( -1.996 4.266 -7.834) 9.141 12.968 ( 0.257 3.272 -2.617) 4.198 12.978 ( 6.950 -0.620 -1.395) 7.116 13.089 ( 8.918 -8.163 0.239) 12.092 13.854 ( -0.487 7.721 0.809) 7.779 13.968 ( -5.644 -1.741 4.689) 7.542 14.346 ( -5.117 -3.559 -6.484) 8.994 14.908 ( 17.360 5.858 2.932) 18.555 15.593 ( 5.618 -10.274 -16.907) 20.566 17.452 ( 4.262 8.339 6.647) 11.484 17.629 ( -2.546 2.636 -0.726) 3.736 19.854 ( 5.911 2.924 3.256) 7.354 20.636 ( 5.669 -0.444 -15.752) 16.747 25.156 ( -17.430 6.835 45.761) 49.443 26.831 ( -0.593 16.626 20.976) 26.772 27.643 ( -0.613 2.007 -16.004) 16.142 27.890 ( 10.229 -7.411 -12.106) 17.496 ======================= Grid point 394 (193/300) ======================= q-point: ( 0.45 0.18 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.883 ( 6.995 -3.565 7.038) 10.543 2.573 ( 8.128 8.010 4.222) 12.167 2.801 ( 8.767 0.878 -0.004) 8.811 3.031 ( 0.145 9.018 9.432) 13.050 3.485 ( 15.138 6.176 -6.051) 17.433 3.921 ( -5.095 12.027 -9.092) 15.915 4.034 ( 0.797 10.299 -7.342) 12.673 4.627 ( -6.712 0.806 4.647) 8.204 4.955 ( 4.871 -11.130 8.745) 14.969 5.502 ( -5.691 -10.664 5.426) 13.249 5.724 ( -1.970 -2.456 -2.740) 4.174 6.355 ( 0.826 -3.634 -4.904) 6.159 6.495 ( -0.716 -4.554 10.032) 11.041 6.902 ( -3.561 1.420 7.156) 8.118 7.371 ( -6.073 -0.701 -2.391) 6.564 7.655 ( -3.795 -7.496 -5.086) 9.821 7.992 ( 4.992 -0.434 13.844) 14.723 8.801 ( -4.639 -19.305 3.353) 20.136 8.903 ( 17.822 6.497 -7.673) 20.463 9.254 ( -2.344 -4.998 1.514) 5.724 10.379 ( -0.958 1.597 16.013) 16.121 10.681 ( -7.165 11.395 5.648) 14.597 10.932 ( -11.566 10.886 -1.608) 15.964 11.367 ( -8.055 6.953 -2.107) 10.848 11.459 ( 3.928 6.535 -2.587) 8.051 11.854 ( 0.903 5.801 -9.781) 11.408 12.863 ( -2.472 2.185 -3.017) 4.471 13.108 ( 9.365 -3.189 3.691) 10.559 13.316 ( 8.880 -7.121 1.967) 11.551 13.776 ( -0.495 -0.675 -5.754) 5.815 13.972 ( -3.059 -0.139 3.426) 4.595 14.317 ( -8.408 -0.218 -8.129) 11.697 14.894 ( 15.443 7.810 -2.511) 17.487 15.649 ( -1.390 3.107 -11.682) 12.168 17.414 ( 16.999 3.171 -6.078) 18.330 17.553 ( -5.585 1.533 -4.176) 7.140 19.833 ( 5.789 3.872 1.811) 7.196 20.656 ( 2.028 -1.119 -12.582) 12.793 25.004 ( -13.974 5.672 47.556) 49.890 26.537 ( -6.777 15.833 23.324) 28.993 27.582 ( 4.275 2.629 -19.340) 19.981 28.040 ( 11.091 -3.140 -16.320) 19.980 ======================= Grid point 395 (194/300) ======================= q-point: ( 0.55 0.18 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.076 ( 6.214 -9.564 -4.112) 12.124 2.445 ( 9.572 11.569 2.431) 15.211 2.755 ( 0.403 6.505 -9.690) 11.678 2.839 ( -3.392 8.184 -4.510) 9.941 3.550 ( 18.985 4.529 -7.855) 21.039 3.597 ( 5.417 17.894 -17.784) 25.803 3.883 ( -5.161 0.239 -4.394) 6.782 4.582 ( -6.476 0.146 2.822) 7.066 5.186 ( 3.891 -8.959 6.606) 11.792 5.578 ( -11.938 -1.809 8.962) 15.036 5.831 ( -1.131 -9.711 5.983) 11.462 6.346 ( -0.384 2.931 0.507) 2.999 6.618 ( -0.910 -5.679 12.664) 13.909 6.910 ( 3.409 -0.850 5.710) 6.704 7.361 ( -4.781 -1.833 -1.542) 5.348 7.765 ( -2.719 -8.084 -7.986) 11.684 8.017 ( 1.376 2.395 10.148) 10.517 8.759 ( 14.919 17.244 -11.221) 25.413 9.093 ( -5.149 -15.151 7.597) 17.714 9.464 ( -3.658 -15.509 4.294) 16.503 10.346 ( 0.288 5.732 9.733) 11.299 10.448 ( -8.609 8.507 4.878) 13.049 10.743 ( -3.549 -0.086 0.218) 3.557 11.173 ( -7.673 7.229 -1.956) 10.722 11.357 ( 2.717 6.102 -0.732) 6.719 11.759 ( 2.996 3.870 -10.307) 11.410 12.839 ( -2.014 -1.277 -1.886) 3.040 13.234 ( 8.423 -2.223 6.002) 10.579 13.440 ( 5.365 -0.479 4.175) 6.814 13.825 ( 0.113 -3.997 -12.093) 12.736 13.935 ( -1.237 2.496 -0.065) 2.786 14.250 ( -6.814 -1.927 -9.889) 12.162 14.841 ( 13.915 7.818 -6.347) 17.177 15.464 ( -10.646 8.979 -2.774) 14.201 17.409 ( 3.427 6.686 -4.795) 8.913 17.611 ( 15.206 -7.789 -21.214) 27.239 19.812 ( 4.939 2.677 3.459) 6.598 20.649 ( -1.145 0.348 -11.099) 11.163 24.922 ( -11.248 2.180 47.386) 48.752 26.244 ( -10.164 12.971 25.495) 30.357 27.544 ( 7.605 1.714 -23.497) 24.756 28.107 ( 9.088 0.353 -19.257) 21.297 ======================= Grid point 396 (195/300) ======================= q-point: (-0.36 0.18 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.153 ( 1.864 7.018 -7.240) 10.254 2.326 ( 9.336 7.444 0.099) 11.941 2.601 ( -3.367 9.310 -10.707) 14.583 2.774 ( 3.436 -9.054 -17.555) 20.049 3.258 ( 3.168 14.294 -22.634) 26.956 3.507 ( -0.245 4.825 -14.889) 15.653 3.993 ( 13.141 -6.012 2.622) 14.687 4.533 ( -5.458 0.931 1.663) 5.782 5.370 ( 2.691 -7.087 4.708) 8.924 5.472 ( -12.077 4.606 9.935) 16.303 6.034 ( -1.976 -10.931 10.152) 15.049 6.276 ( -0.371 4.868 4.290) 6.499 6.689 ( -3.278 -1.261 13.174) 13.634 6.979 ( 3.265 -1.036 9.712) 10.298 7.346 ( -2.535 0.194 -2.440) 3.523 7.841 ( 1.226 1.398 -4.566) 4.930 8.009 ( -3.644 -4.479 -2.137) 6.157 8.504 ( 7.469 14.800 -10.701) 19.731 9.353 ( -4.126 -14.711 12.288) 19.607 9.664 ( 0.412 -3.073 9.028) 9.545 10.208 ( 3.414 9.899 4.083) 11.239 10.285 ( -12.165 0.205 3.694) 12.715 10.893 ( 4.291 -13.193 -2.644) 14.123 11.012 ( -6.162 3.618 -1.347) 7.271 11.280 ( 3.499 4.247 0.504) 5.526 11.714 ( 2.504 1.549 -7.978) 8.504 12.854 ( -2.071 -1.625 -1.090) 2.849 13.303 ( 6.137 2.147 4.437) 7.872 13.465 ( 0.951 -0.068 0.725) 1.198 13.820 ( -1.907 1.446 -8.779) 9.099 13.885 ( 2.041 1.607 -4.214) 4.950 14.287 ( -0.630 -4.990 -10.392) 11.545 14.790 ( 11.213 5.808 -6.602) 14.250 15.215 ( -12.464 6.945 -2.507) 14.487 17.287 ( -0.800 5.499 -4.163) 6.943 17.860 ( 17.367 -9.600 -28.624) 34.830 19.813 ( 3.236 1.537 6.236) 7.192 20.588 ( -2.205 2.679 -10.877) 11.417 24.932 ( -10.482 -2.873 46.289) 47.548 26.018 ( -9.726 8.059 27.087) 29.887 27.553 ( 9.726 -0.818 -26.760) 28.485 28.096 ( 4.887 2.133 -21.253) 21.912 ======================= Grid point 397 (196/300) ======================= q-point: (-0.27 0.18 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.939 ( 3.872 13.613 -6.088) 15.407 2.262 ( 6.341 6.600 -8.071) 12.203 2.360 ( -2.180 9.789 -1.037) 10.082 3.051 ( 3.835 -0.475 -18.595) 18.993 3.085 ( 3.221 -14.488 -22.166) 26.676 3.399 ( -7.915 -0.424 -16.982) 18.741 4.211 ( 16.173 -4.952 1.327) 16.966 4.477 ( -4.876 1.521 1.925) 5.459 5.288 ( -10.634 7.660 11.772) 17.617 5.508 ( 4.351 -3.802 1.406) 5.947 6.151 ( -2.023 8.790 7.594) 11.791 6.237 ( -2.438 -10.266 8.024) 13.256 6.698 ( -3.615 -0.626 13.299) 13.796 6.983 ( -2.957 2.802 14.121) 14.697 7.316 ( 1.742 2.611 -1.333) 3.410 7.751 ( 0.940 5.530 -2.099) 5.989 8.056 ( 6.224 3.167 -9.349) 11.669 8.353 ( -6.746 -2.126 -10.006) 12.254 9.567 ( 0.832 8.971 9.105) 12.809 9.629 ( -5.300 -10.257 15.901) 19.651 10.022 ( 7.672 14.204 -1.336) 16.199 10.356 ( -10.000 -13.495 6.970) 18.185 10.960 ( -1.700 -1.484 -1.062) 2.494 11.207 ( 3.020 -15.602 -4.973) 16.652 11.262 ( 5.170 -0.391 1.680) 5.451 11.705 ( 1.171 -0.268 -4.135) 4.306 12.855 ( -2.228 -0.274 -1.678) 2.802 13.255 ( 1.416 5.443 -1.410) 5.798 13.457 ( -3.023 0.615 -1.343) 3.364 13.746 ( 2.475 4.286 -8.080) 9.475 13.919 ( 2.764 -3.236 0.078) 4.257 14.326 ( 6.002 1.494 -8.692) 10.668 14.731 ( -1.042 4.514 -2.340) 5.190 15.094 ( -1.786 -2.291 -12.421) 12.756 17.203 ( -1.754 1.618 -1.200) 2.671 18.081 ( 10.439 -8.326 -30.445) 33.245 19.807 ( -0.331 2.046 8.522) 8.770 20.499 ( 0.723 3.542 -11.720) 12.264 25.035 ( -12.847 -8.290 45.270) 47.782 25.914 ( -5.507 2.219 27.862) 28.487 27.618 ( 11.040 -3.130 -28.168) 30.415 28.037 ( -0.050 1.491 -22.071) 22.121 ======================= Grid point 398 (197/300) ======================= q-point: (-0.18 0.18 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.712 ( 3.142 12.029 -2.335) 12.650 2.163 ( 0.591 0.898 -9.781) 9.840 2.238 ( 5.248 8.916 13.599) 17.087 3.031 ( 0.000 -2.727 -12.092) 12.396 3.313 ( -2.780 -5.763 -19.233) 20.269 3.509 ( 0.732 -19.744 -16.693) 25.865 4.387 ( 3.170 -2.217 -0.156) 3.872 4.426 ( 4.915 0.184 1.697) 5.203 5.085 ( -8.004 8.974 13.215) 17.867 5.574 ( 5.378 0.832 -1.283) 5.591 5.951 ( -4.487 10.334 7.163) 13.351 6.382 ( -0.508 -3.770 0.770) 3.881 6.737 ( -5.531 -5.179 16.105) 17.799 6.915 ( -6.223 2.484 15.202) 16.613 7.260 ( 4.050 5.267 3.257) 7.400 7.695 ( 3.522 1.187 -4.500) 5.837 7.970 ( 7.381 7.913 -2.593) 11.128 8.394 ( -10.518 -8.223 -12.695) 18.423 9.328 ( -1.406 14.227 5.129) 15.189 9.630 ( -1.196 15.630 1.146) 15.718 9.979 ( 3.459 -7.666 14.418) 16.691 10.582 ( -6.568 -14.371 7.057) 17.305 11.030 ( 3.460 -4.769 1.567) 6.097 11.306 ( 0.716 -3.942 3.584) 5.375 11.532 ( 3.167 -14.133 -5.480) 15.486 11.737 ( 0.475 -4.160 -2.881) 5.083 12.832 ( -2.087 0.216 -4.016) 4.531 13.137 ( -0.186 6.805 -5.573) 8.798 13.384 ( -5.882 3.189 -0.654) 6.722 13.673 ( 5.486 5.665 -7.937) 11.189 14.008 ( 1.341 -3.293 5.775) 6.782 14.308 ( 10.244 4.255 -6.066) 12.643 14.644 ( -5.769 0.098 -3.161) 6.579 15.195 ( 6.377 -8.048 -19.868) 22.364 17.206 ( -2.560 -3.391 3.440) 5.467 18.192 ( 0.936 -4.051 -27.580) 27.892 19.755 ( -4.574 3.004 9.202) 10.706 20.446 ( 6.657 2.369 -13.004) 14.800 25.198 ( -18.211 -12.094 43.707) 48.869 25.961 ( 1.222 -3.825 29.075) 29.351 27.711 ( 11.666 -2.672 -27.231) 29.745 27.979 ( -4.581 -1.405 -21.949) 22.466 ======================= Grid point 399 (198/300) ======================= q-point: (-0.09 0.18 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.576 ( -0.934 2.793 8.483) 8.979 2.119 ( 7.896 10.700 18.953) 23.153 2.224 ( 2.896 -5.603 -2.107) 6.650 3.052 ( -1.978 -0.784 -3.292) 3.920 3.425 ( -4.019 -12.136 -12.708) 18.026 3.840 ( 5.649 -13.586 -6.491) 16.082 4.336 ( -5.814 1.321 4.244) 7.318 4.556 ( 6.865 -4.298 -2.691) 8.535 4.902 ( -5.862 7.049 11.793) 14.938 5.519 ( 3.517 8.295 0.254) 9.013 5.795 ( -2.959 2.773 -1.548) 4.341 6.352 ( 1.813 5.883 -6.966) 9.296 6.767 ( -14.621 -0.329 13.592) 19.966 6.980 ( -0.112 -10.033 18.853) 21.356 7.220 ( 5.463 2.892 6.687) 9.106 7.721 ( 2.919 -1.261 -4.733) 5.702 7.885 ( 3.073 4.905 2.757) 6.411 8.440 ( -2.548 -4.730 -14.571) 15.530 9.029 ( -4.748 17.745 1.492) 18.430 9.265 ( 1.159 19.539 -0.962) 19.597 10.190 ( 0.271 -8.562 19.390) 21.198 10.805 ( -3.934 -12.388 3.033) 13.347 11.175 ( 5.625 -6.407 5.852) 10.341 11.389 ( -0.325 -2.826 6.545) 7.137 11.747 ( -3.238 -11.176 -4.205) 12.372 11.883 ( 1.323 -10.084 -6.945) 12.316 12.816 ( -0.601 -0.567 -5.761) 5.820 12.988 ( 2.674 8.146 -8.580) 12.129 13.273 ( -8.751 2.726 -0.445) 9.176 13.588 ( 9.059 6.715 -5.200) 12.418 14.068 ( -0.954 -2.098 7.546) 7.890 14.309 ( 10.999 3.292 -1.386) 11.565 14.642 ( -5.191 -3.834 -2.851) 7.055 15.377 ( 9.464 -8.635 -24.615) 27.749 17.295 ( -3.162 -6.771 8.318) 11.182 18.131 ( -9.042 3.334 -19.233) 21.512 19.690 ( -3.470 1.562 7.955) 8.819 20.455 ( 10.186 0.899 -14.267) 17.553 25.356 ( -22.989 -12.211 40.907) 48.487 26.175 ( 6.478 -10.504 30.310) 32.726 27.766 ( 10.330 0.810 -23.480) 25.665 27.953 ( -7.123 -3.862 -21.403) 22.885 ======================= Grid point 403 (199/300) ======================= q-point: ( 0.27 0.27 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.125 ( 15.571 0.000 21.546) 26.583 2.349 ( -6.208 -0.000 9.498) 11.347 2.949 ( 19.747 0.000 14.738) 24.640 3.078 ( 6.941 0.000 20.012) 21.182 3.905 ( -3.081 -0.000 24.572) 24.765 4.035 ( -0.528 -0.000 18.703) 18.710 4.327 ( -1.595 -0.000 14.059) 14.150 4.675 ( -3.785 -0.000 5.391) 6.587 4.764 ( -5.101 -0.000 -8.517) 9.928 5.428 ( 2.116 0.000 -3.917) 4.452 5.452 ( 3.760 0.000 -21.421) 21.749 6.058 ( 4.995 0.000 -19.155) 19.796 6.410 ( -6.550 -0.000 8.980) 11.114 6.960 ( -14.267 -0.000 4.116) 14.849 7.263 ( -9.657 -0.000 0.805) 9.691 7.538 ( -15.324 -0.000 -7.518) 17.069 7.837 ( 9.271 0.000 9.518) 13.287 8.216 ( -0.363 -0.000 1.356) 1.403 8.671 ( 6.007 0.000 11.970) 13.393 9.537 ( 27.972 0.000 -10.566) 29.901 10.403 ( -4.489 -0.000 13.415) 14.146 11.174 ( -8.694 -0.000 13.186) 15.794 11.311 ( -9.419 -0.000 1.530) 9.543 11.700 ( 16.191 0.000 -10.151) 19.110 11.788 ( -12.417 -0.000 -15.837) 20.124 11.969 ( -8.931 -0.000 -4.915) 10.194 12.870 ( 5.973 0.000 2.892) 6.636 12.973 ( 8.174 0.000 1.878) 8.387 13.148 ( 2.086 0.000 -4.840) 5.271 13.978 ( -6.663 -0.000 3.091) 7.345 14.003 ( -14.693 -0.000 -1.791) 14.802 14.508 ( 10.567 0.000 -18.831) 21.593 14.974 ( -4.699 -0.000 18.480) 19.068 15.026 ( 22.529 0.000 4.494) 22.973 17.667 ( -0.744 -0.000 14.556) 14.575 17.734 ( 7.511 0.000 -2.637) 7.960 19.896 ( 4.271 0.000 7.922) 9.000 20.648 ( 7.746 0.000 -20.922) 22.310 25.311 ( -18.578 -0.000 42.632) 46.504 27.440 ( 8.476 0.000 -9.776) 12.938 27.448 ( 0.238 0.000 16.369) 16.370 27.687 ( -0.766 -0.000 -7.567) 7.605 ======================= Grid point 404 (200/300) ======================= q-point: ( 0.36 0.27 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.086 ( 2.372 10.834 19.476) 22.413 2.463 ( 4.625 -7.985 10.658) 14.097 3.035 ( 17.469 6.081 14.059) 23.234 3.185 ( 4.241 -1.492 14.041) 14.743 3.766 ( -4.555 10.430 23.026) 25.685 4.203 ( 2.759 -3.150 7.380) 8.485 4.317 ( 3.219 2.888 10.664) 11.508 4.550 ( -7.083 -0.297 4.793) 8.558 4.826 ( 0.531 -0.630 2.913) 3.027 5.217 ( -0.131 4.747 -14.628) 15.380 5.676 ( 2.527 -7.126 -10.593) 13.015 6.067 ( 3.265 -3.750 -14.391) 15.226 6.420 ( -0.770 -1.933 6.539) 6.862 6.893 ( -12.709 -1.944 4.809) 13.727 7.260 ( -10.828 -6.746 0.078) 12.758 7.436 ( -11.111 -1.390 -8.220) 13.891 7.930 ( 6.413 -2.227 8.970) 11.250 8.256 ( -1.537 -5.577 2.028) 6.130 8.769 ( 5.736 -2.923 12.764) 14.296 9.606 ( 23.249 9.982 -9.658) 27.082 10.403 ( -3.706 -0.468 14.383) 14.860 11.058 ( -9.459 7.044 8.213) 14.371 11.224 ( -11.723 2.761 3.617) 12.575 11.618 ( -11.001 5.179 -11.157) 16.502 11.699 ( 9.401 6.776 -8.491) 14.366 11.962 ( -2.620 -2.383 -7.370) 8.177 12.955 ( 6.236 -4.139 0.370) 7.494 13.043 ( 7.156 0.061 -0.268) 7.162 13.105 ( 3.570 4.028 -0.196) 5.386 13.875 ( -14.683 0.036 0.959) 14.715 13.958 ( -5.127 0.315 1.951) 5.494 14.345 ( 2.039 9.144 -3.667) 10.061 15.109 ( 7.303 -0.564 11.227) 13.405 15.329 ( 16.195 -15.498 -12.061) 25.454 17.623 ( -0.929 5.972 13.138) 14.461 17.743 ( 10.451 5.174 -3.212) 12.096 19.931 ( 3.747 0.659 6.043) 7.140 20.651 ( 5.516 0.934 -19.451) 20.239 25.221 ( -15.747 4.171 44.490) 47.378 27.164 ( -1.757 16.836 8.494) 18.939 27.633 ( 0.097 -2.295 -7.811) 8.142 27.783 ( 10.908 -8.770 -2.872) 14.289 ======================= Grid point 405 (201/300) ======================= q-point: ( 0.45 0.27 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.964 ( 2.223 5.586 15.639) 16.755 2.632 ( 2.659 -4.416 6.771) 8.510 3.012 ( 12.533 9.821 3.771) 16.363 3.217 ( 2.769 5.076 18.867) 19.733 3.610 ( -1.288 4.416 10.597) 11.553 4.090 ( 1.722 12.344 -7.531) 14.562 4.254 ( 2.075 6.939 1.189) 7.339 4.648 ( -4.568 2.729 5.595) 7.721 4.806 ( 5.939 -6.905 8.558) 12.498 5.274 ( -2.539 -10.522 -4.132) 11.586 5.683 ( -3.383 1.074 -6.421) 7.337 6.226 ( 3.425 -9.640 -9.654) 14.066 6.466 ( 2.872 -1.109 6.249) 6.966 6.866 ( -7.793 -2.262 6.656) 10.495 7.289 ( -8.924 -3.287 -4.508) 10.525 7.453 ( -6.836 -8.204 -5.227) 11.890 8.037 ( 5.146 -2.465 12.221) 13.488 8.438 ( -2.768 -15.138 2.602) 15.607 8.895 ( 3.015 -5.686 8.134) 10.372 9.487 ( 17.171 15.682 -8.340) 24.704 10.409 ( -2.560 0.177 15.662) 15.871 10.833 ( -10.161 10.169 6.755) 15.883 11.030 ( -13.048 8.516 -0.804) 15.602 11.431 ( -6.844 6.098 -5.575) 10.728 11.618 ( 5.612 6.394 -5.260) 10.002 11.925 ( -0.205 3.618 -8.202) 8.967 12.931 ( -1.022 6.116 -2.723) 6.772 13.116 ( 8.847 -3.548 2.032) 9.746 13.221 ( 8.340 -8.151 1.236) 11.727 13.777 ( -7.541 1.265 -0.041) 7.646 13.947 ( -1.726 -0.627 4.431) 4.797 14.243 ( -5.854 1.104 -5.192) 7.903 15.139 ( 11.609 5.672 3.973) 13.518 15.592 ( 3.421 -5.648 -15.059) 16.443 17.526 ( -0.253 4.289 6.715) 7.972 17.699 ( 16.008 8.033 -5.819) 18.832 19.939 ( 4.146 2.398 3.169) 5.743 20.632 ( 1.558 0.333 -16.060) 16.138 25.102 ( -12.568 5.849 46.709) 48.723 26.827 ( -7.961 17.251 13.041) 23.045 27.638 ( 5.535 1.757 -9.110) 10.804 28.005 ( 11.379 -6.624 -10.514) 16.849 ======================= Grid point 406 (202/300) ======================= q-point: (-0.45 -0.73 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.986 ( 4.170 -3.331 5.398) 7.592 2.671 ( 2.011 3.049 6.654) 7.590 2.879 ( 5.308 10.027 -6.300) 12.977 3.044 ( -4.084 14.003 10.817) 18.160 3.685 ( 5.428 -5.692 6.219) 10.027 3.829 ( 6.386 14.320 -13.917) 20.965 4.060 ( 5.392 16.171 -10.929) 20.249 4.528 ( -9.067 1.012 3.697) 9.844 5.059 ( 5.670 -9.711 6.705) 13.093 5.442 ( -5.567 -7.347 8.236) 12.361 5.669 ( -4.357 -5.454 -1.133) 7.072 6.349 ( 0.695 -2.699 -5.010) 5.732 6.541 ( 1.261 -4.008 9.522) 10.408 6.906 ( 1.365 -3.234 5.689) 6.685 7.283 ( -4.022 -2.521 -4.569) 6.588 7.557 ( -6.916 -8.558 -5.239) 12.187 8.110 ( 4.213 1.368 13.780) 14.475 8.742 ( -4.960 -17.494 3.600) 18.536 9.083 ( 6.196 -10.115 -0.125) 11.862 9.263 ( 7.286 14.436 -5.736) 17.158 10.418 ( -0.564 0.483 13.766) 13.786 10.577 ( -10.589 10.645 6.927) 16.536 10.780 ( -8.102 7.416 -1.492) 11.084 11.262 ( -5.080 7.249 -2.816) 9.289 11.512 ( 3.724 7.599 -2.443) 8.808 11.827 ( 0.469 4.540 -10.020) 11.011 12.845 ( 0.616 2.406 0.460) 2.526 13.238 ( 6.677 -3.474 2.924) 8.074 13.442 ( 7.285 -6.966 2.239) 10.326 13.739 ( -1.103 -1.312 -5.561) 5.819 13.947 ( -2.189 0.045 3.254) 3.922 14.167 ( -8.292 0.419 -8.387) 11.802 15.088 ( 12.054 8.468 -2.347) 14.917 15.531 ( -8.429 6.599 -7.918) 13.315 17.483 ( -2.496 1.625 -1.253) 3.231 17.695 ( 24.848 4.546 -14.146) 28.951 19.917 ( 4.616 3.481 2.694) 6.378 20.607 ( -2.475 -0.562 -13.265) 13.505 24.999 ( -9.933 5.116 47.475) 48.772 26.472 ( -11.781 15.555 18.323) 26.767 27.618 ( 8.258 3.231 -14.375) 16.890 28.138 ( 10.515 -1.557 -15.804) 19.046 ======================= Grid point 407 (203/300) ======================= q-point: (-0.36 -0.73 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.126 ( 2.819 -6.700 -4.789) 8.705 2.594 ( 8.070 9.186 7.558) 14.375 2.711 ( -0.643 8.088 -12.553) 14.946 2.774 ( -4.140 9.587 -2.487) 10.734 3.509 ( -4.171 13.167 -15.310) 20.619 3.705 ( 6.797 18.279 -20.896) 28.583 3.975 ( 15.685 -6.781 4.806) 17.750 4.480 ( -8.895 -1.265 1.086) 9.050 5.257 ( 2.637 -7.699 5.691) 9.930 5.456 ( -8.672 0.581 9.356) 12.771 5.830 ( -2.097 -11.377 8.162) 14.158 6.345 ( 0.207 2.016 -0.463) 2.079 6.640 ( -2.305 -3.949 12.116) 12.950 6.999 ( 5.228 -2.148 6.584) 8.677 7.306 ( -1.087 -2.262 -3.738) 4.502 7.668 ( -6.152 -10.017 -7.868) 14.145 8.074 ( 0.892 6.420 9.893) 11.827 8.876 ( 6.086 13.797 -10.088) 18.143 9.076 ( -0.394 -8.977 7.227) 11.532 9.442 ( -0.969 -18.709 2.748) 18.934 10.300 ( -12.443 10.508 7.757) 18.039 10.407 ( 2.540 4.661 5.936) 7.964 10.728 ( 0.816 -5.259 2.007) 5.688 11.082 ( -3.894 7.508 -2.148) 8.726 11.402 ( 2.928 5.923 -0.464) 6.624 11.739 ( -0.379 3.001 -11.056) 11.462 12.840 ( 1.803 -0.114 2.301) 2.926 13.342 ( 4.145 -2.294 2.570) 5.390 13.526 ( 4.415 2.612 4.583) 6.879 13.777 ( -0.733 -2.860 -11.176) 11.560 13.926 ( -0.209 1.618 0.491) 1.704 14.130 ( -4.514 -5.379 -11.332) 13.332 15.001 ( 9.554 8.457 -4.249) 13.448 15.280 ( -11.059 9.567 -3.707) 15.086 17.393 ( -0.785 5.811 -3.599) 6.880 17.825 ( 21.647 -2.864 -24.603) 32.896 19.894 ( 3.823 2.917 5.196) 7.080 20.568 ( -3.945 -0.056 -12.253) 12.872 24.941 ( -8.951 2.512 46.822) 47.736 26.166 ( -12.099 11.358 23.106) 28.448 27.597 ( 9.672 2.314 -20.019) 22.353 28.157 ( 7.603 2.982 -19.865) 21.478 ======================= Grid point 408 (204/300) ======================= q-point: (-0.27 0.27 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.139 ( -0.433 5.615 -6.317) 8.463 2.487 ( 9.445 12.170 -13.407) 20.423 2.527 ( 1.179 7.404 5.318) 9.192 2.762 ( 2.470 -11.785 -15.824) 19.884 3.197 ( -0.919 13.833 -20.880) 25.063 3.419 ( -1.001 9.730 -20.138) 22.388 4.221 ( 14.542 -6.155 3.343) 16.141 4.441 ( -7.658 -0.916 -0.646) 7.739 5.339 ( -8.160 2.902 9.694) 13.000 5.446 ( 2.831 -5.512 5.675) 8.402 6.042 ( -1.891 -10.600 10.348) 14.933 6.282 ( -0.737 5.244 3.705) 6.463 6.683 ( -3.644 -1.119 12.314) 12.891 7.040 ( -0.973 1.992 11.700) 11.908 7.343 ( 4.030 -1.379 -3.011) 5.216 7.802 ( -3.003 -6.482 -9.851) 12.169 7.965 ( -2.518 2.170 2.560) 4.196 8.565 ( 6.446 18.509 -11.163) 22.556 9.344 ( -3.342 -15.951 13.145) 20.938 9.698 ( 0.014 -3.438 8.054) 8.757 10.098 ( -13.510 -1.892 4.485) 14.360 10.316 ( 8.018 9.699 2.477) 12.825 10.898 ( -4.529 -5.123 1.598) 7.022 10.994 ( 6.684 -5.466 -4.360) 9.672 11.337 ( 3.119 3.412 1.382) 4.825 11.674 ( -3.439 0.394 -9.616) 10.220 12.862 ( 2.041 0.300 3.559) 4.113 13.355 ( 0.922 3.375 -2.675) 4.404 13.474 ( 0.137 4.010 -0.402) 4.033 13.790 ( 1.365 -1.122 -4.918) 5.226 13.900 ( 1.329 0.774 -2.302) 2.769 14.252 ( 1.090 -8.803 -12.260) 15.132 14.854 ( -4.231 9.510 -1.144) 10.471 15.100 ( 3.706 3.963 -7.734) 9.447 17.268 ( 0.183 5.992 -3.595) 6.990 17.979 ( 12.590 -4.978 -29.753) 32.688 19.870 ( 0.428 2.921 8.196) 8.712 20.519 ( -0.782 0.757 -12.334) 12.382 24.941 ( -10.671 -1.295 46.074) 47.311 25.978 ( -8.638 5.115 25.925) 27.801 27.611 ( 10.108 -0.554 -24.187) 26.220 28.080 ( 4.094 5.200 -22.516) 23.468 ======================= Grid point 409 (205/300) ======================= q-point: (-0.18 0.27 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.993 ( 6.002 10.275 -4.421) 12.694 2.232 ( -0.754 11.031 -16.602) 19.947 2.484 ( 13.782 7.466 9.284) 18.217 2.979 ( -1.458 3.011 -20.930) 21.196 3.084 ( 2.092 -21.416 -19.974) 29.359 3.250 ( -1.976 3.511 -18.445) 18.880 4.358 ( -3.449 -1.209 -0.353) 3.672 4.454 ( 7.788 -3.062 1.124) 8.443 5.206 ( -5.984 7.030 11.053) 14.401 5.582 ( 4.952 -4.061 2.748) 6.969 6.129 ( -4.560 9.287 7.742) 12.922 6.238 ( -1.542 -8.982 7.677) 11.916 6.691 ( -3.724 -0.379 12.628) 13.171 6.966 ( -5.685 4.590 13.039) 14.947 7.381 ( 5.958 1.988 3.524) 7.202 7.755 ( 1.388 4.054 -6.016) 7.386 8.070 ( -0.079 -10.089 -8.826) 13.405 8.275 ( 1.361 13.013 -8.686) 15.705 9.559 ( -6.230 9.593 9.573) 14.916 9.627 ( -2.502 -9.218 13.687) 16.690 10.107 ( 2.753 7.867 1.109) 8.408 10.294 ( 0.462 -10.142 4.230) 10.998 10.914 ( -4.770 -4.907 1.076) 6.927 11.267 ( 8.157 -10.902 -5.751) 14.781 11.329 ( 2.378 -2.228 2.322) 4.001 11.646 ( -6.370 -2.692 -6.343) 9.384 12.857 ( 1.490 2.216 2.714) 3.807 13.252 ( 1.302 6.125 -5.931) 8.624 13.394 ( -4.957 3.050 -2.284) 6.252 13.791 ( 6.430 3.189 -7.022) 10.041 13.943 ( -0.128 -4.408 2.457) 5.048 14.375 ( 5.170 -3.417 -10.261) 11.988 14.646 ( -7.604 5.929 -2.700) 10.013 15.132 ( 11.843 -2.190 -11.987) 16.992 17.182 ( -0.600 2.248 -1.037) 2.547 18.070 ( 2.543 -4.253 -30.108) 30.513 19.806 ( -4.242 4.012 9.190) 10.888 20.501 ( 5.709 0.681 -12.331) 13.605 24.994 ( -14.695 -5.370 45.804) 48.402 25.951 ( -2.899 -1.726 27.294) 27.502 27.675 ( 9.033 -3.519 -26.246) 27.979 27.964 ( 1.932 4.785 -23.384) 23.946 ======================= Grid point 410 (206/300) ======================= q-point: (-0.09 0.27 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.781 ( 7.476 15.007 -3.561) 17.140 2.150 ( 2.728 -3.372 -6.170) 7.542 2.428 ( 13.289 10.826 13.067) 21.553 2.991 ( 0.139 -4.832 -11.372) 12.357 3.179 ( -4.724 -5.589 -20.044) 21.338 3.509 ( 6.324 -21.635 -17.636) 28.620 4.314 ( -7.377 0.402 -0.417) 7.400 4.572 ( 8.554 -1.874 1.005) 8.815 5.038 ( -4.367 8.893 11.911) 15.493 5.654 ( 6.163 1.444 -0.471) 6.347 5.898 ( -6.329 10.999 7.266) 14.623 6.376 ( -0.834 -4.114 1.320) 4.401 6.692 ( -7.895 -0.963 14.518) 16.554 6.881 ( -5.121 0.337 12.969) 13.948 7.364 ( 6.129 4.824 9.809) 12.532 7.724 ( 3.131 0.306 -8.069) 8.661 8.045 ( 2.339 9.975 -2.022) 10.443 8.268 ( 1.308 -10.274 -11.371) 15.381 9.294 ( -5.272 14.014 4.524) 15.641 9.606 ( -3.222 13.546 3.025) 14.248 10.094 ( 5.630 -4.596 13.733) 15.537 10.532 ( -3.373 -13.726 5.131) 15.037 11.032 ( -3.862 -10.224 0.806) 10.959 11.340 ( 1.759 -1.629 4.366) 4.981 11.547 ( 0.520 -9.601 -5.273) 10.966 11.686 ( -3.776 -8.488 -5.792) 10.947 12.824 ( 1.837 1.935 -0.729) 2.766 13.147 ( 4.705 6.685 -6.749) 10.601 13.272 ( -8.755 3.986 -0.027) 9.619 13.750 ( 8.047 5.256 -8.790) 13.024 14.022 ( -1.893 -3.353 5.399) 6.631 14.424 ( 8.372 0.582 -5.167) 9.855 14.556 ( -3.845 -0.762 -5.671) 6.893 15.284 ( 14.909 -6.137 -17.925) 24.109 17.182 ( -2.344 -3.142 3.454) 5.224 18.056 ( -6.906 -0.663 -25.421) 26.351 19.717 ( -4.154 2.897 7.831) 9.326 20.524 ( 9.808 0.827 -12.405) 15.835 25.084 ( -18.801 -8.380 45.241) 49.704 26.089 ( 2.134 -7.874 28.727) 29.863 27.761 ( 3.918 -4.794 -26.286) 27.006 27.867 ( 4.105 3.217 -22.235) 22.839 ======================= Grid point 415 (207/300) ======================= q-point: ( 0.36 0.36 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.282 ( -8.311 -0.000 10.406) 13.318 2.370 ( 7.783 0.000 19.645) 21.131 3.211 ( 2.148 0.000 17.974) 18.102 3.224 ( 10.226 0.000 16.394) 19.322 4.000 ( 5.450 0.000 23.689) 24.308 4.107 ( 3.039 0.000 13.236) 13.580 4.360 ( -2.027 -0.000 15.737) 15.867 4.604 ( -8.678 -0.000 4.099) 9.598 4.710 ( 1.773 0.000 -6.186) 6.435 5.448 ( 5.688 0.000 -20.107) 20.896 5.455 ( 2.963 0.000 -5.114) 5.910 6.062 ( 4.923 0.000 -18.943) 19.572 6.384 ( -1.412 -0.000 10.889) 10.980 6.791 ( -11.265 -0.000 3.698) 11.857 7.120 ( -9.712 -0.000 -1.643) 9.851 7.316 ( -12.453 -0.000 -7.150) 14.360 7.953 ( 4.447 0.000 3.451) 5.629 8.193 ( -3.468 -0.000 1.139) 3.650 8.829 ( 7.919 0.000 19.474) 21.023 9.860 ( 23.229 0.000 -11.753) 26.033 10.389 ( -3.899 -0.000 13.667) 14.212 11.081 ( -10.235 -0.000 10.446) 14.625 11.161 ( -12.554 -0.000 0.328) 12.558 11.569 ( -9.225 -0.000 -13.805) 16.604 11.816 ( -10.317 -0.000 -2.417) 10.596 11.905 ( 16.255 0.000 -11.030) 19.644 12.956 ( 4.788 0.000 0.116) 4.789 13.092 ( 6.787 0.000 1.262) 6.903 13.185 ( 4.468 0.000 0.622) 4.511 13.748 ( -17.860 -0.000 -2.260) 18.003 13.904 ( -5.008 -0.000 2.542) 5.616 14.522 ( 0.077 0.000 -7.672) 7.672 14.966 ( -6.102 -0.000 20.682) 21.563 15.437 ( 32.343 0.000 -10.622) 34.043 17.696 ( -2.444 -0.000 14.443) 14.648 17.881 ( 14.546 0.000 -4.060) 15.102 19.963 ( 1.405 0.000 6.987) 7.127 20.666 ( 4.776 0.000 -20.757) 21.300 25.235 ( -13.164 -0.000 44.026) 45.952 27.392 ( -4.082 -0.000 -20.153) 20.562 27.517 ( 1.055 0.000 17.394) 17.426 27.793 ( 12.981 0.000 2.329) 13.189 ======================= Grid point 416 (208/300) ======================= q-point: (-0.55 -0.64 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.125 ( -4.705 8.173 15.750) 18.358 2.537 ( -0.871 -7.144 11.109) 13.237 3.229 ( 0.743 4.477 10.588) 11.520 3.294 ( 5.097 -0.662 21.450) 22.057 3.819 ( 2.288 15.078 19.124) 24.460 4.271 ( 3.443 2.376 5.926) 7.254 4.384 ( -1.716 9.518 -1.226) 9.749 4.503 ( -0.722 -13.436 17.680) 22.218 4.857 ( 2.307 -4.996 4.887) 7.360 5.178 ( 2.073 9.359 -16.862) 19.396 5.661 ( 0.332 -3.250 -9.491) 10.037 6.070 ( 4.137 -4.990 -14.161) 15.574 6.480 ( 6.145 -3.585 5.644) 9.082 6.747 ( -10.353 -3.405 6.406) 12.642 7.109 ( -9.139 -5.882 -2.349) 11.120 7.269 ( -8.541 -4.701 -7.899) 12.548 8.011 ( 2.458 -3.135 4.401) 5.936 8.227 ( -3.448 -6.548 1.831) 7.624 8.909 ( 5.948 0.663 18.325) 19.277 9.874 ( 19.557 11.929 -11.243) 25.518 10.405 ( -2.806 -1.227 14.070) 14.399 10.934 ( -11.695 7.493 6.928) 15.522 11.047 ( -14.114 3.333 0.338) 14.506 11.466 ( -4.444 3.122 -9.476) 10.922 11.709 ( -4.318 2.863 -3.526) 6.267 11.986 ( 9.073 1.783 -9.093) 12.969 12.993 ( 1.463 0.377 -4.542) 4.786 13.149 ( 6.383 -0.546 0.577) 6.432 13.182 ( 4.691 0.391 5.134) 6.966 13.673 ( -11.605 -3.732 -0.651) 12.207 13.904 ( -4.235 -2.439 2.803) 5.634 14.341 ( -1.111 11.229 -0.894) 11.319 15.120 ( -6.956 -10.479 13.359) 18.349 15.622 ( 26.221 1.408 -16.158) 30.832 17.635 ( -3.534 5.941 13.039) 14.759 17.941 ( 18.522 4.656 -6.385) 20.137 19.981 ( 0.327 -0.051 5.623) 5.633 20.639 ( 2.248 1.781 -19.303) 19.515 25.193 ( -10.131 3.627 45.148) 46.413 27.105 ( -7.004 16.722 -2.120) 18.254 27.656 ( 3.595 -4.073 1.366) 5.602 27.948 ( 12.989 -5.880 -1.984) 14.395 ======================= Grid point 417 (209/300) ======================= q-point: (-0.45 -0.64 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.017 ( -1.905 3.096 13.351) 13.837 2.636 ( -5.440 -4.380 5.241) 8.732 3.110 ( 0.763 9.324 3.373) 9.945 3.291 ( -3.513 10.268 22.967) 25.402 3.672 ( 5.286 2.815 10.759) 12.313 4.118 ( 4.644 12.607 -9.276) 16.327 4.266 ( -1.668 3.709 5.105) 6.527 4.610 ( -2.081 10.873 0.530) 11.083 4.931 ( 7.262 -8.482 5.522) 12.457 5.243 ( -0.328 -12.012 0.356) 12.022 5.602 ( -4.349 2.579 -5.472) 7.451 6.237 ( 2.889 -8.779 -10.733) 14.163 6.534 ( 1.975 0.554 6.071) 6.408 6.829 ( 0.380 -6.739 7.126) 9.815 7.169 ( -5.481 -5.972 -4.509) 9.276 7.336 ( -6.321 -8.523 -6.576) 12.484 8.122 ( 1.910 -5.019 9.402) 10.828 8.405 ( -3.049 -14.511 2.956) 15.120 8.957 ( 1.095 -1.472 11.115) 11.265 9.691 ( 15.713 18.314 -10.685) 26.391 10.428 ( -2.236 -0.571 13.769) 13.961 10.700 ( -12.404 9.392 7.745) 17.380 10.851 ( -10.250 6.637 -1.417) 12.293 11.355 ( -1.475 5.656 -4.316) 7.266 11.630 ( -1.273 3.545 -5.144) 6.376 11.932 ( 4.747 6.805 -7.450) 11.151 12.920 ( -0.244 4.599 0.150) 4.608 13.224 ( 5.368 -2.721 0.454) 6.035 13.317 ( 4.728 -8.813 0.492) 10.014 13.694 ( -2.997 -3.387 -0.823) 4.597 13.923 ( -3.844 -1.696 4.206) 5.945 14.160 ( -3.766 6.158 -2.545) 7.654 15.209 ( -4.489 -1.594 6.348) 7.937 15.643 ( 11.894 8.625 -15.499) 21.356 17.522 ( -2.907 4.446 7.343) 9.063 17.964 ( 23.181 6.722 -12.191) 27.040 19.985 ( 0.225 0.843 4.232) 4.321 20.575 ( -1.298 1.756 -16.405) 16.550 25.122 ( -7.359 5.513 46.421) 47.323 26.720 ( -11.244 17.364 7.565) 22.027 27.708 ( 6.815 1.607 -5.319) 8.793 28.136 ( 11.754 -4.684 -9.614) 15.891 ======================= Grid point 418 (210/300) ======================= q-point: (-0.36 -0.64 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.032 ( -0.178 -3.432 4.140) 5.380 2.649 ( -7.143 -1.327 1.525) 7.424 2.930 ( 1.121 10.501 -1.044) 10.613 2.995 ( -5.638 17.264 13.373) 22.554 3.664 ( -0.644 7.549 -5.882) 9.591 4.016 ( 13.762 0.246 1.273) 13.823 4.095 ( 5.823 17.787 -13.102) 22.846 4.401 ( -9.751 2.428 1.545) 10.166 5.140 ( 2.303 -7.847 2.713) 8.616 5.428 ( 0.115 -2.391 9.813) 10.101 5.605 ( -4.455 -10.163 1.911) 11.260 6.340 ( 0.700 -2.621 -5.531) 6.160 6.574 ( -1.185 -3.248 8.885) 9.534 6.976 ( 4.495 -4.987 6.672) 9.465 7.237 ( 0.365 -4.372 -5.543) 7.069 7.440 ( -6.473 -8.394 -5.731) 12.050 8.194 ( 0.800 2.094 12.717) 12.913 8.689 ( -4.235 -16.134 4.415) 17.254 9.094 ( -2.158 -13.570 2.651) 13.993 9.400 ( 12.950 20.430 -10.882) 26.524 10.418 ( -12.245 6.757 6.249) 15.318 10.471 ( -0.969 3.237 12.848) 13.285 10.716 ( -0.904 2.306 1.726) 3.019 11.212 ( -0.454 8.155 -2.453) 8.528 11.523 ( -0.989 5.917 -3.976) 7.197 11.812 ( 2.147 6.633 -8.421) 10.932 12.871 ( 1.298 1.376 3.850) 4.290 13.319 ( 4.829 -3.333 0.203) 5.871 13.515 ( 2.015 -7.999 -0.796) 8.287 13.726 ( 1.268 -0.733 -4.030) 4.287 13.929 ( -2.312 -0.874 4.424) 5.067 14.040 ( -4.948 1.964 -7.503) 9.199 15.152 ( -5.284 4.407 1.439) 7.029 15.448 ( 4.382 13.708 -10.385) 17.747 17.454 ( -1.797 2.606 0.294) 3.180 17.984 ( 23.375 5.675 -20.675) 31.719 19.968 ( 0.194 1.841 4.796) 5.140 20.512 ( -3.419 0.161 -13.802) 14.220 25.050 ( -5.845 5.683 46.517) 47.226 26.350 ( -13.216 14.425 16.045) 25.302 27.692 ( 7.962 3.608 -12.664) 15.388 28.228 ( 9.698 0.911 -15.723) 18.496 ======================= Grid point 419 (211/300) ======================= q-point: (-0.27 -0.64 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.117 ( -1.710 -4.490 -5.314) 7.164 2.586 ( -7.397 2.638 -4.013) 8.819 2.690 ( -6.875 7.247 0.311) 9.994 2.788 ( 10.970 10.021 0.706) 14.875 3.419 ( 0.131 13.639 -15.617) 20.735 3.710 ( 5.287 21.926 -22.423) 31.804 4.206 ( 12.676 -6.390 5.710) 15.301 4.339 ( -10.852 -2.034 -1.413) 11.131 5.282 ( -1.959 -6.290 7.348) 9.869 5.423 ( 0.105 1.178 5.521) 5.646 5.836 ( -1.479 -12.554 10.530) 16.452 6.349 ( 0.795 1.470 -1.433) 2.202 6.639 ( -3.296 -2.970 11.230) 12.075 7.066 ( -0.550 -0.853 9.396) 9.451 7.324 ( 5.914 -3.589 -5.347) 8.743 7.555 ( -5.582 -10.355 -7.217) 13.801 8.095 ( -2.707 8.372 8.139) 11.986 8.889 ( 1.168 2.977 -4.972) 5.912 9.110 ( 1.283 0.147 3.529) 3.758 9.459 ( 2.690 -17.704 0.011) 17.907 10.141 ( -13.267 10.947 8.154) 19.035 10.482 ( 4.161 2.300 7.551) 8.923 10.776 ( 4.803 -5.722 2.370) 7.838 11.058 ( 1.727 7.048 -1.477) 7.406 11.410 ( -1.759 3.943 -2.596) 5.038 11.689 ( -1.033 5.357 -9.215) 10.709 12.886 ( 2.020 -0.348 5.357) 5.736 13.391 ( 4.191 -0.073 -2.209) 4.739 13.565 ( -1.359 3.054 0.218) 3.350 13.743 ( 0.135 -2.067 -5.657) 6.024 13.926 ( -0.706 0.807 1.796) 2.092 14.057 ( 0.338 -7.967 -12.208) 14.582 14.971 ( -11.096 8.490 0.111) 13.972 15.256 ( 9.029 8.902 -7.299) 14.630 17.376 ( -0.069 4.890 -3.508) 6.019 18.005 ( 16.136 2.865 -28.176) 32.596 19.934 ( -1.766 2.495 6.888) 7.536 20.481 ( -1.262 -1.232 -12.355) 12.480 24.990 ( -6.788 4.413 46.013) 46.720 26.075 ( -11.580 8.635 22.257) 26.534 27.659 ( 8.130 2.637 -19.374) 21.175 28.190 ( 6.960 5.680 -20.060) 21.980 ======================= Grid point 420 (212/300) ======================= q-point: (-0.18 -0.64 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.095 ( -2.651 2.401 -6.217) 7.173 2.426 ( -3.072 8.861 -9.774) 13.546 2.704 ( 3.705 -6.592 -9.192) 11.902 2.748 ( 10.262 -0.364 -2.358) 10.536 3.125 ( 2.295 15.571 -18.432) 24.237 3.355 ( 2.145 12.679 -23.251) 26.570 4.287 ( -9.035 -1.434 -2.897) 9.595 4.419 ( 7.232 -6.350 3.663) 10.298 5.298 ( -1.906 3.686 8.259) 9.243 5.506 ( 2.192 -6.922 6.740) 9.907 6.054 ( -1.330 -9.695 10.419) 14.294 6.280 ( -1.260 6.214 3.288) 7.142 6.674 ( -3.438 -1.378 11.852) 12.418 7.031 ( -5.005 3.667 11.204) 12.807 7.422 ( 6.422 -2.125 -0.915) 6.826 7.717 ( -3.149 -10.045 -8.808) 13.726 7.942 ( -1.763 4.212 0.387) 4.583 8.610 ( 5.380 18.851 -11.472) 22.714 9.351 ( -2.125 -15.447 13.580) 20.677 9.717 ( -1.620 -0.146 8.648) 8.799 9.940 ( -10.046 -5.199 3.328) 11.791 10.449 ( 8.147 7.215 4.435) 11.751 10.848 ( -1.725 0.918 0.133) 1.958 11.106 ( 9.988 -8.924 -3.144) 13.758 11.351 ( -2.255 0.566 -0.779) 2.452 11.574 ( -5.230 2.636 -7.985) 9.903 12.911 ( 1.959 0.743 5.690) 6.063 13.359 ( 3.305 4.828 -6.215) 8.535 13.443 ( -3.938 5.910 -3.525) 7.929 13.812 ( 1.682 -4.516 1.125) 4.948 13.901 ( 0.357 1.276 -3.682) 3.913 14.234 ( 2.725 -10.508 -13.122) 17.030 14.729 ( -8.544 8.669 -2.234) 12.376 15.213 ( 11.173 2.631 -5.014) 12.526 17.269 ( 1.891 5.958 -4.629) 7.778 18.000 ( 5.509 0.519 -31.200) 31.687 19.865 ( -4.930 3.796 7.899) 10.055 20.502 ( 4.043 -2.030 -11.187) 12.067 24.951 ( -10.221 1.702 46.065) 47.216 25.956 ( -7.055 1.328 25.466) 26.459 27.650 ( 6.664 -0.045 -24.520) 25.409 28.071 ( 5.919 7.163 -22.195) 24.061 ======================= Grid point 421 (213/300) ======================= q-point: (-0.09 0.36 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.062 ( 5.030 0.936 -4.166) 6.598 2.185 ( 1.828 13.280 -11.890) 17.919 2.747 ( 17.503 8.603 5.625) 20.298 2.880 ( -1.757 -0.206 -20.283) 20.360 2.993 ( -2.210 -11.874 -18.091) 21.753 3.233 ( 6.703 -3.974 -20.472) 21.905 4.241 ( -9.417 -1.307 -3.606) 10.168 4.565 ( 4.547 -4.218 2.650) 6.744 5.199 ( -0.075 7.580 8.776) 11.597 5.658 ( 3.403 -5.111 4.709) 7.738 6.084 ( -5.541 10.355 8.587) 14.549 6.243 ( -1.231 -7.412 6.635) 10.024 6.681 ( -3.705 0.467 12.453) 13.000 6.926 ( -5.384 4.928 10.956) 13.164 7.472 ( 2.807 0.974 6.713) 7.342 7.747 ( 1.055 1.409 -6.481) 6.716 8.040 ( 2.099 -11.295 -10.072) 15.279 8.304 ( 5.315 14.601 -7.810) 17.390 9.491 ( -7.559 9.013 10.132) 15.525 9.628 ( -3.442 -5.239 11.669) 13.246 10.116 ( -1.235 -7.836 5.103) 9.432 10.382 ( 7.890 2.941 1.600) 8.571 10.845 ( -4.858 -4.201 0.946) 6.492 11.336 ( -2.720 -2.673 2.348) 4.478 11.371 ( 6.999 -8.744 -6.940) 13.176 11.515 ( -6.039 -3.422 -6.357) 9.412 12.896 ( 2.419 3.027 3.635) 5.313 13.279 ( 4.927 5.373 -6.442) 9.729 13.298 ( -7.094 4.846 -0.678) 8.618 13.854 ( 5.782 2.198 -9.237) 11.117 13.934 ( -2.250 -5.052 3.153) 6.366 14.408 ( 5.334 -6.899 -11.208) 14.201 14.544 ( -4.453 4.940 -4.929) 8.278 15.290 ( 13.080 -2.544 -6.426) 14.794 17.186 ( 2.724 3.392 -3.259) 5.435 17.951 ( -4.073 -0.184 -29.293) 29.575 19.764 ( -4.809 3.927 7.250) 9.545 20.562 ( 7.704 -1.548 -10.563) 13.165 24.947 ( -14.054 -2.084 46.478) 48.601 26.009 ( -2.650 -5.526 27.227) 27.908 27.660 ( 2.114 -2.041 -27.626) 27.782 27.963 ( 8.805 5.151 -21.926) 24.183 ======================= Grid point 427 (214/300) ======================= q-point: (-0.55 -0.55 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.184 ( -10.952 -0.000 12.479) 16.603 2.458 ( -3.820 -0.000 14.237) 14.740 3.275 ( -1.893 -0.000 21.885) 21.967 3.351 ( 0.427 0.000 18.152) 18.157 4.203 ( 4.591 0.000 6.379) 7.859 4.205 ( 9.363 0.000 24.016) 25.776 4.357 ( -6.389 -0.000 18.662) 19.725 4.464 ( -10.853 -0.000 -0.292) 10.857 4.770 ( 7.813 0.000 -2.768) 8.289 5.459 ( 0.774 0.000 -7.858) 7.896 5.468 ( 6.209 0.000 -18.118) 19.153 6.067 ( 4.925 0.000 -19.006) 19.634 6.456 ( 5.769 0.000 12.956) 14.182 6.673 ( -7.114 -0.000 4.432) 8.381 6.991 ( -6.865 -0.000 -3.334) 7.632 7.142 ( -8.081 -0.000 -8.177) 11.496 8.006 ( 2.583 0.000 1.043) 2.786 8.131 ( -5.486 -0.000 1.261) 5.629 9.009 ( 6.795 0.000 21.591) 22.635 10.113 ( 18.409 0.000 -13.677) 22.933 10.390 ( -2.791 -0.000 14.422) 14.690 10.946 ( -16.875 -0.000 -2.179) 17.015 10.960 ( -11.166 -0.000 8.769) 14.198 11.458 ( -0.099 -0.000 -10.819) 10.819 11.672 ( -9.210 -0.000 -0.039) 9.210 12.072 ( 12.182 0.000 -10.149) 15.856 13.009 ( 4.200 0.000 -3.120) 5.233 13.133 ( -2.156 -0.000 -2.461) 3.272 13.273 ( 5.764 0.000 5.758) 8.148 13.541 ( -8.920 -0.000 0.117) 8.921 13.853 ( -3.625 -0.000 3.155) 4.806 14.477 ( -3.039 -0.000 -5.537) 6.316 14.944 ( -7.017 -0.000 21.022) 22.162 15.819 ( 27.615 0.000 -15.801) 31.816 17.694 ( -4.826 -0.000 13.536) 14.370 18.099 ( 17.679 0.000 -5.926) 18.646 19.981 ( -2.028 -0.000 6.009) 6.342 20.640 ( 1.441 0.000 -19.913) 19.965 25.243 ( -7.217 -0.000 44.324) 44.908 27.255 ( -4.640 -0.000 -20.802) 21.313 27.591 ( 0.923 0.000 16.403) 16.429 27.993 ( 13.353 0.000 2.032) 13.507 ======================= Grid point 428 (215/300) ======================= q-point: (-0.45 -0.55 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.079 ( -8.851 3.910 15.125) 17.955 2.492 ( -10.175 -5.158 8.199) 14.048 3.241 ( -3.999 5.357 16.329) 17.644 3.398 ( -1.406 -0.267 24.799) 24.841 3.936 ( 4.255 16.257 12.464) 20.923 4.259 ( -13.639 6.112 2.805) 15.207 4.331 ( 1.229 3.081 9.235) 9.813 4.610 ( 5.671 -12.465 9.837) 16.862 4.932 ( 4.906 -7.405 6.350) 10.919 5.152 ( 2.490 12.616 -17.706) 21.883 5.637 ( 1.569 -0.210 -9.107) 9.244 6.079 ( 4.220 -5.418 -15.882) 17.303 6.594 ( 1.640 2.941 4.458) 5.587 6.682 ( 2.806 -11.097 10.205) 15.335 6.999 ( -4.826 -5.708 -3.016) 8.060 7.145 ( -4.573 -6.117 -8.921) 11.744 8.044 ( 0.586 -3.274 3.178) 4.600 8.179 ( -3.582 -8.145 1.698) 9.058 9.046 ( 3.927 4.008 18.139) 18.987 10.075 ( 13.998 12.531 -12.862) 22.768 10.419 ( -2.023 -1.177 12.810) 13.022 10.757 ( -15.708 5.914 3.036) 17.056 10.871 ( -10.000 3.093 4.558) 11.417 11.430 ( 2.851 2.849 -6.542) 7.684 11.617 ( -6.209 -0.425 -2.616) 6.751 12.087 ( 8.322 4.962 -8.558) 12.927 12.987 ( -1.088 3.474 -2.716) 4.542 13.164 ( -0.815 -5.395 -3.987) 6.758 13.288 ( 5.908 1.136 6.274) 8.693 13.577 ( -2.229 -5.997 0.405) 6.411 13.856 ( -4.192 -2.092 3.929) 6.114 14.311 ( -2.568 10.411 -0.725) 10.748 15.049 ( -8.874 -8.921 13.060) 18.136 15.906 ( 21.665 7.361 -17.117) 28.575 17.614 ( -5.560 5.720 11.829) 14.267 18.188 ( 19.103 2.782 -9.554) 21.539 19.977 ( -3.515 -0.581 5.411) 6.478 20.585 ( -0.438 2.432 -18.343) 18.508 25.246 ( -4.334 3.403 44.720) 45.058 26.982 ( -7.597 17.055 -6.068) 19.632 27.716 ( 3.181 -5.013 2.722) 6.531 28.123 ( 12.150 -3.775 -1.965) 12.874 ======================= Grid point 429 (216/300) ======================= q-point: (-0.36 -0.55 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.005 ( -5.909 0.698 12.813) 14.127 2.515 ( -13.019 -4.975 2.823) 14.221 3.090 ( -6.347 9.018 9.781) 14.740 3.300 ( -5.494 13.576 23.947) 28.071 3.790 ( 5.857 5.496 3.024) 8.582 4.090 ( -6.910 2.560 0.751) 7.407 4.284 ( 2.406 4.411 4.563) 6.788 4.597 ( 1.529 16.801 -4.580) 17.481 5.007 ( 2.062 -6.604 -3.259) 7.648 5.273 ( 1.117 -15.285 8.054) 17.313 5.554 ( 1.946 5.522 -5.565) 8.077 6.232 ( 2.019 -8.183 -11.731) 14.445 6.547 ( -2.330 0.491 6.876) 7.277 6.922 ( 7.078 -6.322 7.609) 12.164 7.111 ( -0.076 -8.252 -3.790) 9.081 7.241 ( -3.158 -7.845 -7.558) 11.342 8.160 ( -0.995 -6.816 8.308) 10.792 8.379 ( -1.768 -14.428 3.167) 14.877 9.001 ( 0.015 2.855 9.313) 9.741 9.838 ( 9.984 18.799 -13.392) 25.148 10.418 ( -6.897 1.430 9.147) 11.545 10.556 ( -9.014 5.353 10.007) 14.493 10.764 ( -2.595 3.250 4.739) 6.305 11.356 ( 2.788 6.455 -2.256) 7.385 11.570 ( -3.277 1.809 -6.688) 7.664 11.983 ( 4.940 9.155 -6.312) 12.168 12.910 ( -2.110 2.277 2.099) 3.747 13.277 ( 4.131 -5.687 -4.361) 8.272 13.373 ( 3.060 -5.486 2.534) 6.774 13.674 ( -0.450 -4.533 -3.178) 5.554 13.875 ( -4.786 -2.706 5.924) 8.082 14.118 ( -1.550 8.326 -0.595) 8.490 15.109 ( -10.668 -2.554 5.641) 12.335 15.779 ( 13.043 15.680 -14.884) 25.250 17.497 ( -4.076 3.996 6.375) 8.557 18.227 ( 20.092 5.721 -16.918) 26.882 19.968 ( -4.807 -0.578 5.135) 7.057 20.497 ( -1.443 2.556 -15.321) 15.600 25.213 ( -2.153 5.846 45.119) 45.548 26.579 ( -11.735 17.632 6.901) 22.276 27.773 ( 5.074 1.196 -7.109) 8.816 28.263 ( 10.506 -2.456 -9.303) 14.247 ======================= Grid point 430 (217/300) ======================= q-point: (-0.27 -0.55 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.010 ( -4.694 -3.298 3.715) 6.835 2.501 ( -12.769 -3.100 -1.544) 13.231 2.833 ( -12.823 12.762 10.382) 20.859 3.050 ( 3.592 12.024 9.485) 15.730 3.656 ( 3.120 11.998 -12.374) 17.516 4.072 ( -1.760 4.909 -2.721) 5.882 4.216 ( 9.976 7.436 -3.765) 12.999 4.286 ( -4.778 6.099 -0.712) 7.780 5.139 ( -2.970 -7.843 3.424) 9.058 5.485 ( 2.318 3.078 -2.460) 4.572 5.586 ( 0.662 -14.791 12.873) 19.620 6.334 ( 1.338 -3.369 -6.147) 7.137 6.578 ( -1.962 -3.116 8.042) 8.845 7.042 ( 0.547 -2.641 8.013) 8.455 7.266 ( 6.032 -6.384 -5.146) 10.179 7.347 ( -3.470 -7.350 -5.288) 9.697 8.209 ( -4.978 3.257 11.545) 12.987 8.667 ( -0.543 -15.819 4.840) 16.552 9.074 ( -1.189 -10.330 0.315) 10.403 9.514 ( 8.401 17.968 -12.720) 23.563 10.246 ( -13.907 8.251 8.552) 18.292 10.528 ( 2.347 -0.177 11.408) 11.649 10.759 ( 4.833 -1.291 5.224) 7.232 11.229 ( 2.640 8.561 0.264) 8.963 11.467 ( -2.985 5.183 -7.864) 9.880 11.821 ( 2.099 9.281 -5.798) 11.143 12.893 ( -0.316 -0.482 4.447) 4.484 13.406 ( 8.290 -3.388 -2.564) 9.315 13.499 ( -3.097 -6.091 -1.039) 6.912 13.701 ( -3.526 -1.302 -6.291) 7.328 13.919 ( -1.359 -2.442 6.314) 6.904 13.990 ( 0.716 3.132 -5.354) 6.244 15.014 ( -11.699 4.506 1.507) 12.627 15.527 ( 8.740 14.928 -10.704) 20.342 17.426 ( -2.400 2.324 -0.212) 3.347 18.195 ( 17.312 8.039 -24.992) 31.447 19.944 ( -5.868 0.226 5.412) 7.985 20.439 ( -0.151 0.062 -11.963) 11.964 25.153 ( -1.895 7.388 44.944) 45.586 26.219 ( -13.184 12.874 16.899) 25.003 27.742 ( 5.630 3.615 -15.175) 16.584 28.301 ( 8.046 3.300 -15.506) 17.778 ======================= Grid point 431 (218/300) ======================= q-point: (-0.18 -0.55 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.043 ( -5.937 -3.151 -5.080) 8.425 2.442 ( -10.095 -0.051 -5.362) 11.431 2.581 ( -8.434 3.694 1.385) 9.311 2.939 ( 8.873 6.500 2.503) 11.280 3.405 ( 4.950 13.743 -17.265) 22.615 3.717 ( 7.068 24.464 -20.833) 32.901 4.169 ( -11.567 -2.262 -4.033) 12.457 4.360 ( 6.124 -5.377 6.856) 10.650 5.280 ( -2.036 -7.153 8.965) 11.648 5.456 ( 1.798 0.839 1.329) 2.388 5.864 ( -0.118 -12.263 12.088) 17.220 6.359 ( 1.522 1.554 -2.089) 3.016 6.632 ( -2.915 -2.556 11.114) 11.771 7.058 ( -4.451 0.958 9.703) 10.718 7.398 ( 4.108 -4.205 -5.624) 8.136 7.481 ( 0.010 -10.210 -4.314) 11.084 8.051 ( -6.659 8.143 5.969) 12.095 8.901 ( 3.041 2.247 -5.557) 6.722 9.126 ( -0.729 -3.591 4.165) 5.547 9.509 ( 4.526 -13.561 -2.094) 14.449 9.992 ( -11.882 10.366 10.557) 18.976 10.566 ( 3.388 1.115 9.479) 10.128 10.875 ( 7.856 -2.879 1.648) 8.527 11.120 ( 6.385 4.110 1.788) 7.801 11.335 ( -5.117 3.613 -8.736) 10.750 11.651 ( -1.269 8.184 -4.842) 9.594 12.924 ( 1.213 -1.254 4.505) 4.831 13.466 ( 6.765 3.366 -1.853) 7.780 13.491 ( -6.595 2.471 -5.986) 9.243 13.715 ( -3.030 -4.938 -1.484) 5.980 13.926 ( 0.766 0.942 -0.349) 1.263 14.051 ( 3.269 -7.649 -9.209) 12.410 14.818 ( -8.663 7.397 -0.989) 11.434 15.359 ( 7.033 7.368 -5.923) 11.783 17.359 ( -0.639 3.312 -4.298) 5.464 18.091 ( 11.086 8.418 -30.775) 33.777 19.891 ( -6.526 1.845 5.814) 8.933 20.457 ( 2.716 -2.844 -9.569) 10.345 25.066 ( -4.747 7.580 45.112) 45.990 25.995 ( -10.761 5.354 23.123) 26.060 27.683 ( 5.388 3.074 -22.298) 23.145 28.217 ( 6.221 7.130 -19.166) 21.375 ======================= Grid point 432 (219/300) ======================= q-point: (-0.09 -0.55 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.027 ( -3.565 -1.911 -6.215) 7.416 2.345 ( -4.348 3.693 -7.476) 9.404 2.629 ( -3.656 -12.169 -12.685) 17.954 2.908 ( 8.747 4.506 -7.646) 12.461 3.187 ( 12.899 13.523 -11.419) 21.901 3.316 ( 4.725 15.268 -22.606) 27.685 4.126 ( -10.548 -2.381 -5.428) 12.099 4.503 ( 2.380 -5.204 5.148) 7.697 5.329 ( 2.215 3.357 5.336) 6.682 5.541 ( -1.338 -8.122 8.338) 11.717 6.076 ( -0.727 -8.285 10.377) 13.298 6.272 ( -1.436 7.562 3.501) 8.456 6.671 ( -2.681 -1.455 12.182) 12.558 6.992 ( -5.444 3.679 10.557) 12.435 7.465 ( -0.818 -2.580 -1.839) 3.272 7.689 ( 2.435 -9.099 -2.580) 9.766 7.920 ( 0.064 0.516 -4.509) 4.539 8.630 ( 2.766 17.926 -11.904) 21.695 9.381 ( -0.191 -13.485 13.395) 19.008 9.701 ( -5.715 7.760 11.820) 15.251 9.858 ( -2.110 -13.273 1.056) 13.481 10.548 ( 1.852 4.629 8.263) 9.650 10.872 ( 6.057 6.262 -2.397) 9.036 11.230 ( 3.358 -5.592 0.636) 6.554 11.262 ( -3.087 -3.240 -10.237) 11.173 11.504 ( -1.655 4.322 -1.947) 5.021 12.955 ( 2.340 0.431 3.609) 4.322 13.339 ( -8.508 5.523 -3.379) 10.692 13.411 ( 5.894 5.620 -4.935) 9.522 13.816 ( -1.767 -6.377 1.248) 6.734 13.899 ( 1.850 1.660 -6.013) 6.506 14.240 ( 3.847 -10.707 -11.287) 16.026 14.639 ( -2.129 7.140 -4.391) 8.648 15.326 ( 5.336 0.277 -1.775) 5.630 17.285 ( 2.499 4.022 -5.907) 7.571 17.945 ( 3.677 6.700 -32.161) 33.056 19.809 ( -5.438 3.161 5.989) 8.685 20.537 ( 4.851 -3.963 -8.739) 10.752 24.973 ( -9.040 5.077 45.982) 47.136 25.947 ( -6.932 -2.124 26.092) 27.081 27.630 ( 3.823 1.579 -27.715) 28.022 28.094 ( 7.101 6.475 -20.360) 22.514 ======================= Grid point 439 (220/300) ======================= q-point: (-0.45 -0.45 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.065 ( -12.187 -0.000 15.271) 19.538 2.371 ( -13.330 -0.000 9.866) 16.583 3.327 ( -2.680 -0.000 27.624) 27.754 3.395 ( -2.788 -0.000 20.119) 20.312 4.186 ( -13.377 -0.000 13.284) 18.852 4.197 ( -18.571 -0.000 9.854) 21.023 4.383 ( 4.215 0.000 9.786) 10.655 4.488 ( 10.771 0.000 8.733) 13.867 4.870 ( 6.088 0.000 -1.011) 6.171 5.436 ( 1.175 0.000 -10.387) 10.453 5.492 ( 5.369 0.000 -16.543) 17.392 6.071 ( 5.024 0.000 -19.388) 20.028 6.588 ( 0.058 0.000 12.940) 12.940 6.664 ( 8.615 0.000 7.587) 11.480 6.912 ( -2.206 -0.000 -3.806) 4.399 7.041 ( -1.441 -0.000 -10.127) 10.229 8.046 ( 2.829 0.000 0.679) 2.910 8.055 ( -5.672 -0.000 1.815) 5.955 9.152 ( 3.170 0.000 18.318) 18.590 10.256 ( 6.454 0.000 -17.053) 18.234 10.409 ( -1.763 -0.000 14.806) 14.910 10.712 ( -12.079 -0.000 -1.939) 12.234 10.844 ( -9.175 -0.000 11.534) 14.738 11.482 ( 7.710 0.000 -8.471) 11.454 11.552 ( -8.186 -0.000 0.788) 8.224 12.176 ( 7.225 0.000 -9.276) 11.758 13.025 ( -8.944 -0.000 -4.698) 10.103 13.070 ( 5.958 0.000 -2.676) 6.532 13.368 ( 4.325 0.000 6.247) 7.598 13.494 ( -0.170 -0.000 1.171) 1.183 13.818 ( -3.382 -0.000 4.547) 5.667 14.400 ( -5.133 -0.000 -5.453) 7.489 14.916 ( -6.635 -0.000 19.774) 20.858 16.107 ( 21.407 0.000 -18.546) 28.323 17.650 ( -7.416 -0.000 11.784) 13.924 18.313 ( 15.135 0.000 -8.297) 17.260 19.950 ( -4.989 -0.000 5.406) 7.356 20.572 ( -1.454 -0.000 -18.211) 18.269 25.334 ( -1.498 -0.000 43.584) 43.610 27.127 ( -3.349 -0.000 -20.150) 20.426 27.650 ( -0.050 -0.000 13.441) 13.441 28.169 ( 10.603 0.000 0.269) 10.606 ======================= Grid point 440 (221/300) ======================= q-point: (-0.36 -0.45 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.994 ( -10.400 1.134 16.807) 19.797 2.326 ( -16.048 -4.181 7.243) 18.097 3.234 ( -6.072 8.759 18.938) 21.731 3.450 ( -3.800 1.119 28.843) 29.114 3.961 ( -7.360 9.756 9.721) 15.616 4.044 ( -17.505 2.098 3.871) 18.050 4.386 ( 2.583 3.124 9.617) 10.437 4.708 ( 4.488 -7.445 4.835) 9.947 5.006 ( 1.531 -8.752 6.277) 10.878 5.129 ( 3.187 14.965 -17.780) 23.456 5.659 ( 6.123 -1.055 -9.421) 11.285 6.079 ( 3.889 -4.518 -17.575) 18.558 6.575 ( -3.078 2.599 8.448) 9.360 6.862 ( 12.706 -8.701 8.978) 17.825 6.958 ( 0.363 -6.004 -1.885) 6.303 7.087 ( 1.402 -5.872 -10.214) 11.864 8.045 ( -2.483 -3.814 4.137) 6.151 8.159 ( 0.710 -8.660 1.141) 8.764 9.130 ( -0.240 6.229 12.889) 14.318 10.131 ( -1.840 9.874 -16.364) 19.200 10.424 ( -3.617 0.945 11.055) 11.670 10.590 ( -5.919 4.780 5.330) 9.289 10.806 ( -2.963 1.308 11.054) 11.518 11.465 ( -0.990 3.264 0.087) 3.412 11.549 ( 3.435 -0.884 -8.120) 8.861 12.151 ( 4.634 5.583 -7.701) 10.581 12.926 ( -5.353 2.129 -2.012) 6.102 13.171 ( 3.485 -5.583 -3.627) 7.514 13.381 ( 4.936 0.756 5.076) 7.121 13.568 ( -0.225 -5.453 -0.997) 5.548 13.811 ( -4.607 -1.179 5.705) 7.427 14.265 ( -3.360 7.773 -1.530) 8.605 14.970 ( -8.116 -5.238 12.461) 15.766 16.111 ( 15.768 10.777 -18.696) 26.727 17.559 ( -7.262 4.771 9.763) 13.069 18.388 ( 13.547 1.263 -12.379) 18.395 19.924 ( -6.330 -0.458 5.200) 8.205 20.507 ( -1.929 2.054 -16.083) 16.328 25.375 ( 0.918 3.386 43.193) 43.336 26.858 ( -6.841 18.160 -5.780) 20.248 27.756 ( 1.760 -5.157 -0.483) 5.470 28.266 ( 9.098 -2.888 -3.221) 10.074 ======================= Grid point 441 (222/300) ======================= q-point: (-0.27 -0.45 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.947 ( -8.511 -0.372 13.914) 16.315 2.313 ( -16.031 -5.401 3.480) 17.271 2.996 ( -12.974 12.381 14.011) 22.758 3.312 ( -4.166 12.537 22.007) 25.668 3.820 ( -1.432 5.646 -4.356) 7.273 3.974 ( -10.366 -4.448 7.657) 13.633 4.341 ( 2.839 4.517 4.792) 7.171 4.630 ( 5.917 18.717 -6.219) 20.592 4.980 ( -3.011 -5.097 -4.965) 7.726 5.279 ( -3.526 -14.748 6.225) 16.391 5.636 ( 10.233 5.069 -4.140) 12.147 6.218 ( 2.002 -8.395 -12.309) 15.033 6.541 ( -1.392 -0.170 7.385) 7.517 7.017 ( 2.543 -2.722 5.338) 6.509 7.155 ( 5.787 -8.882 -2.360) 10.861 7.211 ( 3.334 -6.327 -4.289) 8.339 8.147 ( -5.133 -6.526 8.768) 12.075 8.393 ( 2.675 -14.345 2.750) 14.849 9.013 ( -2.033 4.127 3.861) 6.006 9.848 ( -2.207 14.949 -16.470) 22.353 10.305 ( -9.780 6.895 9.305) 15.158 10.558 ( 1.984 -0.204 12.795) 12.950 10.800 ( 3.524 0.852 9.613) 10.274 11.369 ( -3.880 5.390 2.544) 7.112 11.544 ( 6.482 4.088 -11.020) 13.423 12.018 ( 2.758 9.836 -5.289) 11.503 12.881 ( -2.085 -0.279 1.395) 2.524 13.299 ( -0.400 -7.505 -5.539) 9.336 13.451 ( 7.359 -2.256 4.530) 8.931 13.627 ( -3.690 -2.145 -7.104) 8.288 13.837 ( -4.462 -4.405 7.954) 10.128 14.105 ( -0.208 7.391 -0.107) 7.395 14.980 ( -9.351 -0.370 4.881) 10.555 15.881 ( 8.256 18.080 -15.819) 25.403 17.451 ( -4.887 3.078 4.534) 7.343 18.397 ( 12.572 5.033 -19.703) 23.908 19.895 ( -7.151 -0.743 4.641) 8.557 20.435 ( -0.689 1.494 -12.269) 12.379 25.369 ( 2.521 6.610 42.878) 43.458 26.440 ( -11.945 18.179 9.416) 23.703 27.799 ( 3.118 0.992 -11.851) 12.295 28.359 ( 7.330 -0.748 -10.006) 12.426 ======================= Grid point 442 (223/300) ======================= q-point: (-0.18 -0.45 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.930 ( -8.210 -2.342 4.419) 9.613 2.303 ( -13.895 -4.438 -0.184) 14.588 2.672 ( -15.073 11.983 11.688) 22.525 3.126 ( 2.458 8.488 7.857) 11.824 3.646 ( 1.772 11.459 -14.000) 18.178 3.995 ( -7.793 -2.375 -0.359) 8.154 4.243 ( 4.711 21.756 -11.607) 25.104 4.345 ( 5.162 0.219 4.115) 6.605 5.098 ( -5.058 -9.809 6.710) 12.916 5.463 ( -2.076 -4.671 -2.476) 5.680 5.692 ( 6.020 -6.042 9.546) 12.801 6.339 ( 2.504 -4.466 -6.780) 8.497 6.584 ( -0.755 -2.840 8.179) 8.690 7.057 ( -1.536 0.137 7.275) 7.437 7.293 ( -0.050 -5.579 -6.807) 8.801 7.359 ( 5.967 -6.277 0.874) 8.705 8.132 ( -10.697 4.412 10.216) 15.435 8.715 ( 4.886 -16.127 4.604) 17.468 9.053 ( -1.650 -7.506 -4.092) 8.707 9.540 ( 1.373 11.933 -12.910) 17.634 10.108 ( -9.963 8.555 12.626) 18.217 10.616 ( 4.586 -0.384 11.071) 11.990 10.876 ( 8.222 -2.906 7.111) 11.252 11.231 ( -5.991 5.337 5.126) 9.521 11.447 ( 7.618 8.983 -12.581) 17.233 11.823 ( 0.518 11.034 -3.888) 11.711 12.906 ( 1.101 -2.013 2.660) 3.513 13.399 ( -7.025 -5.456 -5.985) 10.721 13.557 ( 10.241 -0.970 2.780) 10.656 13.593 ( -7.359 -1.557 -7.845) 10.868 13.914 ( -3.298 -4.225 5.297) 7.536 14.008 ( 3.618 2.813 -3.768) 5.933 14.875 ( -7.763 4.848 0.704) 9.180 15.582 ( 3.939 14.233 -11.626) 18.795 17.382 ( -3.311 1.917 -1.028) 3.961 18.306 ( 11.414 9.343 -26.790) 30.582 19.864 ( -6.748 -0.233 4.112) 7.906 20.415 ( 1.063 -1.337 -8.753) 8.918 25.303 ( 1.485 10.147 42.940) 44.147 26.093 ( -13.703 10.900 19.864) 26.480 27.747 ( 3.882 3.624 -19.841) 20.539 28.341 ( 4.933 4.728 -15.567) 17.001 ======================= Grid point 443 (224/300) ======================= q-point: (-0.09 -0.45 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.925 ( -8.161 -3.262 -3.939) 9.631 2.282 ( -9.951 -2.688 -2.645) 10.642 2.467 ( -7.922 0.523 -0.382) 7.948 3.045 ( 5.695 4.751 -1.687) 7.606 3.406 ( 3.350 11.826 -18.561) 22.262 3.789 ( 11.888 25.751 -17.076) 33.106 3.995 ( -9.688 -2.670 -5.480) 11.446 4.438 ( 1.742 -4.340 7.258) 8.634 5.277 ( -3.643 -10.141 10.444) 15.006 5.474 ( 0.832 0.660 -0.848) 1.359 5.910 ( 0.549 -10.753 11.687) 15.891 6.376 ( 1.677 2.288 -1.953) 3.444 6.641 ( -1.249 -2.123 12.121) 12.369 7.020 ( -5.366 2.106 9.723) 11.303 7.370 ( -2.392 -4.723 -6.059) 8.046 7.538 ( 5.731 -8.678 0.087) 10.400 7.961 ( -7.606 5.373 3.028) 9.792 8.907 ( 0.331 9.899 -12.139) 15.667 9.138 ( 0.534 -13.901 8.390) 16.246 9.565 ( 4.235 -11.802 -2.506) 12.787 9.891 ( -7.875 10.123 13.749) 18.803 10.641 ( 2.163 3.243 11.249) 11.905 10.989 ( 5.515 -0.703 2.085) 5.937 11.161 ( -4.390 -0.982 1.592) 4.772 11.313 ( 11.185 7.736 -10.438) 17.143 11.614 ( -2.003 9.404 -2.367) 9.902 12.963 ( 2.915 -1.688 1.711) 3.778 13.346 ( -10.466 2.453 -4.375) 11.606 13.532 ( 0.729 3.219 -3.489) 4.802 13.685 ( 2.665 -5.926 -2.921) 7.124 13.925 ( -1.769 0.882 -0.849) 2.152 14.077 ( 4.476 -6.999 -6.902) 10.801 14.735 ( -2.369 5.278 -2.101) 6.155 15.394 ( 0.676 6.125 -6.439) 8.912 17.323 ( -2.431 1.701 -4.308) 5.231 18.132 ( 10.638 11.796 -31.354) 35.148 19.820 ( -5.312 1.157 4.500) 7.057 20.467 ( 2.108 -4.228 -7.447) 8.819 25.163 ( -3.668 11.468 44.156) 45.768 25.927 ( -10.618 1.982 25.128) 27.351 27.666 ( 4.558 3.710 -26.371) 27.018 28.226 ( 3.906 6.819 -18.399) 20.007 ======================= Grid point 451 (225/300) ======================= q-point: (-0.36 -0.36 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.957 ( -10.937 -0.000 18.439) 21.438 2.181 ( -17.562 -0.000 10.360) 20.390 3.382 ( -3.956 -0.000 29.231) 29.498 3.420 ( -4.271 -0.000 21.791) 22.206 3.929 ( -20.843 -0.000 3.822) 21.190 3.968 ( -23.992 -0.000 19.603) 30.982 4.484 ( 5.241 0.000 5.067) 7.290 4.640 ( 5.299 0.000 8.964) 10.413 4.928 ( 3.088 0.000 -1.614) 3.485 5.436 ( 4.260 0.000 -11.746) 12.495 5.506 ( 4.574 0.000 -15.656) 16.311 6.074 ( 4.941 0.000 -20.034) 20.635 6.613 ( -0.222 -0.000 12.472) 12.474 6.874 ( 12.828 0.000 11.202) 17.030 6.912 ( 3.828 0.000 -1.934) 4.289 7.033 ( 5.912 0.000 -13.041) 14.319 7.992 ( -4.104 -0.000 2.776) 4.955 8.096 ( 4.082 0.000 0.705) 4.142 9.206 ( -3.364 -0.000 10.384) 10.916 10.107 ( -16.998 -0.000 -16.117) 23.425 10.430 ( -2.987 -0.000 15.347) 15.635 10.671 ( 5.824 0.000 -4.408) 7.304 10.811 ( -1.964 -0.000 18.474) 18.578 11.443 ( -7.209 -0.000 0.295) 7.215 11.604 ( 12.815 0.000 -7.470) 14.833 12.215 ( 2.540 0.000 -8.211) 8.595 12.899 ( -5.861 -0.000 -3.922) 7.053 13.143 ( 4.035 0.000 -1.856) 4.441 13.448 ( 4.953 0.000 5.949) 7.741 13.496 ( -0.434 -0.000 -1.066) 1.151 13.784 ( -4.119 -0.000 5.538) 6.902 14.301 ( -5.791 -0.000 -5.076) 7.701 14.898 ( -4.696 -0.000 17.211) 17.841 16.295 ( 14.594 0.000 -21.241) 25.771 17.570 ( -8.845 -0.000 9.673) 13.107 18.445 ( 7.305 0.000 -10.451) 12.751 19.882 ( -6.945 -0.000 5.426) 8.813 20.482 ( -2.683 -0.000 -15.636) 15.865 25.493 ( 2.888 0.000 41.608) 41.708 27.024 ( -1.541 -0.000 -18.636) 18.699 27.677 ( -1.569 -0.000 8.793) 8.932 28.289 ( 6.566 0.000 -2.166) 6.914 ======================= Grid point 452 (226/300) ======================= q-point: (-0.27 -0.36 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.913 ( -9.601 0.381 19.539) 21.774 2.113 ( -17.455 -3.995 9.540) 20.290 3.170 ( -13.086 13.461 17.410) 25.604 3.497 ( -4.185 4.064 30.849) 31.396 3.802 ( -19.619 -3.897 7.032) 21.202 3.829 ( -12.285 0.482 8.764) 15.098 4.461 ( 2.965 4.563 7.337) 9.135 4.766 ( 1.652 -5.005 2.670) 5.908 5.017 ( -2.051 -6.059 4.264) 7.688 5.131 ( 6.077 15.944 -17.028) 24.106 5.728 ( 7.458 -5.396 -10.117) 13.678 6.071 ( 3.984 -3.115 -18.561) 19.238 6.589 ( 0.516 3.660 10.542) 11.171 6.984 ( 4.202 -3.421 0.889) 5.491 7.054 ( 7.702 -6.133 5.338) 11.200 7.133 ( 10.854 -6.476 -7.630) 14.764 8.014 ( -3.710 -4.313 5.435) 7.868 8.206 ( 5.075 -8.294 0.600) 9.742 9.110 ( -7.286 6.582 4.202) 10.681 9.914 ( -18.088 3.593 -15.220) 23.911 10.397 ( -5.045 4.631 12.880) 14.587 10.643 ( 7.624 4.534 5.786) 10.590 10.856 ( 3.165 -0.034 14.486) 14.828 11.387 ( -6.533 1.492 0.594) 6.728 11.667 ( 13.649 2.367 -8.319) 16.158 12.166 ( 1.077 4.999 -6.639) 8.380 12.860 ( -2.293 -0.188 -1.983) 3.037 13.183 ( -1.486 -3.024 -3.485) 4.848 13.480 ( 4.868 -0.872 2.799) 5.683 13.552 ( 0.609 -3.340 -0.972) 3.532 13.760 ( -5.624 -0.563 6.142) 8.347 14.212 ( -2.928 4.357 -1.481) 5.454 14.915 ( -5.103 -1.434 10.976) 12.188 16.215 ( 8.185 13.334 -20.921) 26.124 17.484 ( -7.236 3.417 7.636) 11.061 18.470 ( 4.113 -0.266 -13.659) 14.267 19.844 ( -7.054 -0.344 5.055) 8.685 20.428 ( -1.843 0.943 -13.210) 13.371 25.560 ( 4.384 3.179 40.425) 40.786 26.751 ( -6.036 20.084 -3.177) 21.211 27.760 ( 0.353 -4.970 -5.678) 7.555 28.351 ( 4.853 -2.594 -5.472) 7.760 ======================= Grid point 453 (227/300) ======================= q-point: (-0.18 -0.36 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.870 ( -9.421 0.494 16.438) 18.952 2.104 ( -15.483 -5.746 6.361) 17.698 2.818 ( -18.473 13.708 13.013) 26.429 3.322 ( -4.669 10.865 17.161) 20.841 3.762 ( -3.515 2.258 -0.866) 4.267 3.852 ( -10.327 -6.300 7.055) 14.003 4.392 ( 1.905 4.804 4.223) 6.674 4.711 ( 7.718 19.419 -6.970) 22.028 4.907 ( -4.982 -5.520 -2.058) 7.716 5.246 ( -2.661 -12.548 3.685) 13.346 5.761 ( 8.595 3.378 -5.301) 10.648 6.208 ( 2.728 -9.291 -12.818) 16.064 6.569 ( 1.772 0.388 8.621) 8.810 7.063 ( 2.511 -1.309 3.446) 4.460 7.190 ( 2.457 -5.103 -3.213) 6.511 7.319 ( 9.205 -4.306 2.310) 10.422 8.078 ( -8.855 -3.558 9.544) 13.496 8.472 ( 7.031 -14.496 1.929) 16.226 8.958 ( -6.096 1.353 -3.547) 7.181 9.674 ( -13.290 7.029 -14.630) 20.978 10.243 ( -4.926 9.116 13.337) 16.889 10.672 ( 7.561 0.568 10.765) 13.167 10.915 ( 7.180 -0.778 12.081) 14.075 11.277 ( -8.380 4.959 2.167) 9.975 11.663 ( 13.510 6.981 -9.901) 18.146 12.026 ( 0.833 9.635 -4.287) 10.579 12.879 ( 1.561 -2.132 0.431) 2.678 13.223 ( -6.952 -5.519 -5.775) 10.590 13.500 ( -6.505 -0.867 -7.730) 10.140 13.627 ( 10.308 -0.997 4.348) 11.232 13.784 ( -7.118 -5.670 6.791) 11.355 14.111 ( 0.961 5.315 0.322) 5.411 14.891 ( -5.105 1.679 3.747) 6.551 15.893 ( 1.415 18.814 -17.816) 25.949 17.398 ( -4.182 2.463 3.376) 5.913 18.448 ( 4.560 3.123 -19.714) 20.474 19.816 ( -5.742 -0.712 3.845) 6.947 20.389 ( -0.531 -0.060 -9.865) 9.879 25.573 ( 5.833 7.061 39.671) 40.714 26.303 ( -13.231 19.428 14.014) 27.366 27.784 ( 2.160 0.881 -17.154) 17.312 28.395 ( 2.877 0.374 -11.724) 12.077 ======================= Grid point 454 (228/300) ======================= q-point: (-0.09 -0.36 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.818 ( -9.980 -0.496 6.478) 11.908 2.123 ( -12.050 -5.749 3.769) 13.873 2.496 ( -14.356 8.911 8.471) 18.902 3.163 ( -0.209 6.005 3.129) 6.775 3.623 ( 1.645 11.120 -11.094) 15.793 3.874 ( -8.058 -3.189 -1.811) 8.854 4.300 ( 7.984 20.515 -10.898) 24.564 4.409 ( 2.253 2.050 2.526) 3.957 5.047 ( -6.171 -11.236 10.098) 16.319 5.432 ( -1.216 -7.054 -0.422) 7.170 5.790 ( 3.992 -3.263 4.869) 7.092 6.353 ( 2.690 -5.369 -7.536) 9.636 6.623 ( 2.169 -2.054 10.093) 10.526 7.055 ( -2.356 3.220 7.529) 8.521 7.269 ( -1.272 -3.638 -3.582) 5.262 7.452 ( 6.391 -4.847 2.220) 8.322 7.995 ( -12.364 4.257 8.401) 15.543 8.824 ( 7.814 -16.458 3.971) 18.647 8.978 ( -5.902 -3.908 -10.393) 12.575 9.476 ( -4.181 1.356 -9.013) 10.027 10.057 ( -4.500 9.831 15.894) 19.222 10.734 ( 6.729 1.105 10.791) 12.765 11.018 ( 5.749 0.363 6.433) 8.635 11.131 ( -6.344 1.308 4.630) 7.962 11.570 ( 13.442 10.518 -9.992) 19.778 11.813 ( -0.233 12.418 -2.867) 12.747 12.948 ( 3.707 -2.534 0.719) 4.548 13.251 ( -10.303 -3.810 -5.993) 12.513 13.453 ( -7.969 -3.007 -8.210) 11.830 13.710 ( 8.575 0.462 1.262) 8.679 13.857 ( -5.930 -5.023 4.876) 9.175 14.056 ( 4.415 1.431 -2.822) 5.432 14.803 ( -2.889 4.333 -0.218) 5.212 15.555 ( -1.217 13.257 -14.317) 19.550 17.333 ( -3.034 2.308 -0.212) 3.818 18.347 ( 7.614 7.907 -26.070) 28.286 19.798 ( -4.267 -0.353 3.636) 5.617 20.396 ( 0.193 -2.578 -7.890) 8.302 25.484 ( 3.201 14.350 40.703) 43.277 25.965 ( -15.069 7.801 23.935) 29.340 27.724 ( 4.029 3.445 -24.112) 24.688 28.327 ( 0.795 5.110 -16.400) 17.196 ======================= Grid point 463 (229/300) ======================= q-point: (-0.27 -0.27 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.891 ( -7.778 -0.000 21.204) 22.586 1.966 ( -18.166 -0.000 13.729) 22.770 3.371 ( -14.970 -0.000 14.850) 21.086 3.374 ( -13.683 -0.000 23.730) 27.392 3.705 ( -9.956 -0.000 9.388) 13.684 3.708 ( -19.635 -0.000 27.344) 33.663 4.550 ( 1.081 0.000 6.034) 6.130 4.697 ( -0.391 -0.000 5.957) 5.970 4.962 ( 3.452 0.000 -3.679) 5.045 5.473 ( 6.688 0.000 -12.305) 14.005 5.516 ( 4.520 0.000 -15.437) 16.085 6.071 ( 4.603 0.000 -20.659) 21.165 6.673 ( 1.852 0.000 15.181) 15.294 7.000 ( 7.919 0.000 1.568) 8.073 7.065 ( 7.756 0.000 11.231) 13.649 7.124 ( 14.382 0.000 -16.033) 21.538 7.963 ( -1.487 -0.000 3.885) 4.160 8.168 ( 5.792 0.000 0.400) 5.806 9.110 ( -13.299 -0.000 0.875) 13.328 9.754 ( -23.885 -0.000 -14.540) 27.962 10.435 ( -4.510 -0.000 19.906) 20.411 10.764 ( 8.865 0.000 -6.830) 11.190 10.906 ( 4.503 0.000 20.245) 20.740 11.370 ( -2.112 -0.000 1.222) 2.440 11.777 ( 14.545 0.000 -7.082) 16.177 12.196 ( -1.197 -0.000 -6.894) 6.997 12.841 ( -0.684 -0.000 -3.012) 3.088 13.138 ( -3.567 -0.000 -3.290) 4.853 13.456 ( -4.346 -0.000 -4.623) 6.345 13.559 ( 5.158 0.000 8.693) 10.108 13.747 ( -1.748 -0.000 4.182) 4.532 14.216 ( -3.559 -0.000 -3.064) 4.697 14.905 ( -1.930 -0.000 13.736) 13.871 16.363 ( 5.585 0.000 -24.157) 24.795 17.479 ( -7.747 -0.000 8.185) 11.269 18.436 ( -3.600 -0.000 -10.309) 10.920 19.797 ( -7.690 -0.000 5.992) 9.749 20.402 ( -1.110 -0.000 -13.155) 13.201 25.686 ( 4.147 0.000 38.369) 38.593 26.956 ( 0.530 0.000 -16.372) 16.380 27.664 ( -3.343 -0.000 3.291) 4.691 28.339 ( 2.190 0.000 -4.863) 5.333 ======================= Grid point 464 (230/300) ======================= q-point: (-0.18 -0.27 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.859 ( -9.054 0.858 22.447) 24.219 1.915 ( -14.776 -3.780 13.056) 20.076 2.967 ( -21.896 15.367 12.426) 29.496 3.489 ( -18.131 5.446 13.077) 23.009 3.583 ( -7.603 -9.262 24.185) 26.991 3.756 ( -3.558 -2.808 13.942) 14.660 4.505 ( -0.354 4.462 7.149) 8.435 4.772 ( -1.484 -4.796 0.868) 5.094 4.990 ( -2.586 0.248 1.077) 2.813 5.191 ( 9.977 13.314 -14.973) 22.383 5.784 ( 5.388 -8.707 -11.234) 15.200 6.065 ( 4.306 -2.334 -18.954) 19.576 6.661 ( 3.833 4.414 13.074) 14.321 7.063 ( 5.568 -1.119 2.795) 6.330 7.147 ( 4.971 -2.288 1.788) 5.757 7.305 ( 14.725 -6.456 -3.840) 16.531 7.984 ( -3.455 -1.973 6.513) 7.632 8.299 ( 7.636 -9.221 -0.112) 11.972 8.942 ( -16.410 4.378 -4.000) 17.448 9.569 ( -22.708 -0.599 -13.738) 26.547 10.384 ( -4.523 5.758 18.775) 20.152 10.784 ( 9.779 2.549 0.411) 10.114 10.976 ( 5.723 -0.371 15.036) 16.093 11.331 ( -0.747 4.615 3.385) 5.772 11.842 ( 14.349 2.957 -7.913) 16.651 12.142 ( -1.290 3.613 -5.629) 6.812 12.855 ( 2.452 -1.605 -1.777) 3.427 13.104 ( -7.098 -1.120 -4.883) 8.688 13.418 ( -7.898 -1.017 -7.852) 11.183 13.630 ( -3.290 -4.580 8.564) 10.254 13.735 ( 5.916 2.434 4.454) 7.795 14.184 ( -0.438 1.783 0.370) 1.872 14.902 ( -1.771 1.429 8.494) 8.793 16.189 ( -1.436 14.849 -22.956) 27.378 17.420 ( -4.710 2.073 6.674) 8.428 18.413 ( -5.420 -2.906 -11.789) 13.296 19.765 ( -6.581 -1.058 5.400) 8.578 20.372 ( 0.316 0.450 -11.696) 11.709 25.758 ( 3.938 2.132 36.586) 36.859 26.667 ( -5.154 23.126 1.044) 23.717 27.729 ( -0.554 -5.161 -11.052) 12.211 28.364 ( 0.317 -2.270 -8.162) 8.478 ======================= Grid point 465 (231/300) ======================= q-point: (-0.09 -0.27 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.803 ( -8.709 3.313 19.863) 21.940 1.924 ( -13.886 -6.546 10.539) 18.621 2.586 ( -18.179 11.174 8.298) 22.895 3.279 ( -7.998 7.511 9.172) 14.300 3.724 ( -6.457 -7.057 10.249) 14.019 3.770 ( -0.736 3.106 3.398) 4.662 4.418 ( -0.351 4.334 4.492) 6.251 4.758 ( 2.004 17.551 -12.562) 21.676 4.854 ( -2.315 -5.428 6.682) 8.915 5.246 ( 1.899 -9.408 0.671) 9.621 5.831 ( 4.315 2.238 -6.981) 8.506 6.204 ( 3.051 -9.915 -13.418) 16.961 6.657 ( 5.826 1.399 11.274) 12.767 7.105 ( 0.409 0.741 4.437) 4.517 7.210 ( 0.677 -1.589 1.547) 2.319 7.465 ( 10.825 -1.229 0.840) 10.927 7.968 ( -10.921 0.763 9.690) 14.620 8.591 ( 8.508 -14.467 1.086) 16.818 8.817 ( -9.960 -4.522 -10.199) 14.955 9.406 ( -17.526 -0.196 -11.249) 20.826 10.242 ( -2.984 9.141 17.553) 20.014 10.826 ( 9.485 1.097 5.767) 11.155 11.073 ( 7.891 -2.781 11.649) 14.342 11.186 ( -4.385 9.471 5.381) 11.743 11.827 ( 13.698 7.876 -9.356) 18.363 12.018 ( 0.216 8.752 -3.674) 9.495 12.927 ( 4.813 -2.941 -0.048) 5.641 13.078 ( -9.730 -4.118 -6.887) 12.611 13.349 ( -9.134 -0.587 -10.295) 13.775 13.675 ( -10.069 -4.866 3.148) 11.618 13.805 ( 10.172 -1.304 8.003) 13.009 14.135 ( 2.064 3.848 1.363) 4.574 14.855 ( -2.079 3.103 2.314) 4.394 15.803 ( -4.197 17.567 -20.332) 27.195 17.367 ( -1.831 2.562 4.259) 5.297 18.403 ( -1.466 -0.697 -17.417) 17.493 19.758 ( -4.724 -1.436 4.466) 6.657 20.355 ( 1.031 -0.361 -10.282) 10.340 25.791 ( 5.597 4.844 35.345) 36.111 26.162 ( -14.454 23.161 20.375) 34.066 27.750 ( 2.591 0.322 -21.171) 21.332 28.358 ( -1.758 1.146 -13.860) 14.018 ======================= Grid point 475 (232/300) ======================= q-point: (-0.18 -0.18 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.769 ( -17.166 -0.000 17.573) 24.565 1.885 ( -3.861 -0.000 22.601) 22.928 3.113 ( -22.073 -0.000 2.687) 22.236 3.129 ( -26.859 -0.000 20.064) 33.526 3.663 ( -4.552 -0.000 32.131) 32.452 3.708 ( -0.323 -0.000 20.741) 20.743 4.559 ( -2.771 -0.000 7.890) 8.362 4.686 ( -2.888 -0.000 3.660) 4.662 4.999 ( 3.742 0.000 -5.421) 6.587 5.528 ( 4.783 0.000 -15.855) 16.561 5.534 ( 7.610 0.000 -12.797) 14.889 6.063 ( 4.456 0.000 -20.921) 21.390 6.768 ( 3.514 0.000 18.082) 18.421 7.127 ( 8.865 0.000 1.780) 9.041 7.154 ( -0.703 -0.000 10.645) 10.669 7.338 ( 23.202 0.000 -14.614) 27.421 7.977 ( 1.218 0.000 4.706) 4.861 8.253 ( 5.111 0.000 -0.211) 5.116 8.835 ( -23.788 -0.000 -5.062) 24.320 9.351 ( -25.480 -0.000 -14.390) 29.263 10.444 ( -4.942 -0.000 23.507) 24.021 10.865 ( 8.927 0.000 -7.488) 11.652 11.030 ( 3.990 0.000 12.602) 13.218 11.437 ( 10.234 0.000 7.299) 12.570 11.943 ( 10.616 0.000 -6.212) 12.300 12.146 ( -1.560 -0.000 -6.303) 6.494 12.859 ( 4.517 0.000 -2.438) 5.133 13.036 ( -7.959 -0.000 -5.161) 9.486 13.334 ( -9.657 -0.000 -7.932) 12.497 13.553 ( -8.430 -0.000 6.167) 10.445 13.837 ( 9.697 0.000 6.742) 11.810 14.192 ( 0.786 0.000 0.166) 0.803 14.935 ( 0.065 0.000 10.100) 10.100 16.272 ( -6.852 -0.000 -25.337) 26.248 17.421 ( -4.134 -0.000 8.182) 9.166 18.286 ( -12.508 -0.000 -6.022) 13.882 19.713 ( -6.948 -0.000 6.804) 9.725 20.367 ( 2.579 0.000 -12.565) 12.827 25.851 ( 0.338 0.000 34.679) 34.681 26.928 ( 2.816 0.000 -13.546) 13.836 27.607 ( -5.078 -0.000 -1.096) 5.195 28.319 ( -1.790 -0.000 -7.497) 7.708 ======================= Grid point 476 (233/300) ======================= q-point: (-0.09 -0.18 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.730 ( -15.116 -4.976 17.803) 23.879 1.870 ( -4.126 3.670 23.498) 24.138 2.689 ( -20.567 13.463 8.789) 26.105 3.220 ( -19.929 -8.266 6.524) 22.540 3.632 ( -2.402 1.503 29.155) 29.292 3.798 ( 0.914 -2.124 17.682) 17.833 4.505 ( -2.979 3.809 7.656) 9.055 4.739 ( -3.194 -4.392 0.623) 5.466 4.960 ( -1.418 4.823 -1.792) 5.337 5.291 ( 10.493 10.303 -14.034) 20.328 5.801 ( 2.746 -9.031 -11.971) 15.245 6.063 ( 4.681 -2.535 -19.023) 19.754 6.785 ( 6.494 3.849 16.383) 18.038 7.120 ( -2.444 1.431 7.044) 7.592 7.217 ( 4.957 -1.047 2.911) 5.843 7.532 ( 20.439 -2.657 -7.067) 21.789 7.955 ( -4.593 3.144 7.314) 9.191 8.401 ( 5.208 -11.860 -0.716) 12.973 8.645 ( -19.656 -0.617 -8.440) 21.401 9.190 ( -23.838 -3.807 -12.776) 27.312 10.394 ( -4.128 5.625 21.417) 22.525 10.910 ( 8.701 0.589 -4.042) 9.612 11.090 ( 4.364 -1.565 9.503) 10.573 11.421 ( 9.354 11.117 10.453) 17.898 11.993 ( 8.707 1.003 -6.943) 11.181 12.110 ( 1.524 2.979 -6.337) 7.166 12.912 ( 5.214 -1.869 -1.993) 5.887 12.970 ( -7.436 -0.259 -5.150) 9.049 13.248 ( -10.867 -0.651 -9.948) 14.747 13.527 ( -10.388 -3.102 2.896) 11.221 13.894 ( 9.491 1.472 8.683) 12.947 14.203 ( 2.129 1.070 2.746) 3.636 14.912 ( -0.906 3.553 6.074) 7.095 16.019 ( -10.767 13.150 -22.894) 28.513 17.404 ( -0.991 1.168 7.586) 7.739 18.256 ( -11.419 -6.407 -7.255) 14.970 19.697 ( -5.736 -1.696 6.573) 8.887 20.361 ( 4.105 0.850 -12.763) 13.434 25.891 ( -3.261 0.734 32.700) 32.871 26.624 ( -2.116 26.088 6.381) 26.940 27.674 ( -0.658 -6.346 -14.404) 15.754 28.307 ( -3.722 -1.562 -10.667) 11.405 ======================= Grid point 487 (234/300) ======================= q-point: (-0.09 -0.09 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.604 ( -14.992 -0.000 20.566) 25.451 1.938 ( 0.623 0.000 22.321) 22.329 2.825 ( -18.102 -0.000 -0.677) 18.115 2.852 ( -20.760 -0.000 22.672) 30.741 3.736 ( -1.245 -0.000 30.651) 30.677 3.787 ( -0.281 -0.000 24.144) 24.146 4.533 ( -4.907 -0.000 8.730) 10.015 4.657 ( -2.409 -0.000 2.750) 3.656 5.024 ( 2.405 0.000 -6.309) 6.752 5.540 ( 4.670 0.000 -16.810) 17.446 5.586 ( 5.476 0.000 -12.877) 13.993 6.055 ( 4.588 0.000 -20.801) 21.301 6.901 ( 5.727 0.000 20.908) 21.678 7.117 ( -9.374 -0.000 9.586) 13.408 7.257 ( 8.146 0.000 2.110) 8.414 7.668 ( 29.212 0.000 -12.070) 31.608 8.028 ( 3.738 0.000 4.883) 6.150 8.206 ( -19.951 -0.000 -0.344) 19.954 8.518 ( -8.710 -0.000 -5.516) 10.310 8.944 ( -24.514 -0.000 -14.756) 28.612 10.452 ( -5.112 -0.000 22.288) 22.866 10.968 ( 9.428 0.000 -7.541) 12.073 11.116 ( 3.634 0.000 9.003) 9.709 11.680 ( 18.581 0.000 6.805) 19.788 11.961 ( -5.414 -0.000 -2.894) 6.139 12.173 ( 8.231 0.000 -8.800) 12.050 12.896 ( -8.397 -0.000 -6.025) 10.335 12.956 ( 10.300 0.000 -1.164) 10.365 13.147 ( -11.402 -0.000 -9.159) 14.625 13.427 ( -10.241 -0.000 1.529) 10.354 13.992 ( 7.169 0.000 9.378) 11.804 14.230 ( 3.475 0.000 2.636) 4.361 14.968 ( 0.004 0.000 7.441) 7.441 15.997 ( -20.056 -0.000 -20.678) 28.807 17.423 ( 0.023 0.000 9.626) 9.626 18.074 ( -14.809 -0.000 -0.566) 14.820 19.656 ( -4.384 -0.000 7.582) 8.758 20.386 ( 6.359 0.000 -14.241) 15.596 25.913 ( -8.414 -0.000 32.272) 33.351 26.944 ( 5.369 0.000 -10.409) 11.712 27.521 ( -6.008 -0.000 -1.491) 6.191 28.241 ( -4.911 -0.000 -9.882) 11.035 ======================= Grid point 488 (235/300) ======================= q-point: ( 0.00 0.00 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.923 ( -4.633 -0.000 17.147) 17.762 2.194 ( 4.501 0.000 -7.535) 8.777 2.769 ( -5.518 -0.000 14.035) 15.081 2.962 ( -1.599 -0.000 -1.159) 1.974 4.333 ( -0.800 -0.000 19.468) 19.485 4.380 ( -1.982 -0.000 21.479) 21.571 4.625 ( -3.706 -0.000 -0.637) 3.760 4.675 ( 1.764 0.000 -2.065) 2.716 4.955 ( -3.682 -0.000 4.840) 6.082 5.182 ( 1.042 0.000 -15.342) 15.378 5.405 ( 1.864 0.000 -2.578) 3.181 5.609 ( 4.740 0.000 -19.880) 20.438 7.152 ( -18.410 -0.000 10.669) 21.278 7.338 ( 11.139 0.000 -5.837) 12.576 7.549 ( 10.222 0.000 20.770) 23.149 7.850 ( -28.134 -0.000 4.378) 28.472 7.869 ( 21.175 0.000 -9.169) 23.075 8.027 ( 3.924 0.000 -12.316) 12.926 8.395 ( -8.959 -0.000 -0.988) 9.013 8.433 ( 4.677 0.000 -3.196) 5.665 10.730 ( -7.796 -0.000 9.855) 12.566 10.916 ( 10.256 0.000 -8.620) 13.397 11.530 ( 3.617 0.000 18.281) 18.636 11.797 ( -8.803 -0.000 -4.294) 9.794 11.921 ( 8.063 0.000 -0.995) 8.124 11.997 ( 0.506 0.000 -10.855) 10.867 12.741 ( -1.504 -0.000 1.558) 2.165 12.830 ( -3.475 -0.000 -6.321) 7.213 13.175 ( 16.962 0.000 2.065) 17.087 13.234 ( -12.328 -0.000 -3.159) 12.726 14.260 ( -0.366 -0.000 6.048) 6.059 14.327 ( 2.962 0.000 -0.506) 3.005 15.156 ( 2.768 0.000 9.702) 10.089 15.376 ( -12.722 -0.000 -11.152) 16.918 17.699 ( 5.726 0.000 9.336) 10.952 17.848 ( -9.459 -0.000 -4.693) 10.559 19.850 ( -1.288 -0.000 11.326) 11.399 20.117 ( 4.579 0.000 -14.473) 15.180 26.443 ( -15.770 -0.000 24.437) 29.084 26.817 ( 13.204 0.000 -12.420) 18.127 27.558 ( 2.305 0.000 9.366) 9.645 27.825 ( -7.036 -0.000 -15.140) 16.696 ======================= Grid point 489 (236/300) ======================= q-point: ( 0.09 0.00 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.951 ( 0.237 -0.936 16.020) 16.049 2.222 ( 7.166 0.207 -9.338) 11.772 2.690 ( 0.348 7.435 22.637) 23.830 2.966 ( 1.417 0.692 -7.069) 7.243 4.237 ( -4.178 15.758 19.570) 25.471 4.309 ( 2.262 9.723 13.122) 16.487 4.465 ( -3.601 7.691 -4.870) 9.789 4.605 ( 1.952 5.697 -10.849) 12.408 5.007 ( -6.782 -4.456 13.582) 15.822 5.223 ( 1.558 -7.316 -2.198) 7.797 5.521 ( -1.341 -7.224 -7.244) 10.318 5.674 ( 5.929 -8.832 -17.262) 20.276 7.022 ( -19.840 0.695 10.968) 22.681 7.338 ( 3.546 3.939 -2.284) 5.771 7.651 ( 4.538 4.150 17.634) 18.676 7.726 ( -9.360 -7.451 3.798) 12.552 7.834 ( -9.844 6.312 -16.025) 19.838 8.074 ( 23.820 0.160 -6.597) 24.717 8.460 ( -7.653 -10.298 1.909) 12.971 8.658 ( 12.565 -14.033 -2.057) 18.948 10.685 ( -6.194 1.065 9.128) 11.083 10.950 ( 10.036 2.839 -8.277) 13.315 11.588 ( -0.005 -0.197 16.622) 16.623 11.710 ( -8.054 1.743 1.425) 8.363 11.900 ( -4.030 6.619 -12.968) 15.107 11.936 ( 5.005 2.655 -5.730) 8.059 12.741 ( 1.651 1.147 3.625) 4.145 12.800 ( -0.036 0.488 -3.748) 3.780 13.149 ( -10.056 -0.371 -3.967) 10.817 13.330 ( 20.457 -2.300 -0.720) 20.598 14.273 ( -1.580 -1.455 4.873) 5.325 14.330 ( -1.618 0.861 -1.029) 2.102 15.032 ( -4.771 12.567 11.061) 17.408 15.252 ( -0.071 5.264 -9.770) 11.098 17.743 ( 3.715 1.774 10.945) 11.694 17.795 ( -8.556 -1.582 -5.528) 10.309 19.860 ( -0.930 0.593 10.196) 10.256 20.132 ( 7.209 -0.432 -14.640) 16.324 26.336 ( -16.973 3.484 25.178) 30.564 26.855 ( 13.174 3.936 -9.054) 16.463 27.566 ( 4.477 3.001 9.952) 11.317 27.715 ( -7.633 3.557 -15.707) 17.822 ======================= Grid point 490 (237/300) ======================= q-point: ( 0.18 0.00 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.963 ( 1.326 4.311 13.843) 14.559 2.253 ( 10.899 2.062 -5.969) 12.597 2.625 ( 3.577 4.431 21.980) 22.706 2.916 ( 5.332 4.705 -11.815) 13.789 3.806 ( -3.595 26.480 11.591) 29.128 4.052 ( 4.263 20.829 -6.417) 22.208 4.339 ( -6.939 3.170 -0.603) 7.653 4.556 ( 5.742 0.157 -5.539) 7.979 5.057 ( -7.906 -4.570 15.141) 17.682 5.404 ( 3.985 -7.900 -1.867) 9.043 5.628 ( -4.577 -9.760 1.455) 10.878 5.926 ( 5.302 -14.150 -12.960) 19.907 6.906 ( -17.179 -0.809 10.011) 19.899 7.273 ( -2.839 2.999 0.239) 4.136 7.585 ( -4.312 2.550 -5.669) 7.565 7.625 ( -1.954 6.899 1.598) 7.346 7.904 ( 5.494 -6.734 12.775) 15.451 8.207 ( 18.176 1.083 -11.905) 21.755 8.667 ( -9.068 -17.865 3.442) 20.328 9.003 ( 10.101 -13.332 -0.026) 16.727 10.635 ( -4.188 2.120 8.312) 9.545 10.912 ( 7.740 7.172 -5.498) 11.898 11.523 ( -6.876 6.359 8.746) 12.815 11.611 ( -7.338 7.814 3.872) 11.398 11.716 ( -5.641 3.382 -8.476) 10.728 11.874 ( 2.937 6.382 -7.043) 9.948 12.746 ( 4.977 -0.766 1.726) 5.323 12.813 ( 6.799 1.061 -1.128) 6.973 13.113 ( -9.996 -4.768 -1.876) 11.233 13.526 ( 17.809 -2.822 -1.626) 18.105 14.232 ( -5.965 4.446 2.367) 7.807 14.322 ( -0.442 -2.070 -2.022) 2.927 14.794 ( -2.960 10.276 8.428) 13.616 15.137 ( 10.346 7.940 -11.072) 17.107 17.688 ( -4.075 5.907 9.444) 11.861 17.746 ( -5.325 1.544 -4.404) 7.081 19.840 ( -2.880 1.398 6.999) 7.696 20.202 ( 10.775 -2.554 -11.527) 15.984 26.170 ( -16.949 5.933 28.220) 33.449 26.827 ( 11.666 7.184 -3.666) 14.182 27.529 ( -7.324 6.952 -17.549) 20.247 27.562 ( 7.780 3.614 5.933) 10.430 ======================= Grid point 491 (238/300) ======================= q-point: ( 0.27 0.00 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.888 ( 2.571 5.392 13.253) 14.537 2.232 ( 12.969 9.513 -4.716) 16.761 2.645 ( 0.494 -1.879 -2.854) 3.453 2.886 ( 12.808 2.660 2.422) 13.304 3.313 ( -2.195 25.181 10.846) 27.506 3.619 ( 5.209 25.795 -15.915) 30.753 4.222 ( -10.191 2.670 -3.078) 10.975 4.619 ( 7.232 -1.209 -3.047) 7.940 5.129 ( -6.637 -6.328 12.623) 15.602 5.549 ( 6.260 -5.470 -7.147) 10.963 5.837 ( -6.126 -14.074 12.473) 19.779 6.183 ( 3.853 -11.057 -9.814) 15.278 6.855 ( -13.056 -3.590 9.405) 16.487 7.170 ( -5.328 5.112 5.057) 8.950 7.474 ( -4.994 1.247 -11.875) 12.942 7.603 ( 3.407 -0.659 3.802) 5.147 8.050 ( 7.420 -0.795 13.226) 15.186 8.237 ( 14.463 5.700 -10.234) 18.611 8.989 ( -6.945 -21.267 2.217) 22.481 9.297 ( 3.060 -13.787 0.083) 14.122 10.564 ( -2.169 4.868 5.386) 7.577 10.764 ( 4.486 12.495 0.590) 13.289 11.265 ( -10.640 12.879 0.375) 16.710 11.470 ( -2.617 3.084 3.249) 5.188 11.587 ( -9.097 5.606 -3.689) 11.304 11.708 ( 0.978 11.010 -5.280) 12.250 12.807 ( 5.330 0.174 -0.371) 5.345 12.912 ( 8.339 -7.466 -0.127) 11.193 13.183 ( -4.136 -7.334 2.137) 8.687 13.627 ( 8.859 1.951 -1.657) 9.221 14.112 ( -5.472 3.903 -0.638) 6.752 14.343 ( -0.153 -0.898 -8.584) 8.632 14.633 ( 0.785 7.990 6.923) 10.601 15.116 ( 17.804 2.232 -9.798) 20.444 17.510 ( -7.638 9.916 11.895) 17.267 17.640 ( -5.696 4.034 -8.736) 11.182 19.810 ( -3.549 0.095 4.969) 6.107 20.322 ( 11.137 -3.288 -8.559) 14.426 25.987 ( -15.400 6.498 31.067) 35.278 26.743 ( 8.672 9.184 1.871) 12.769 27.301 ( -5.868 8.104 -21.099) 23.351 27.576 ( 10.505 2.569 0.897) 10.852 ======================= Grid point 492 (239/300) ======================= q-point: ( 0.36 0.00 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.913 ( 5.447 -3.914 6.657) 9.450 2.091 ( 9.844 11.204 -9.384) 17.621 2.642 ( -1.211 1.244 -10.712) 10.851 2.888 ( 0.211 18.305 3.145) 18.575 3.025 ( 14.461 -2.149 13.605) 19.971 3.154 ( 5.841 23.614 -17.381) 29.897 4.087 ( -11.968 2.358 -5.635) 13.437 4.657 ( 3.537 0.953 -1.806) 4.084 5.243 ( -2.364 -6.838 8.441) 11.117 5.683 ( 6.223 -4.814 -5.279) 9.475 6.064 ( -5.763 -11.694 12.354) 17.961 6.327 ( 0.645 -3.487 -5.010) 6.139 6.885 ( -7.816 -5.355 10.338) 14.023 7.074 ( -4.800 1.386 9.009) 10.302 7.410 ( -1.356 1.631 -13.024) 13.196 7.690 ( -0.284 -6.356 0.412) 6.375 8.051 ( 11.665 9.556 0.928) 15.108 8.204 ( 7.954 4.037 -0.073) 8.920 9.334 ( -5.640 -19.085 5.174) 20.563 9.575 ( -1.722 -15.307 -2.336) 15.580 10.408 ( -1.558 11.201 -3.867) 11.952 10.569 ( 6.077 11.536 10.260) 16.591 10.983 ( -9.340 8.689 1.672) 12.866 11.372 ( -9.585 7.753 -6.647) 14.006 11.432 ( -4.962 0.938 3.920) 6.393 11.501 ( 5.224 10.586 -5.000) 12.820 12.855 ( 1.088 -3.137 -1.438) 3.618 13.113 ( 4.176 -6.760 2.394) 8.298 13.309 ( 5.219 -4.859 4.566) 8.467 13.622 ( 4.052 1.308 -6.122) 7.457 14.000 ( -4.799 3.709 -3.377) 6.941 14.313 ( -3.614 0.647 -9.326) 10.023 14.517 ( 2.958 7.116 4.749) 9.052 15.255 ( 18.840 -2.866 -6.368) 20.093 17.296 ( -7.101 7.900 9.216) 14.064 17.502 ( -4.897 4.396 -10.381) 12.291 19.809 ( -3.084 -1.617 4.166) 5.430 20.432 ( 8.491 -1.922 -6.526) 10.880 25.835 ( -12.601 4.577 32.207) 34.886 26.624 ( 4.816 9.201 7.532) 12.830 27.095 ( -3.119 5.838 -23.970) 24.867 27.615 ( 10.381 0.834 -5.115) 11.603 ======================= Grid point 493 (240/300) ======================= q-point: ( 0.45 0.00 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.950 ( 3.714 6.068 -6.950) 9.946 2.114 ( 4.815 -8.734 -2.266) 10.227 2.530 ( 0.585 6.205 -4.919) 7.939 2.623 ( -3.297 8.376 -1.914) 9.203 2.844 ( 4.367 8.494 -16.831) 19.352 3.211 ( 13.099 -3.662 6.779) 15.197 3.958 ( -9.324 1.758 -5.494) 10.965 4.640 ( 0.558 1.682 0.251) 1.789 5.353 ( 0.400 -4.058 3.748) 5.539 5.763 ( 1.635 -0.100 0.134) 1.643 6.224 ( -3.334 -7.180 7.283) 10.757 6.325 ( -0.718 1.880 0.862) 2.189 6.946 ( -2.322 -2.028 12.079) 12.466 7.095 ( -4.186 -4.468 8.446) 10.432 7.341 ( -0.184 2.712 -12.077) 12.379 7.779 ( -4.007 -2.983 -5.578) 7.488 7.926 ( 11.156 10.089 2.299) 15.216 8.219 ( 2.968 -2.580 -3.056) 4.981 9.633 ( -5.243 -15.429 9.556) 18.891 9.775 ( -1.764 -5.372 1.959) 5.984 10.138 ( 0.634 15.940 -5.143) 16.761 10.491 ( 5.350 0.811 2.540) 5.978 10.845 ( -3.858 1.280 3.106) 5.116 11.165 ( -6.542 6.064 -5.009) 10.230 11.325 ( -3.530 3.577 0.948) 5.114 11.459 ( 5.456 1.073 -2.298) 6.017 12.916 ( -1.241 -2.998 -2.054) 3.840 13.196 ( 0.918 -0.867 0.961) 1.587 13.438 ( 5.794 -2.600 7.530) 9.850 13.656 ( 3.096 -4.321 -7.536) 9.222 13.875 ( -5.120 6.144 -5.499) 9.706 14.259 ( -1.329 2.109 -5.655) 6.180 14.449 ( 2.700 1.353 0.631) 3.085 15.387 ( 7.408 -0.310 -1.148) 7.503 17.189 ( -0.460 1.212 0.850) 1.550 17.399 ( -2.534 0.970 -9.633) 10.008 19.832 ( -2.052 -1.765 3.147) 4.151 20.481 ( 4.141 0.570 -4.344) 6.028 25.764 ( -9.042 0.313 31.276) 32.558 26.508 ( 1.113 7.134 13.286) 15.121 26.974 ( -0.382 0.990 -25.970) 25.992 27.671 ( 7.404 -1.390 -10.467) 12.896 ======================= Grid point 494 (241/300) ======================= q-point: (-0.45 0.00 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.870 ( -3.042 1.874 -0.702) 3.641 2.138 ( -2.220 3.904 -4.874) 6.628 2.482 ( -4.372 -0.672 4.403) 6.242 2.690 ( 3.336 -15.290 -8.988) 18.047 2.802 ( 1.007 -5.171 -15.144) 16.034 3.338 ( 2.561 -3.404 -4.933) 6.518 3.900 ( 1.820 0.145 -0.660) 1.941 4.615 ( -0.863 1.164 2.694) 3.059 5.402 ( 1.612 -0.023 -0.895) 1.844 5.693 ( -5.021 6.224 6.611) 10.376 6.273 ( -0.181 3.986 5.505) 6.799 6.312 ( 1.284 -1.766 -0.583) 2.260 6.969 ( 0.465 0.885 12.673) 12.712 7.141 ( -2.851 -0.692 5.240) 6.005 7.270 ( -0.178 2.570 -8.340) 8.729 7.730 ( 7.407 6.198 -3.854) 10.399 7.877 ( -7.641 -2.203 6.195) 10.080 8.338 ( -1.399 -9.666 -11.795) 15.314 9.678 ( 0.331 11.476 9.808) 15.100 9.803 ( 3.574 16.725 -6.187) 18.187 9.941 ( -2.873 -12.297 12.389) 17.691 10.627 ( -2.490 -12.567 -6.443) 14.340 10.867 ( 2.240 -2.117 -0.891) 3.209 11.080 ( 2.308 -0.339 2.756) 3.611 11.313 ( -1.031 -4.024 1.495) 4.415 11.482 ( 4.749 0.018 -3.088) 5.665 12.921 ( -1.403 0.797 -3.075) 3.472 13.207 ( -1.856 -0.947 -0.266) 2.101 13.515 ( 1.299 -2.560 3.381) 4.436 13.665 ( -5.084 9.276 -8.473) 13.553 13.790 ( 2.655 -6.139 -0.476) 6.705 14.186 ( 3.518 5.238 0.960) 6.382 14.520 ( 1.588 -6.325 -5.205) 8.344 15.349 ( -7.304 3.726 2.142) 8.474 17.216 ( 2.334 -2.067 -1.093) 3.304 17.442 ( 5.071 -7.518 -14.178) 16.830 19.848 ( -0.510 -0.428 1.746) 1.868 20.454 ( -0.820 2.811 -1.965) 3.526 25.809 ( -5.126 -5.063 28.071) 28.981 26.430 ( -2.022 3.613 18.702) 19.155 26.965 ( 1.876 -4.212 -26.065) 26.470 27.734 ( 2.674 -3.813 -14.726) 15.445 ======================= Grid point 495 (242/300) ======================= q-point: (-0.36 0.00 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.859 ( -8.237 -4.783 8.635) 12.856 2.082 ( -3.298 -2.532 -6.676) 7.866 2.472 ( -8.655 -0.136 8.336) 12.017 2.927 ( -0.558 -14.920 -2.490) 15.137 3.083 ( 0.934 -18.042 -10.988) 21.145 3.385 ( -7.378 -8.802 -19.698) 22.802 3.990 ( 13.005 -3.454 2.926) 13.770 4.587 ( -2.689 1.422 4.769) 5.657 5.378 ( 2.592 3.667 -3.694) 5.815 5.523 ( -6.768 7.889 9.169) 13.860 6.161 ( -1.399 8.900 8.887) 12.655 6.294 ( 3.107 5.181 -7.463) 9.602 6.956 ( 6.931 5.327 7.857) 11.754 7.137 ( -3.624 -2.230 6.001) 7.357 7.229 ( 0.569 0.758 -3.039) 3.183 7.653 ( 6.238 6.696 2.042) 9.376 7.932 ( -13.070 -9.470 6.256) 17.310 8.461 ( -6.356 -7.774 -17.244) 19.955 9.362 ( 3.491 21.921 4.662) 22.682 9.547 ( 2.771 13.042 -2.107) 13.498 10.190 ( -1.024 -12.097 14.229) 18.704 10.821 ( -8.795 -11.077 -10.129) 17.396 10.932 ( 6.459 -4.353 6.221) 9.968 11.219 ( 9.130 -6.858 5.756) 12.787 11.459 ( 5.991 -8.086 1.193) 10.134 11.520 ( 1.637 -3.544 -4.425) 5.901 12.880 ( -2.745 0.707 -4.774) 5.551 13.173 ( -4.717 3.410 -1.977) 6.148 13.406 ( -4.637 9.590 -4.509) 11.567 13.610 ( -2.160 -5.214 -4.406) 7.160 13.915 ( 4.525 -4.229 3.302) 7.019 14.145 ( 3.497 2.337 5.764) 7.135 14.640 ( 1.282 -5.766 -5.549) 8.104 15.207 ( -14.202 1.513 -1.955) 14.416 17.290 ( 1.961 -4.189 4.172) 6.229 17.662 ( 9.001 -12.029 -20.018) 25.029 19.849 ( 1.417 0.730 0.853) 1.808 20.365 ( -5.252 3.991 -0.556) 6.620 25.971 ( -1.297 -9.690 22.339) 24.385 26.411 ( -4.497 -0.049 23.198) 23.630 27.055 ( 3.538 -7.510 -23.342) 24.774 27.799 ( -2.043 -5.821 -17.810) 18.848 ======================= Grid point 496 (243/300) ======================= q-point: (-0.27 0.00 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.939 ( -9.274 -7.140 10.145) 15.489 2.182 ( -3.378 -10.867 4.813) 12.356 2.386 ( -10.138 2.840 4.971) 11.643 3.141 ( -8.753 -6.412 -5.371) 12.107 3.377 ( -3.072 -22.553 -1.728) 22.827 3.620 ( 0.663 -19.266 -14.184) 23.933 4.197 ( 12.410 -8.505 -2.939) 15.329 4.534 ( -4.388 2.394 5.181) 7.199 5.278 ( -2.029 7.536 8.237) 11.348 5.380 ( 0.103 5.143 -1.240) 5.292 5.961 ( -3.082 11.868 8.653) 15.007 6.137 ( 3.142 11.696 -12.550) 17.441 6.938 ( 12.208 3.669 4.082) 13.385 7.187 ( -1.023 -2.355 5.065) 5.679 7.248 ( 1.321 -2.357 4.507) 5.254 7.604 ( 3.943 2.222 2.304) 5.078 8.014 ( -13.857 -7.080 8.579) 17.769 8.444 ( -10.158 0.086 -19.793) 22.247 9.004 ( 7.071 20.170 1.319) 21.415 9.307 ( -4.456 12.099 -1.584) 12.991 10.417 ( 1.008 -9.521 13.902) 16.880 10.879 ( -4.677 -3.603 -5.303) 7.936 11.152 ( 5.377 -10.893 9.785) 15.599 11.409 ( 7.668 -4.103 10.198) 13.403 11.580 ( 10.314 -3.890 -6.213) 12.654 11.727 ( 0.752 -13.294 -3.744) 13.831 12.851 ( -6.010 -1.745 -5.625) 8.415 12.998 ( -7.920 7.333 -5.772) 12.240 13.232 ( 2.252 8.200 -3.072) 9.041 13.640 ( -9.764 -1.483 -2.338) 10.149 14.042 ( 7.107 -4.232 5.628) 10.005 14.164 ( 2.888 -0.977 7.192) 7.812 14.736 ( -0.763 -5.635 -2.533) 6.225 15.141 ( -12.006 -6.287 -11.070) 17.499 17.411 ( 3.144 -5.340 7.673) 9.863 17.893 ( 4.924 -9.851 -19.493) 22.388 19.852 ( 2.511 0.652 1.861) 3.192 20.242 ( -7.258 3.791 -1.675) 8.358 26.209 ( 1.032 -11.727 14.320) 18.538 26.443 ( -5.250 -2.587 25.287) 25.956 27.199 ( 4.312 -8.259 -16.956) 19.347 27.856 ( -5.299 -6.415 -19.472) 21.175 ======================= Grid point 497 (244/300) ======================= q-point: (-0.18 0.00 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.988 ( -7.287 -2.197 9.627) 12.272 2.267 ( -7.139 3.144 1.780) 8.001 2.424 ( -6.499 -15.335 16.553) 23.482 3.120 ( -10.626 -2.003 -12.841) 16.788 3.828 ( -3.074 -24.855 10.446) 27.136 3.953 ( 4.086 -14.936 1.305) 15.540 4.444 ( 6.242 -11.135 -12.459) 17.837 4.478 ( -3.422 0.289 2.626) 4.323 5.145 ( -4.950 5.302 16.206) 17.755 5.286 ( 4.092 7.167 -3.133) 8.827 5.740 ( -2.863 9.374 1.156) 9.870 5.885 ( 4.192 14.780 -15.788) 22.029 7.027 ( 15.916 -1.891 1.656) 16.114 7.215 ( -3.275 -1.691 5.680) 6.771 7.334 ( 5.669 -2.195 9.281) 11.094 7.641 ( 6.785 -1.430 1.716) 7.143 8.006 ( -12.295 -0.749 6.986) 14.161 8.280 ( -14.071 3.161 -18.344) 23.334 8.717 ( 8.794 16.887 -0.989) 19.065 9.014 ( -13.617 12.301 -2.213) 18.483 10.605 ( 1.514 -7.162 11.242) 13.415 10.881 ( -3.029 -0.485 -3.092) 4.355 11.398 ( 6.060 -6.132 13.871) 16.332 11.531 ( 8.598 -4.314 10.499) 14.239 11.764 ( 7.213 -8.887 -9.301) 14.749 11.907 ( -0.104 -5.334 -6.288) 8.246 12.792 ( -8.176 1.038 -3.724) 9.043 12.895 ( -7.379 -3.142 -6.436) 10.283 13.107 ( 8.847 8.349 -1.980) 12.325 13.515 ( -15.602 3.505 -0.355) 15.995 14.162 ( 7.703 -1.044 8.675) 11.648 14.251 ( 3.229 -3.916 3.853) 6.372 14.854 ( -1.650 -8.351 1.637) 8.669 15.230 ( -8.633 -12.920 -17.373) 23.309 17.541 ( 4.447 -3.815 8.897) 10.653 17.999 ( -2.541 -3.328 -14.329) 14.928 19.860 ( 0.099 0.550 6.519) 6.543 20.138 ( -3.715 1.678 -6.908) 8.021 26.418 ( -7.567 -7.961 17.529) 20.686 26.537 ( 4.716 -5.488 11.037) 13.198 27.355 ( 3.924 -7.228 -6.979) 10.787 27.888 ( -6.729 -4.962 -19.106) 20.855 ======================= Grid point 498 (245/300) ======================= q-point: (-0.09 0.00 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.957 ( -7.836 1.228 14.958) 16.931 2.197 ( -0.390 1.122 -4.084) 4.253 2.667 ( -7.174 -11.648 16.848) 21.702 3.034 ( -7.428 1.963 -7.779) 10.934 4.216 ( -2.034 -12.408 20.096) 23.705 4.227 ( 1.753 -10.993 15.397) 19.000 4.521 ( -2.008 -8.122 -4.619) 9.557 4.616 ( 1.707 -5.914 -11.186) 12.768 5.055 ( -6.613 5.036 13.908) 16.203 5.184 ( 5.238 3.749 -3.672) 7.415 5.562 ( -0.707 10.911 -7.141) 13.060 5.653 ( 5.702 6.814 -18.642) 20.651 7.207 ( 12.703 -4.172 -2.367) 13.578 7.221 ( -8.462 -2.449 7.018) 11.263 7.436 ( 9.949 -0.612 17.118) 19.808 7.738 ( 19.488 1.413 -0.920) 19.561 7.949 ( -10.227 -2.950 -0.609) 10.662 8.092 ( -20.591 0.975 -12.069) 23.887 8.499 ( 6.743 11.469 -0.942) 13.338 8.663 ( -15.543 12.525 -4.105) 20.379 10.729 ( -3.767 -3.999 10.653) 11.986 10.868 ( 4.114 0.299 -6.206) 7.451 11.484 ( 5.338 1.329 17.068) 17.933 11.743 ( 4.796 -8.044 5.236) 10.729 11.910 ( -1.128 1.038 -5.833) 6.031 11.937 ( 4.725 -5.683 -11.397) 13.583 12.751 ( -4.367 -1.047 -0.367) 4.506 12.877 ( -7.167 -0.872 -7.908) 10.708 13.080 ( 13.258 2.501 2.047) 13.646 13.347 ( -15.164 1.611 -1.799) 15.355 14.230 ( 4.572 -0.294 7.988) 9.209 14.314 ( 3.465 0.350 1.046) 3.637 15.027 ( -0.255 -9.215 6.954) 11.547 15.379 ( -9.206 -10.654 -16.785) 21.909 17.637 ( 5.293 -1.124 8.926) 10.438 17.946 ( -8.417 1.584 -7.853) 11.620 19.851 ( -2.876 0.600 10.994) 11.379 20.109 ( 2.410 -0.344 -12.491) 12.726 26.473 ( -13.843 -3.389 25.117) 28.879 26.707 ( 11.666 -4.371 -8.341) 14.993 27.488 ( 2.687 -4.450 3.354) 6.186 27.878 ( -6.939 -2.462 -16.916) 18.449 ======================= Grid point 500 (246/300) ======================= q-point: ( 0.09 0.09 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.993 ( 6.404 0.000 16.684) 17.871 2.263 ( 8.645 0.000 -10.828) 13.855 2.816 ( 4.500 0.000 19.091) 19.614 2.993 ( 6.144 0.000 -0.780) 6.193 4.364 ( -4.092 -0.000 19.044) 19.479 4.414 ( -3.334 -0.000 15.029) 15.394 4.566 ( -3.815 -0.000 2.611) 4.623 4.712 ( 4.242 0.000 -2.024) 4.700 4.906 ( -5.911 -0.000 6.935) 9.112 5.126 ( -1.504 -0.000 -15.301) 15.375 5.411 ( -0.210 -0.000 0.168) 0.269 5.610 ( 5.291 0.000 -20.771) 21.434 6.899 ( -20.796 -0.000 11.566) 23.796 7.417 ( 1.567 0.000 -2.910) 3.305 7.493 ( -20.574 -0.000 1.775) 20.650 7.777 ( 8.132 0.000 19.088) 20.748 7.783 ( -10.472 -0.000 -19.768) 22.371 8.186 ( 4.601 0.000 2.383) 5.182 8.524 ( 28.430 0.000 -5.732) 29.002 8.527 ( 9.437 0.000 1.389) 9.538 10.660 ( -6.369 -0.000 7.642) 9.948 11.048 ( 12.989 0.000 -10.065) 16.432 11.607 ( -2.346 -0.000 18.676) 18.823 11.647 ( -9.964 -0.000 -4.128) 10.785 11.901 ( -7.803 -0.000 -12.922) 15.095 11.983 ( 2.193 0.000 -4.245) 4.778 12.770 ( 3.330 0.000 4.389) 5.509 12.809 ( 2.845 0.000 -1.738) 3.334 13.094 ( -5.072 -0.000 -4.501) 6.781 13.476 ( 24.617 0.000 -2.385) 24.732 14.227 ( -5.977 -0.000 3.407) 6.880 14.318 ( -3.813 -0.000 -3.693) 5.309 15.187 ( -9.699 -0.000 -2.430) 9.999 15.244 ( 3.175 0.000 15.484) 15.806 17.714 ( -6.859 -0.000 -3.745) 7.815 17.810 ( 4.594 0.000 11.261) 12.162 19.895 ( 2.271 0.000 10.105) 10.357 20.148 ( 7.114 0.000 -16.395) 17.872 26.291 ( -16.999 -0.000 24.655) 29.947 26.967 ( 13.406 0.000 -12.810) 18.542 27.639 ( 2.868 0.000 14.681) 14.959 27.676 ( -6.559 -0.000 -12.276) 13.919 ======================= Grid point 501 (247/300) ======================= q-point: ( 0.18 0.09 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.071 ( 8.400 1.714 13.079) 15.638 2.316 ( 9.329 -1.231 -7.342) 11.935 2.828 ( 8.599 7.281 19.484) 22.507 3.028 ( 9.650 2.219 -1.783) 10.061 4.234 ( -5.065 16.953 17.658) 24.997 4.363 ( -4.567 4.782 4.849) 8.200 4.398 ( 0.006 12.250 2.218) 12.449 4.601 ( 2.899 5.312 -10.177) 11.840 4.959 ( -5.914 -3.377 11.637) 13.483 5.214 ( -2.474 -11.865 1.810) 12.254 5.483 ( -0.091 -4.872 -7.875) 9.260 5.699 ( 5.541 -10.089 -15.643) 19.421 6.787 ( -17.187 -0.638 10.517) 20.160 7.277 ( -10.135 2.867 -1.044) 10.584 7.545 ( -8.097 -6.859 1.078) 10.666 7.608 ( -11.361 4.544 -15.329) 19.614 7.899 ( 9.132 -3.160 14.592) 17.502 8.293 ( 2.448 -8.116 2.182) 8.754 8.491 ( 16.664 5.501 -2.301) 17.698 8.884 ( 19.205 -10.098 -0.337) 21.701 10.629 ( -5.254 0.147 6.327) 8.226 11.084 ( 12.653 4.490 -8.319) 15.794 11.546 ( -9.751 2.234 2.304) 10.266 11.625 ( -7.104 -0.535 11.585) 13.600 11.748 ( -9.962 6.335 -14.359) 18.589 11.962 ( 1.058 2.307 -4.897) 5.516 12.807 ( 5.919 1.507 4.051) 7.329 12.849 ( 5.727 -2.832 1.850) 6.651 13.035 ( -3.109 2.544 -4.348) 5.920 13.644 ( 23.519 0.146 -3.937) 23.847 14.231 ( -5.245 -4.180 0.752) 6.749 14.248 ( -8.900 2.269 -3.363) 9.781 14.993 ( -3.057 10.733 8.501) 14.029 15.295 ( 5.165 2.410 4.100) 7.021 17.660 ( -6.152 0.647 -3.813) 7.267 17.834 ( 1.987 3.154 12.657) 13.195 19.898 ( 2.107 3.147 6.791) 7.776 20.200 ( 8.778 -2.625 -13.883) 16.633 26.185 ( -16.418 3.153 26.549) 31.374 26.998 ( 11.031 3.736 -12.610) 17.165 27.574 ( -4.538 4.590 -11.048) 12.795 27.671 ( 4.101 1.601 14.242) 14.907 ======================= Grid point 502 (248/300) ======================= q-point: ( 0.27 0.09 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.054 ( 4.730 6.595 10.291) 13.106 2.427 ( 13.627 -1.299 0.028) 13.689 2.726 ( 6.398 10.680 1.594) 12.551 3.062 ( 15.367 3.566 7.103) 17.301 3.800 ( -2.942 25.754 11.698) 28.439 4.080 ( 3.005 21.765 -9.827) 24.069 4.225 ( -8.230 5.377 -0.123) 9.831 4.618 ( 5.460 -2.721 -5.794) 8.414 4.997 ( -7.535 -4.471 14.396) 16.853 5.444 ( 2.012 -10.148 0.948) 10.389 5.574 ( -3.437 -9.413 0.552) 10.036 5.957 ( 4.844 -13.970 -11.694) 18.851 6.724 ( -12.452 -2.246 9.033) 15.547 7.189 ( -8.365 0.618 1.549) 8.530 7.426 ( -9.217 2.900 -12.819) 16.053 7.590 ( -4.717 -2.609 -0.016) 5.391 8.075 ( 8.013 -5.180 16.596) 19.143 8.463 ( 19.318 2.796 -6.901) 20.703 8.580 ( -2.507 -13.620 2.047) 14.000 9.142 ( 8.659 -7.084 2.111) 11.385 10.600 ( -3.432 0.946 3.787) 5.198 11.015 ( 7.570 9.868 -1.795) 12.566 11.392 ( -12.937 8.511 0.861) 15.509 11.509 ( -6.332 4.838 -1.379) 8.087 11.585 ( -9.152 2.520 -4.582) 10.540 11.881 ( 0.133 6.646 -3.515) 7.519 12.866 ( 9.963 -1.848 3.172) 10.617 12.924 ( 4.951 4.670 0.662) 6.838 13.015 ( -0.167 -8.120 0.418) 8.132 13.754 ( 13.771 3.176 -1.260) 14.189 14.124 ( -9.014 2.243 -0.570) 9.306 14.277 ( -3.455 -3.364 -5.919) 7.635 14.828 ( 4.413 9.215 6.215) 11.959 15.277 ( 11.622 4.142 -4.121) 13.008 17.574 ( -7.036 3.382 -3.014) 8.368 17.744 ( -2.059 8.387 12.473) 15.171 19.849 ( 1.720 3.735 3.167) 5.190 20.309 ( 8.890 -3.995 -9.719) 13.764 26.042 ( -14.976 5.159 29.387) 33.384 26.937 ( 4.944 6.744 -10.018) 13.049 27.414 ( 0.409 8.498 -11.163) 14.035 27.693 ( 6.553 2.171 9.118) 11.436 ======================= Grid point 503 (249/300) ======================= q-point: ( 0.36 0.09 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.983 ( 4.619 4.878 10.982) 12.874 2.430 ( 15.557 15.014 -1.647) 21.683 2.626 ( 2.457 -0.440 -11.743) 12.005 3.149 ( 18.789 1.835 10.889) 21.794 3.325 ( -1.955 24.825 12.629) 27.921 3.637 ( 5.087 25.565 -16.892) 31.061 4.054 ( -11.299 4.527 -4.527) 12.987 4.676 ( 2.146 -0.491 -4.258) 4.794 5.098 ( -3.293 -8.074 11.605) 14.516 5.599 ( 4.240 -6.342 -8.504) 11.424 5.799 ( -5.840 -14.374 15.093) 21.646 6.198 ( 2.833 -9.957 -9.400) 13.983 6.735 ( -7.718 -5.290 8.603) 12.711 7.106 ( -6.238 3.187 5.962) 9.199 7.350 ( -6.365 -2.288 -10.432) 12.433 7.606 ( -1.990 -2.468 -3.269) 4.554 8.215 ( 5.966 -0.249 19.144) 20.054 8.452 ( 20.357 10.574 -10.982) 25.432 8.911 ( -4.864 -21.810 1.843) 22.422 9.316 ( -0.831 -9.647 1.211) 9.758 10.538 ( -1.878 4.737 -1.245) 5.246 10.839 ( 2.823 11.896 7.617) 14.405 11.097 ( -12.684 11.063 -0.369) 16.835 11.420 ( -6.445 4.591 -2.849) 8.411 11.433 ( -6.645 3.432 -3.203) 8.135 11.715 ( 1.217 9.888 -3.497) 10.559 12.851 ( 0.301 2.371 -0.150) 2.395 13.040 ( 9.436 -6.302 4.132) 12.076 13.220 ( 7.261 -9.298 2.142) 11.990 13.710 ( 2.826 5.894 -0.544) 6.559 14.044 ( -3.256 3.047 -1.469) 4.695 14.265 ( -5.593 -0.299 -9.834) 11.317 14.711 ( 7.507 8.835 2.751) 11.916 15.332 ( 14.887 -0.637 -7.587) 16.721 17.416 ( -6.476 7.875 3.034) 10.638 17.575 ( -3.320 8.084 3.967) 9.598 19.813 ( 1.976 1.840 2.821) 3.905 20.422 ( 6.445 -3.420 -7.798) 10.679 25.894 ( -12.759 5.361 31.391) 34.306 26.793 ( -2.399 7.567 -6.380) 10.184 27.238 ( 6.525 10.662 -11.226) 16.801 27.712 ( 7.883 2.374 1.178) 8.317 ======================= Grid point 504 (250/300) ======================= q-point: ( 0.45 0.09 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.012 ( 5.276 -2.658 5.683) 8.197 2.209 ( 11.386 15.013 -11.271) 21.956 2.630 ( 2.577 2.246 -2.610) 4.301 2.890 ( -1.494 21.229 5.434) 21.964 3.173 ( 5.525 23.594 -18.511) 30.493 3.282 ( 14.473 0.098 7.222) 16.175 3.911 ( -8.756 1.235 -4.716) 10.022 4.659 ( -2.151 1.052 -1.963) 3.096 5.259 ( 0.844 -7.403 6.660) 9.994 5.716 ( 0.164 -4.753 -4.702) 6.688 6.034 ( -4.325 -11.687 13.086) 18.071 6.313 ( -0.010 -2.818 -5.064) 5.795 6.843 ( -2.551 -7.965 9.259) 12.477 7.042 ( -3.931 0.413 8.404) 9.287 7.340 ( -2.826 -0.909 -8.991) 9.469 7.652 ( -2.492 -4.930 -6.486) 8.519 8.216 ( 5.046 7.722 14.761) 17.406 8.338 ( 14.243 11.641 -10.466) 21.164 9.281 ( -4.347 -19.818 5.791) 21.099 9.531 ( -3.185 -15.053 -2.233) 15.547 10.374 ( -0.262 10.705 -5.759) 12.158 10.669 ( 0.502 10.913 12.820) 16.843 10.858 ( -8.230 4.485 1.486) 9.490 11.224 ( -8.111 6.395 -6.258) 12.077 11.351 ( -4.221 3.807 0.285) 5.691 11.571 ( 4.880 6.016 -4.185) 8.805 12.843 ( -1.381 -1.741 0.011) 2.223 13.211 ( 8.123 -3.371 4.743) 9.992 13.429 ( 7.927 -5.442 4.543) 10.634 13.633 ( 0.563 1.843 -6.089) 6.386 13.939 ( -2.380 5.185 -3.615) 6.754 14.197 ( -7.636 -0.333 -8.588) 11.497 14.614 ( 8.840 8.068 1.038) 12.013 15.424 ( 6.397 -0.414 -5.562) 8.487 17.257 ( 0.220 5.672 2.172) 6.077 17.428 ( -2.503 5.254 -2.153) 6.205 19.820 ( 2.521 -0.089 3.673) 4.456 20.488 ( 2.461 -1.356 -6.760) 7.321 25.785 ( -10.073 3.181 32.006) 33.704 26.622 ( -6.974 5.979 -1.261) 9.272 27.081 ( 10.256 9.874 -12.515) 18.956 27.717 ( 6.606 2.137 -6.760) 9.691 ======================= Grid point 506 (251/300) ======================= q-point: (-0.45 0.09 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.993 ( 5.287 10.171 -5.751) 12.825 2.166 ( 4.041 -3.559 -3.562) 6.457 2.538 ( 1.653 9.274 -3.607) 10.087 2.591 ( -1.178 5.761 4.321) 7.297 2.840 ( 3.466 10.484 -17.514) 20.705 3.326 ( 0.489 1.552 -5.167) 5.418 3.905 ( 4.974 -2.359 1.502) 5.706 4.618 ( -3.673 0.658 -0.061) 3.732 5.384 ( 2.364 -3.593 2.057) 4.768 5.729 ( -6.664 1.010 1.970) 7.022 6.216 ( -1.471 -8.023 7.349) 10.979 6.322 ( 0.033 0.455 0.097) 0.466 6.964 ( -1.668 -2.802 12.433) 12.853 7.083 ( -0.322 -5.067 5.697) 7.632 7.301 ( -0.898 1.944 -6.634) 6.972 7.708 ( -2.698 -3.784 -8.775) 9.930 8.063 ( 5.918 13.229 4.527) 15.183 8.241 ( 2.754 2.857 -5.787) 7.017 9.606 ( -3.476 -16.476 10.439) 19.812 9.768 ( -0.039 -9.121 0.987) 9.174 10.139 ( 2.451 14.423 -5.845) 15.754 10.486 ( -7.290 4.445 2.652) 8.940 10.834 ( 0.937 -2.537 2.129) 3.441 11.096 ( -3.066 1.120 -0.484) 3.300 11.260 ( -2.781 2.176 0.198) 3.536 11.537 ( 5.461 1.478 -4.951) 7.518 12.877 ( -2.337 -2.496 0.387) 3.441 13.264 ( 6.264 3.430 1.224) 7.245 13.503 ( 0.294 0.489 3.339) 3.388 13.691 ( 4.850 -6.669 -2.336) 8.570 13.787 ( -4.183 8.325 -6.289) 11.241 14.187 ( -4.391 -4.371 -6.147) 8.727 14.548 ( 10.014 5.556 -1.234) 11.518 15.374 ( -8.419 4.484 -0.626) 9.559 17.229 ( 5.436 0.937 -1.809) 5.805 17.369 ( 2.689 -1.253 -6.949) 7.556 19.855 ( 3.442 -0.395 4.019) 5.306 20.479 ( -2.006 1.367 -5.486) 5.999 25.757 ( -7.263 -1.216 31.220) 32.076 26.481 ( -8.887 3.281 5.962) 11.193 26.988 ( 11.981 5.530 -15.840) 20.617 27.703 ( 2.867 0.943 -13.122) 13.465 ======================= Grid point 507 (252/300) ======================= q-point: (-0.36 0.09 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.848 ( 0.156 6.270 0.347) 6.281 2.088 ( -2.386 6.695 -5.943) 9.265 2.466 ( -0.190 1.276 7.547) 7.657 2.711 ( 3.972 -14.581 -9.307) 17.748 2.762 ( 0.031 -4.371 -12.455) 13.199 3.244 ( -8.652 1.065 -13.691) 16.230 4.037 ( 13.987 -2.992 4.069) 14.871 4.582 ( -4.831 0.299 1.707) 5.132 5.433 ( 3.692 0.421 -2.255) 4.346 5.608 ( -9.684 5.592 7.117) 13.256 6.289 ( -0.289 3.678 5.025) 6.234 6.329 ( 0.796 -2.336 0.426) 2.505 7.005 ( -3.089 -2.357 14.576) 15.085 7.156 ( 4.536 0.986 0.398) 4.659 7.248 ( -0.720 2.086 -0.856) 2.367 7.738 ( -5.175 -4.104 -4.068) 7.757 7.867 ( 5.311 11.232 1.267) 12.489 8.254 ( -4.840 -5.561 -10.313) 12.677 9.719 ( 0.826 10.435 8.780) 13.662 9.850 ( 5.375 17.122 -6.272) 19.011 9.950 ( -1.826 -14.558 13.430) 19.891 10.501 ( -9.792 -12.037 -7.813) 17.373 10.914 ( 4.264 -3.286 1.249) 5.527 11.174 ( 5.516 -7.640 4.452) 10.422 11.254 ( -3.853 -4.336 0.331) 5.810 11.562 ( 6.040 -0.564 -5.537) 8.213 12.879 ( -2.323 0.971 0.627) 2.595 13.217 ( 1.035 3.946 -0.993) 4.199 13.504 ( -3.080 -1.702 0.168) 3.523 13.562 ( -3.413 9.884 -10.116) 14.549 13.871 ( 7.203 -6.645 4.292) 10.698 14.213 ( 0.409 0.529 -0.247) 0.713 14.571 ( 7.865 -1.804 -6.116) 10.125 15.168 ( -17.282 6.241 -0.116) 18.375 17.255 ( 1.574 -1.487 4.797) 5.263 17.502 ( 10.037 -8.600 -17.502) 21.932 19.889 ( 4.713 0.647 3.715) 6.036 20.394 ( -5.892 3.601 -4.192) 8.078 25.839 ( -4.856 -6.532 29.199) 30.312 26.399 ( -8.980 0.338 12.745) 15.594 26.998 ( 12.725 -0.325 -18.383) 22.360 27.683 ( -1.900 -1.406 -17.524) 17.683 ======================= Grid point 508 (253/300) ======================= q-point: (-0.27 0.09 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.790 ( -5.453 -1.750 8.720) 10.432 2.021 ( -1.638 -3.191 -8.775) 9.479 2.441 ( -0.396 3.814 12.928) 13.484 2.915 ( -0.600 -14.684 0.141) 14.697 3.035 ( -2.451 -10.907 -14.055) 17.958 3.215 ( -4.980 -14.651 -20.185) 25.434 4.203 ( 14.744 -2.913 2.442) 15.226 4.535 ( -6.448 1.037 2.645) 7.046 5.404 ( -1.005 5.881 3.405) 6.869 5.456 ( -2.606 3.897 1.592) 4.951 6.162 ( -2.968 9.758 9.177) 13.720 6.308 ( 2.507 5.608 -7.141) 9.419 7.084 ( -1.868 -5.147 14.775) 15.757 7.136 ( 8.927 4.896 -0.271) 10.185 7.219 ( -1.997 -0.134 3.313) 3.871 7.673 ( -6.504 3.461 -0.409) 7.379 7.855 ( 3.431 -3.421 2.115) 5.286 8.294 ( -8.947 -5.103 -14.827) 18.054 9.427 ( 2.755 19.684 5.131) 20.528 9.565 ( 1.256 16.372 -3.534) 16.796 10.237 ( 0.382 -13.202 15.034) 20.011 10.671 ( -7.158 -12.253 -8.950) 16.777 11.048 ( 6.279 -6.787 7.515) 11.915 11.336 ( 2.094 -6.452 3.821) 7.786 11.442 ( 0.906 -14.560 -2.003) 14.725 11.621 ( 7.136 -1.750 -4.092) 8.409 12.820 ( -2.523 2.780 -0.908) 3.862 13.087 ( -6.681 8.066 -5.393) 11.781 13.384 ( 3.416 6.255 -3.470) 7.927 13.530 ( -5.594 -3.070 -4.331) 7.712 14.037 ( 9.695 -3.866 4.675) 11.436 14.194 ( 1.042 1.509 4.766) 5.106 14.656 ( 2.663 -2.879 -4.417) 5.907 14.969 ( -15.200 -0.092 -7.478) 16.940 17.340 ( 1.194 -5.203 9.381) 10.793 17.713 ( 7.200 -9.881 -20.648) 23.995 19.909 ( 5.094 1.692 4.233) 6.836 20.261 ( -7.272 4.344 -4.589) 9.634 26.020 ( -4.588 -10.552 26.788) 29.155 26.389 ( -6.280 -2.607 15.221) 16.671 27.106 ( 12.531 -4.496 -16.666) 21.330 27.675 ( -5.954 -4.302 -20.121) 21.420 ======================= Grid point 509 (254/300) ======================= q-point: (-0.18 0.09 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.858 ( -7.398 -7.231 13.302) 16.851 2.117 ( -2.035 -7.956 -8.952) 12.148 2.394 ( 2.853 3.319 20.154) 20.624 2.989 ( -6.875 -1.901 -15.690) 17.235 3.336 ( -3.361 -25.274 4.765) 25.938 3.600 ( 3.090 -23.441 -14.419) 27.694 4.358 ( 11.266 -3.741 -1.629) 11.982 4.467 ( -6.680 1.269 2.306) 7.180 5.250 ( -7.088 7.000 13.896) 17.098 5.410 ( 5.710 3.809 -6.730) 9.613 5.933 ( -5.180 12.630 9.341) 16.541 6.143 ( 3.829 11.989 -12.236) 17.553 7.136 ( 4.114 0.585 3.772) 5.612 7.162 ( 1.936 0.068 4.168) 4.596 7.279 ( 0.286 -6.736 14.196) 15.715 7.622 ( -1.620 -1.864 -3.278) 4.104 7.925 ( -1.160 -1.412 5.807) 6.088 8.241 ( -8.487 1.121 -17.254) 19.261 9.104 ( 5.194 18.227 2.411) 19.105 9.226 ( -5.045 17.722 -2.074) 18.543 10.484 ( 1.207 -9.573 14.733) 17.611 10.793 ( -3.477 -6.316 -7.790) 10.615 11.277 ( 5.898 -10.684 11.684) 16.895 11.502 ( 0.096 -8.749 5.790) 10.491 11.648 ( 3.881 -5.480 -5.629) 8.762 11.754 ( 3.386 -9.126 -4.283) 10.634 12.758 ( -3.237 1.192 -2.793) 4.438 12.868 ( -6.026 6.735 -7.465) 11.722 13.317 ( 8.301 6.178 -0.358) 10.353 13.479 ( -10.219 2.634 -2.739) 10.903 14.181 ( 9.203 -3.547 4.059) 10.665 14.207 ( -0.133 -1.914 5.769) 6.079 14.709 ( -3.819 -5.117 2.077) 6.714 14.962 ( -4.154 -7.636 -16.843) 18.954 17.485 ( 1.910 -6.670 11.636) 13.548 17.867 ( 0.217 -6.672 -18.138) 19.327 19.905 ( 0.558 2.269 8.166) 8.494 20.142 ( -1.712 2.731 -9.188) 9.738 26.216 ( -11.129 -10.041 26.971) 30.857 26.475 ( 3.275 -6.047 9.399) 11.646 27.267 ( 10.930 -5.870 -9.739) 15.772 27.690 ( -8.113 -6.272 -20.947) 23.322 ======================= Grid point 510 (255/300) ======================= q-point: (-0.09 0.09 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.939 ( -4.854 -2.507 14.077) 15.100 2.187 ( 1.330 -2.143 -9.106) 9.449 2.492 ( 1.998 -6.771 27.048) 27.954 2.965 ( -4.131 -2.579 -15.547) 16.292 3.818 ( -3.545 -26.226 11.080) 28.690 4.009 ( 4.183 -18.317 -2.935) 19.016 4.422 ( -4.895 -1.307 0.819) 5.133 4.497 ( 5.792 -5.222 -8.095) 11.240 5.112 ( -7.275 4.959 16.186) 18.426 5.346 ( 5.260 6.846 -3.142) 9.187 5.690 ( -4.617 9.577 1.382) 10.721 5.899 ( 5.192 14.365 -14.761) 21.241 7.108 ( -14.599 -1.211 9.446) 17.431 7.233 ( 10.058 -2.081 -1.262) 10.348 7.468 ( 7.686 -6.539 16.588) 19.416 7.703 ( -0.279 -7.698 -4.790) 9.071 7.892 ( -5.268 3.382 4.127) 7.498 8.101 ( 0.507 6.256 -16.846) 17.977 8.795 ( -7.185 16.913 4.042) 18.815 8.877 ( 4.743 16.200 -3.589) 17.258 10.647 ( -2.033 -5.017 12.753) 13.854 10.856 ( 2.895 -3.301 -7.898) 9.036 11.513 ( 2.235 -6.673 13.604) 15.317 11.646 ( 0.438 -5.146 11.965) 13.032 11.780 ( 1.094 -8.646 -11.793) 14.663 11.880 ( 0.238 -3.790 -9.681) 10.399 12.716 ( -1.253 0.174 -0.065) 1.266 12.790 ( -2.411 -1.614 -6.039) 6.699 13.260 ( 2.305 5.062 1.431) 5.744 13.320 ( -0.773 6.030 -4.032) 7.294 14.258 ( 0.989 -1.792 6.272) 6.597 14.301 ( 2.546 -2.781 2.321) 4.427 14.829 ( -4.381 -10.032 7.053) 13.023 15.101 ( 0.790 -10.934 -18.243) 21.284 17.635 ( 3.092 -4.927 11.932) 13.274 17.886 ( -6.837 -0.852 -11.956) 13.800 19.867 ( -4.083 1.338 10.702) 11.532 20.114 ( 6.187 0.618 -13.119) 14.518 26.315 ( -16.269 -6.552 26.948) 32.153 26.670 ( 10.924 -7.132 -0.817) 13.072 27.433 ( 7.851 -5.290 0.619) 9.487 27.713 ( -8.376 -5.892 -19.400) 21.937 ======================= Grid point 513 (256/300) ======================= q-point: ( 0.18 0.18 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.195 ( 13.397 0.000 12.424) 18.272 2.337 ( 6.143 0.000 -8.855) 10.777 3.027 ( 14.926 0.000 19.855) 24.840 3.122 ( 11.712 0.000 1.023) 11.756 4.355 ( -8.093 -0.000 1.627) 8.255 4.357 ( -5.579 -0.000 18.172) 19.009 4.572 ( 0.603 0.000 11.493) 11.509 4.774 ( 4.740 0.000 -0.642) 4.783 4.846 ( -6.526 -0.000 12.107) 13.754 5.037 ( -2.744 -0.000 -17.174) 17.392 5.408 ( -0.744 -0.000 2.577) 2.682 5.615 ( 5.662 0.000 -21.440) 22.175 6.685 ( -13.971 -0.000 10.039) 17.204 7.234 ( -17.115 -0.000 1.592) 17.189 7.352 ( -8.282 -0.000 -5.761) 10.089 7.581 ( -9.681 -0.000 -11.625) 15.128 7.919 ( 4.248 0.000 10.332) 11.171 8.216 ( 0.398 0.000 1.012) 1.087 8.721 ( 14.627 0.000 11.002) 18.303 8.948 ( 31.399 0.000 -8.245) 32.463 10.602 ( -5.129 -0.000 5.831) 7.766 11.214 ( 15.355 0.000 -11.865) 19.405 11.496 ( -9.153 -0.000 -3.550) 9.818 11.585 ( -9.177 -0.000 16.512) 18.891 11.706 ( -12.446 -0.000 -14.021) 18.748 11.968 ( -1.920 -0.000 -3.344) 3.856 12.835 ( 3.232 0.000 1.920) 3.759 12.890 ( 7.839 0.000 1.564) 7.993 13.072 ( 3.220 0.000 -0.140) 3.223 13.819 ( 24.658 0.000 -8.274) 26.009 14.134 ( -7.833 -0.000 2.484) 8.218 14.186 ( -11.473 -0.000 -7.891) 13.925 15.108 ( -1.435 -0.000 4.449) 4.675 15.340 ( 1.201 0.000 20.161) 20.197 17.645 ( -0.757 -0.000 -3.190) 3.279 17.902 ( 2.356 0.000 12.825) 13.039 19.973 ( 3.822 0.000 8.479) 9.300 20.199 ( 8.007 0.000 -17.202) 18.974 26.147 ( -15.445 -0.000 26.784) 30.918 27.073 ( 7.704 0.000 -19.573) 21.034 27.589 ( -0.047 -0.000 -4.455) 4.455 27.733 ( 2.253 0.000 17.682) 17.825 ======================= Grid point 514 (257/300) ======================= q-point: ( 0.27 0.18 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.227 ( 7.562 5.929 5.064) 10.862 2.434 ( 9.555 -4.805 -1.466) 10.795 3.047 ( 14.597 11.516 8.930) 20.626 3.229 ( 15.688 0.413 11.478) 19.443 4.223 ( -3.675 17.224 10.922) 20.723 4.248 ( -8.995 5.081 0.400) 10.339 4.446 ( 0.657 12.426 9.714) 15.786 4.621 ( 4.643 3.976 -9.134) 10.991 4.923 ( -3.814 -0.794 7.312) 8.285 5.176 ( -4.886 -16.189 8.645) 18.992 5.464 ( 1.407 -3.498 -9.213) 9.954 5.722 ( 4.968 -11.069 -14.738) 19.089 6.629 ( -9.643 -1.173 9.014) 13.252 7.105 ( -12.208 -0.335 -0.798) 12.239 7.363 ( -13.252 -4.094 -9.289) 16.693 7.466 ( -7.388 -0.263 -3.225) 8.066 8.031 ( 3.777 -6.409 8.356) 11.187 8.282 ( -1.789 -7.675 0.330) 7.888 8.780 ( 19.872 6.510 7.565) 22.237 9.167 ( 20.346 -1.560 -2.473) 20.555 10.582 ( -3.864 -0.380 4.135) 5.672 11.227 ( 9.028 6.900 -7.401) 13.561 11.408 ( -9.913 2.954 -2.005) 10.536 11.533 ( -9.138 1.579 6.876) 11.544 11.554 ( -8.941 3.099 -11.210) 14.670 11.936 ( -2.835 1.340 -1.697) 3.565 12.894 ( 1.299 -3.756 -0.763) 4.047 12.940 ( 9.056 0.640 2.066) 9.311 13.065 ( 7.095 4.054 4.291) 9.229 13.923 ( 15.998 3.168 -5.038) 17.069 14.052 ( -15.003 0.483 -6.455) 16.340 14.169 ( -2.475 -4.526 -1.743) 5.445 15.039 ( 6.197 7.497 6.423) 11.656 15.382 ( 2.444 0.731 11.395) 11.677 17.610 ( 1.122 3.508 -2.771) 4.609 17.891 ( -0.372 5.094 13.949) 14.855 19.961 ( 4.039 4.622 3.735) 7.186 20.270 ( 7.187 -3.913 -12.729) 15.132 26.064 ( -13.914 2.728 28.670) 31.984 27.032 ( 1.202 4.102 -21.338) 21.762 27.558 ( 6.193 4.926 -1.994) 8.160 27.774 ( 2.889 0.588 15.917) 16.188 ======================= Grid point 515 (258/300) ======================= q-point: ( 0.36 0.18 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.151 ( 4.404 6.979 7.970) 11.473 2.583 ( 7.791 -3.918 -3.386) 9.355 2.875 ( 14.493 17.763 1.027) 22.949 3.352 ( 18.896 1.932 15.022) 24.217 3.803 ( -1.903 24.807 9.826) 26.750 4.018 ( -7.735 13.031 -6.990) 16.688 4.165 ( 1.193 16.904 -3.379) 17.279 4.656 ( 2.726 -1.995 -8.929) 9.547 4.955 ( -4.830 -5.757 14.592) 16.413 5.468 ( -0.136 -13.008 5.643) 14.180 5.532 ( -2.327 -7.850 -1.802) 8.384 5.979 ( 3.924 -13.603 -11.697) 18.365 6.627 ( -5.290 -2.903 8.303) 10.264 7.073 ( -8.282 -2.498 2.562) 9.022 7.255 ( -9.050 0.673 -10.977) 14.243 7.500 ( -7.362 -5.602 -2.449) 9.570 8.210 ( 3.941 -7.044 11.978) 14.444 8.491 ( -3.197 -16.417 -0.533) 16.734 8.795 ( 20.898 8.363 0.562) 22.516 9.256 ( 6.512 1.366 2.088) 6.974 10.569 ( -1.980 0.535 1.114) 2.334 11.069 ( -1.063 11.054 -0.312) 11.109 11.190 ( -14.765 8.850 0.047) 17.214 11.433 ( -9.698 3.470 -4.386) 11.195 11.474 ( 3.910 2.830 -3.821) 6.156 11.851 ( -2.974 5.514 -1.645) 6.478 12.909 ( -1.274 2.405 -1.352) 3.039 13.031 ( 10.439 -3.004 3.798) 11.507 13.134 ( 9.964 -4.915 4.999) 12.183 13.847 ( -2.843 6.968 -2.168) 7.831 14.023 ( -1.795 -2.273 -0.516) 2.942 14.201 ( -3.720 -1.051 -6.118) 7.237 14.959 ( 11.696 9.410 1.318) 15.069 15.402 ( 6.265 0.497 -0.755) 6.330 17.523 ( 1.627 6.358 -1.690) 6.777 17.751 ( -3.225 10.253 13.373) 17.157 19.906 ( 4.941 4.566 1.197) 6.833 20.373 ( 4.312 -4.189 -9.046) 10.861 25.954 ( -11.928 4.482 30.696) 33.236 26.875 ( -4.919 6.894 -18.534) 20.378 27.486 ( 11.037 9.075 -1.382) 14.355 27.803 ( 4.528 1.512 8.413) 9.673 ======================= Grid point 517 (259/300) ======================= q-point: ( 0.45 0.18 -0.56) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.086 ( 4.518 4.426 10.036) 11.863 2.580 ( 6.887 13.252 -17.486) 22.996 2.700 ( 11.295 5.667 8.074) 14.996 3.339 ( -1.682 25.244 11.176) 27.659 3.458 ( 17.653 4.787 9.365) 20.548 3.638 ( 3.239 22.742 -16.618) 28.352 3.894 ( -7.397 6.529 -4.251) 10.743 4.644 ( -4.483 0.559 -4.356) 6.276 5.120 ( 1.064 -9.434 9.451) 13.396 5.595 ( -0.948 -5.929 -8.658) 10.536 5.785 ( -3.662 -14.524 16.735) 22.460 6.197 ( 1.714 -8.818 -9.915) 13.379 6.705 ( -0.750 -6.462 8.315) 10.557 7.041 ( -5.512 0.868 5.544) 7.866 7.237 ( -4.807 -4.762 -7.660) 10.221 7.537 ( -5.200 -4.315 -6.037) 9.061 8.342 ( 3.413 -0.248 17.204) 17.541 8.684 ( 14.474 8.768 -10.481) 19.906 8.884 ( 1.965 -16.989 2.429) 17.274 9.285 ( -3.975 -5.642 1.625) 7.091 10.513 ( -0.266 5.012 -3.007) 5.851 10.869 ( -2.716 7.812 7.181) 10.953 10.913 ( -13.421 10.164 3.793) 17.257 11.266 ( -8.613 5.887 -7.308) 12.738 11.430 ( 3.949 4.781 -1.782) 6.452 11.705 ( -1.078 7.037 -3.046) 7.743 12.855 ( 1.077 2.418 2.522) 3.656 13.191 ( 8.604 -5.332 4.009) 10.887 13.348 ( 8.591 -8.997 1.431) 12.522 13.704 ( -2.471 5.595 -1.652) 6.335 14.010 ( -1.406 3.044 -0.069) 3.354 14.138 ( -7.059 1.618 -8.233) 10.965 14.855 ( 11.951 10.036 -0.806) 15.627 15.440 ( 3.171 -0.339 -6.729) 7.446 17.402 ( 4.273 7.851 -0.085) 8.939 17.554 ( -2.715 9.468 7.288) 12.253 19.879 ( 5.869 2.548 2.402) 6.834 20.443 ( 0.332 -2.951 -8.001) 8.535 25.844 ( -9.788 4.559 32.012) 33.784 26.668 ( -7.846 6.814 -14.355) 17.721 27.370 ( 12.503 11.881 -0.314) 17.251 27.803 ( 5.111 2.967 -1.993) 6.237 ======================= Grid point 518 (260/300) ======================= q-point: ( 0.55 0.18 -0.56) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.096 ( 3.512 -0.568 5.895) 6.885 2.322 ( 10.534 15.319 -14.928) 23.843 2.689 ( 4.454 4.243 6.648) 9.058 2.885 ( -2.523 23.025 8.070) 24.528 3.179 ( 4.559 23.530 -19.884) 31.142 3.396 ( -0.616 8.130 -7.260) 10.917 3.893 ( 8.380 -4.203 4.730) 10.501 4.586 ( -6.908 0.208 -2.401) 7.316 5.307 ( 2.898 -7.157 5.275) 9.351 5.653 ( -6.542 -3.456 -2.334) 7.758 6.035 ( -1.919 -11.543 12.337) 17.004 6.295 ( 0.116 -3.107 -5.625) 6.427 6.871 ( 0.945 -8.114 9.689) 12.673 7.025 ( -0.993 -1.561 4.630) 4.986 7.278 ( -2.503 -2.498 -3.957) 5.307 7.579 ( -4.004 -5.222 -9.178) 11.294 8.300 ( 0.188 8.794 15.975) 18.236 8.503 ( 13.333 16.550 -13.059) 24.944 9.253 ( -2.732 -19.700 7.059) 21.104 9.475 ( -3.270 -17.055 -3.044) 17.630 10.373 ( 2.942 9.736 -4.660) 11.188 10.619 ( -11.689 12.239 8.915) 19.128 10.807 ( -1.072 -0.505 4.865) 5.007 11.096 ( -7.077 4.261 -5.154) 9.737 11.349 ( 3.673 5.871 -0.691) 6.959 11.594 ( 0.288 3.629 -4.689) 5.936 12.853 ( 2.679 -0.002 3.591) 4.481 13.324 ( 3.678 -2.119 1.209) 4.413 13.546 ( 6.063 -2.815 4.691) 8.166 13.616 ( 1.416 -0.176 -4.753) 4.963 13.900 ( -1.652 6.816 -3.062) 7.652 14.057 ( -7.530 -1.814 -7.968) 11.112 14.767 ( 12.388 8.505 -0.672) 15.041 15.388 ( -8.169 3.677 -4.333) 9.951 17.327 ( 8.752 4.772 -3.194) 10.468 17.408 ( -0.194 4.886 1.134) 5.020 19.901 ( 6.664 0.747 4.625) 8.146 20.453 ( -3.673 -0.739 -7.787) 8.642 25.769 ( -7.860 2.315 32.667) 33.679 26.480 ( -8.550 4.508 -9.121) 13.290 27.235 ( 12.790 11.420 -1.104) 17.182 27.755 ( 3.281 4.089 -11.204) 12.369 ======================= Grid point 519 (261/300) ======================= q-point: (-0.36 0.18 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.051 ( 4.334 10.571 -2.323) 11.659 2.199 ( 3.064 3.826 -7.385) 8.864 2.545 ( 1.671 8.873 -1.957) 9.239 2.626 ( 2.041 5.584 8.892) 10.696 2.825 ( 3.103 11.519 -17.038) 20.799 3.217 ( -8.590 4.898 -12.949) 16.293 4.078 ( 14.931 -4.481 5.258) 16.452 4.536 ( -7.686 -0.598 -1.292) 7.817 5.435 ( 4.148 -3.196 1.295) 5.394 5.612 ( -9.958 1.437 3.322) 10.595 6.226 ( -0.985 -8.011 7.419) 10.963 6.324 ( 0.173 -0.618 -0.430) 0.773 6.966 ( -4.257 -1.857 13.265) 14.055 7.137 ( 6.220 -5.878 -1.841) 8.754 7.273 ( -1.748 0.651 2.689) 3.273 7.637 ( -2.526 -4.718 -11.586) 12.762 8.115 ( -1.659 11.304 8.910) 14.489 8.272 ( 5.803 11.778 -10.824) 17.016 9.602 ( -2.499 -18.189 11.317) 21.567 9.775 ( 0.682 -12.823 -0.630) 12.856 10.179 ( 6.288 13.816 -5.574) 16.170 10.343 ( -12.739 7.011 3.061) 14.859 10.875 ( 3.963 -4.256 0.725) 5.861 11.026 ( -6.866 -3.370 1.747) 7.846 11.292 ( 5.863 3.238 0.852) 6.752 11.555 ( -0.448 -0.397 -6.554) 6.582 12.889 ( 3.392 -0.174 4.401) 5.559 13.297 ( -3.122 3.675 -4.751) 6.770 13.513 ( 1.649 4.489 2.918) 5.602 13.703 ( -2.146 6.251 -4.672) 8.094 13.791 ( 6.527 -5.334 0.819) 8.469 14.108 ( -3.538 -7.875 -7.127) 11.195 14.709 ( 13.342 7.131 -1.476) 15.200 15.181 ( -16.673 7.702 -1.199) 18.405 17.282 ( 0.762 2.888 3.956) 4.956 17.431 ( 9.835 -3.461 -13.161) 16.791 19.950 ( 7.075 0.517 6.294) 9.484 20.392 ( -6.479 1.822 -7.675) 10.208 25.770 ( -6.698 -2.019 32.991) 33.725 26.356 ( -7.817 1.298 -2.787) 8.400 27.145 ( 13.322 7.179 -4.460) 15.777 27.665 ( -0.342 3.610 -17.713) 18.081 ======================= Grid point 520 (262/300) ======================= q-point: (-0.27 0.18 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.877 ( 3.608 9.857 0.879) 10.534 2.028 ( -2.699 7.316 -7.390) 10.744 2.536 ( 5.707 1.587 9.239) 10.975 2.711 ( -0.266 -10.300 -11.069) 15.122 2.745 ( 3.743 -7.271 -7.608) 11.169 3.056 ( -9.660 2.562 -15.548) 18.483 4.264 ( 14.927 -2.966 3.359) 15.585 4.489 ( -8.593 -0.500 -0.550) 8.625 5.489 ( -7.259 4.650 5.895) 10.444 5.495 ( 3.598 0.452 -1.286) 3.847 6.295 ( -1.519 4.412 5.267) 7.037 6.337 ( 0.113 -2.830 1.097) 3.038 6.991 ( -5.079 -2.700 14.034) 15.167 7.201 ( 0.748 0.570 -6.769) 6.834 7.296 ( 5.943 0.334 11.868) 13.277 7.642 ( -3.948 0.754 -8.893) 9.759 7.955 ( 5.398 6.091 0.670) 8.166 8.143 ( -5.185 0.443 -9.036) 10.428 9.752 ( -0.862 12.226 8.280) 14.791 9.873 ( -0.908 7.477 -0.092) 7.532 10.014 ( 5.890 -6.482 8.046) 11.893 10.340 ( -7.976 -14.239 -8.125) 18.231 10.985 ( 3.497 -4.709 4.084) 7.147 11.141 ( -3.836 -11.253 -2.775) 12.209 11.331 ( 7.058 -2.416 5.285) 9.142 11.576 ( -1.244 -3.668 -7.744) 8.658 12.897 ( 3.573 3.477 5.503) 7.425 13.166 ( -6.030 5.804 -6.049) 10.327 13.454 ( -4.501 1.411 1.884) 5.079 13.535 ( 4.719 7.262 -10.550) 13.650 13.994 ( 6.204 -7.938 6.872) 12.195 14.205 ( -0.090 -3.767 -4.505) 5.873 14.690 ( 9.927 3.893 -2.386) 10.927 14.910 ( -15.499 6.485 -4.202) 17.318 17.282 ( -1.395 -2.167 8.856) 9.224 17.571 ( 7.623 -6.932 -19.277) 21.858 19.989 ( 4.956 1.697 8.241) 9.765 20.280 ( -5.283 3.535 -8.879) 10.920 25.862 ( -7.720 -6.769 33.450) 34.990 26.318 ( -4.464 -2.133 2.475) 5.532 27.152 ( 13.783 1.192 -8.033) 15.997 27.568 ( -4.196 1.107 -21.397) 21.833 ======================= Grid point 521 (263/300) ======================= q-point: (-0.18 0.18 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.774 ( -0.837 1.797 8.306) 8.540 1.985 ( 1.572 -4.257 -9.692) 10.702 2.544 ( 7.255 4.966 16.000) 18.257 2.898 ( -5.764 -13.351 -9.531) 17.388 2.915 ( -1.817 -3.957 -6.772) 8.051 3.137 ( 2.235 -23.742 -17.064) 29.323 4.401 ( 7.112 -1.288 1.546) 7.391 4.432 ( -3.479 0.065 -0.995) 3.619 5.339 ( -8.281 6.033 10.405) 14.603 5.504 ( 7.245 2.684 -5.584) 9.533 6.141 ( -4.649 10.826 9.960) 15.428 6.319 ( 2.357 5.429 -6.432) 8.741 7.049 ( -7.042 -4.488 12.427) 14.972 7.175 ( -4.623 -0.361 3.775) 5.980 7.344 ( 13.470 2.801 8.678) 16.266 7.564 ( -3.974 0.498 -8.848) 9.712 7.961 ( 7.972 0.954 2.823) 8.510 8.120 ( -8.350 -4.150 -12.128) 15.298 9.450 ( -3.012 17.338 6.394) 18.723 9.574 ( 2.620 19.471 -5.078) 20.293 10.306 ( 2.046 -13.417 15.185) 20.366 10.563 ( -3.980 -13.477 -8.453) 16.399 11.141 ( 0.959 -9.235 8.855) 12.830 11.313 ( 0.285 -9.155 -5.454) 10.661 11.502 ( 3.107 -9.617 4.467) 11.050 11.640 ( -1.888 -5.650 -6.711) 8.973 12.828 ( 1.869 6.155 4.299) 7.736 12.979 ( -2.554 8.725 -8.781) 12.639 13.392 ( -5.751 1.263 1.973) 6.210 13.491 ( 5.866 1.883 -7.739) 9.892 14.152 ( -0.900 -4.007 6.645) 7.812 14.241 ( 7.947 0.245 -2.234) 8.258 14.629 ( -8.801 1.032 3.829) 9.653 14.833 ( 6.211 -2.756 -14.734) 16.225 17.373 ( -2.259 -6.767 12.386) 14.294 17.706 ( 1.475 -7.186 -19.724) 21.044 19.962 ( -4.716 3.315 10.701) 12.155 20.193 ( 5.325 3.100 -11.617) 13.150 26.001 ( -12.694 -8.863 33.379) 36.795 26.395 ( 3.277 -6.169 4.341) 8.224 27.257 ( 13.281 -3.262 -8.196) 15.944 27.503 ( -7.039 -2.671 -22.559) 23.783 ======================= Grid point 522 (264/300) ======================= q-point: (-0.09 0.18 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.835 ( -2.389 -6.246 14.579) 16.040 2.115 ( 6.393 -6.699 -8.842) 12.803 2.545 ( 6.780 2.981 21.466) 22.708 2.857 ( -2.020 -2.525 -19.680) 19.943 3.315 ( -2.883 -25.610 8.774) 27.225 3.603 ( 4.462 -25.218 -15.232) 29.797 4.361 ( -8.483 -0.629 -0.521) 8.523 4.504 ( 9.820 -0.259 -1.898) 10.005 5.189 ( -7.832 6.009 13.409) 16.651 5.479 ( 6.866 4.311 -6.803) 10.584 5.885 ( -6.153 13.477 10.595) 18.214 6.161 ( 4.246 11.746 -10.984) 16.633 7.019 ( -13.924 0.942 10.096) 17.224 7.214 ( -2.107 -4.554 2.243) 5.496 7.448 ( 12.040 -2.653 13.807) 18.510 7.567 ( -2.007 -3.851 -10.596) 11.451 7.968 ( 1.519 3.411 6.207) 7.243 8.135 ( 3.368 -1.897 -12.851) 13.420 9.086 ( -7.474 19.363 3.255) 21.009 9.235 ( 5.640 17.567 -1.933) 18.551 10.545 ( -0.011 -7.842 13.975) 16.025 10.740 ( 0.350 -9.218 -7.698) 12.015 11.359 ( -2.173 -11.838 9.214) 15.158 11.476 ( -1.492 -9.024 -0.794) 9.181 11.670 ( -0.969 -5.972 0.342) 6.059 11.742 ( -1.851 -8.016 -7.492) 11.127 12.753 ( 1.989 2.732 0.344) 3.397 12.820 ( 3.917 6.391 -5.906) 9.543 13.291 ( -10.234 4.738 1.748) 11.412 13.489 ( 10.919 3.250 -3.494) 11.916 14.185 ( -4.600 -3.345 2.960) 6.412 14.311 ( 7.079 -0.627 -1.958) 7.371 14.646 ( -5.491 -6.836 6.481) 10.904 14.950 ( 10.221 -5.886 -15.616) 19.570 17.530 ( -2.150 -8.770 14.068) 16.716 17.772 ( -5.121 -4.118 -15.681) 17.003 19.872 ( -7.699 2.034 8.946) 11.977 20.188 ( 11.369 2.536 -11.130) 16.111 26.109 ( -16.532 -7.851 30.909) 35.921 26.596 ( 9.704 -8.751 2.896) 13.384 27.413 ( 11.379 -4.524 -3.007) 12.609 27.493 ( -8.311 -6.108 -21.517) 23.861 ======================= Grid point 526 (265/300) ======================= q-point: ( 0.27 0.27 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.378 ( 2.959 0.000 -4.204) 5.140 2.412 ( 11.868 0.000 3.903) 12.494 3.325 ( 14.476 0.000 7.573) 16.337 3.332 ( 17.058 0.000 18.311) 25.025 4.238 ( -6.390 -0.000 -5.565) 8.474 4.345 ( -3.766 -0.000 15.995) 16.432 4.632 ( 1.033 0.000 13.945) 13.983 4.817 ( -2.427 -0.000 7.725) 8.097 4.821 ( -3.766 -0.000 17.402) 17.805 4.955 ( 3.531 0.000 -25.113) 25.360 5.406 ( -1.061 -0.000 2.286) 2.520 5.621 ( 5.699 0.000 -21.906) 22.635 6.577 ( -6.015 -0.000 8.438) 10.362 7.017 ( -14.135 -0.000 1.596) 14.225 7.181 ( -10.968 -0.000 -8.542) 13.902 7.408 ( -11.615 -0.000 -5.330) 12.780 7.980 ( 1.562 0.000 4.033) 4.325 8.212 ( -0.986 -0.000 -1.181) 1.539 8.994 ( 15.646 0.000 18.659) 24.351 9.324 ( 25.822 0.000 -9.618) 27.555 10.557 ( -3.617 -0.000 4.240) 5.573 11.321 ( -2.027 -0.000 -5.985) 6.319 11.374 ( -6.540 -0.000 -14.793) 16.174 11.474 ( -13.015 -0.000 12.430) 17.997 11.536 ( 3.667 0.000 -9.708) 10.377 11.915 ( -4.887 -0.000 1.385) 5.079 12.868 ( 2.241 0.000 -3.106) 3.831 13.017 ( 8.237 0.000 2.410) 8.583 13.169 ( 7.747 0.000 6.490) 10.107 13.909 ( -14.762 -0.000 -6.862) 16.279 14.040 ( -6.417 -0.000 3.415) 7.269 14.129 ( 15.688 0.000 -15.065) 21.750 15.180 ( 9.150 0.000 4.466) 10.181 15.406 ( -2.434 -0.000 22.590) 22.721 17.678 ( 6.840 0.000 -2.784) 7.385 17.964 ( -0.143 -0.000 13.697) 13.698 20.050 ( 2.867 0.000 6.949) 7.518 20.249 ( 7.176 0.000 -16.972) 18.427 26.046 ( -12.307 -0.000 29.363) 31.838 27.030 ( -1.432 -0.000 -26.315) 26.353 27.662 ( 9.780 0.000 1.582) 9.907 27.820 ( 1.058 0.000 18.325) 18.356 ======================= Grid point 528 (266/300) ======================= q-point: ( 0.36 0.27 -0.56) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.312 ( 3.186 5.935 2.770) 7.283 2.549 ( 6.676 -4.275 -3.608) 8.709 3.290 ( 14.482 13.241 9.457) 21.783 3.507 ( 14.647 -1.099 18.052) 23.273 4.119 ( -5.234 7.671 -8.440) 12.549 4.237 ( -1.644 16.879 16.697) 23.799 4.470 ( -1.802 10.363 7.646) 13.004 4.666 ( 6.350 4.857 -11.542) 14.040 4.901 ( -2.233 1.723 5.263) 5.971 5.151 ( -4.185 -18.650 16.300) 25.120 5.450 ( 1.169 -2.576 -11.215) 11.567 5.735 ( 4.086 -11.666 -15.127) 19.535 6.576 ( -2.081 -1.446 7.989) 8.382 6.949 ( -9.360 -3.029 0.584) 9.855 7.153 ( -11.796 -3.498 -8.694) 15.066 7.327 ( -10.616 -3.267 -2.845) 11.466 8.078 ( 0.598 -8.165 4.528) 9.356 8.257 ( -1.611 -6.670 -1.588) 7.043 9.077 ( 15.559 5.745 15.744) 22.868 9.424 ( 17.931 5.548 -6.426) 19.840 10.551 ( -2.045 -0.821 2.622) 3.425 11.200 ( -14.792 6.073 -11.406) 19.641 11.227 ( -5.626 6.188 1.595) 8.513 11.400 ( -10.385 0.731 0.999) 10.459 11.571 ( 12.020 2.367 -7.118) 14.169 11.877 ( -5.234 0.943 1.695) 5.582 12.897 ( 1.465 -1.643 -3.708) 4.312 13.074 ( 7.454 -0.427 2.088) 7.753 13.206 ( 8.319 2.330 8.316) 11.991 13.805 ( -15.488 -1.492 -6.685) 16.935 14.014 ( -0.805 -0.598 2.870) 3.041 14.189 ( 6.443 1.316 -9.238) 11.339 15.204 ( 14.471 6.146 0.436) 15.728 15.428 ( -2.532 -0.277 14.535) 14.757 17.677 ( 9.361 5.562 -2.667) 11.210 17.918 ( -2.684 6.620 14.136) 15.839 20.030 ( 3.920 4.233 2.616) 6.335 20.308 ( 4.017 -3.490 -12.191) 13.302 25.994 ( -10.327 2.463 30.753) 32.534 26.918 ( -4.285 4.863 -24.921) 25.750 27.699 ( 12.076 4.641 1.295) 13.002 27.857 ( 1.294 0.043 14.556) 14.613 ======================= Grid point 529 (267/300) ======================= q-point: ( 0.45 0.27 -0.56) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.232 ( 2.837 5.750 8.757) 10.853 2.628 ( 2.187 -1.435 -9.503) 9.857 3.102 ( 13.396 17.812 8.758) 23.946 3.659 ( 12.778 -0.174 19.426) 23.253 3.814 ( 3.838 21.615 -6.621) 22.930 3.885 ( -8.761 16.064 8.415) 20.140 4.188 ( 4.000 20.487 -7.932) 22.330 4.616 ( -3.480 1.780 -11.455) 12.103 4.973 ( 0.264 -8.244 13.630) 15.931 5.472 ( -0.345 -6.454 -9.873) 11.800 5.503 ( -3.182 -14.177 16.020) 21.628 5.984 ( 2.706 -13.136 -13.101) 18.749 6.630 ( 1.458 -3.360 7.910) 8.717 6.987 ( -5.536 -3.978 4.708) 8.284 7.102 ( -6.801 -2.977 -10.102) 12.537 7.369 ( -9.264 -7.297 -3.959) 12.439 8.277 ( 0.912 -10.212 8.804) 13.514 8.451 ( -1.961 -15.662 -1.590) 15.864 9.064 ( 13.969 8.661 7.014) 17.870 9.347 ( 6.862 10.353 -2.651) 12.700 10.554 ( -0.335 0.401 0.388) 0.652 10.946 ( -12.483 7.636 -8.094) 16.722 11.045 ( -8.151 8.863 11.007) 16.314 11.293 ( -6.875 3.846 -6.415) 10.159 11.568 ( 8.894 5.052 -2.802) 10.606 11.794 ( -3.878 4.536 -1.409) 6.132 12.913 ( 2.204 1.010 0.598) 2.497 13.162 ( 5.491 -3.604 1.209) 6.679 13.282 ( 7.737 -3.683 6.062) 10.496 13.720 ( -8.902 0.135 -5.578) 10.506 14.033 ( -0.203 -0.074 3.135) 3.142 14.143 ( -1.648 3.719 -4.403) 5.994 15.146 ( 14.249 10.758 -2.796) 18.072 15.434 ( -1.593 -0.282 0.406) 1.668 17.608 ( 10.823 8.557 -2.903) 14.099 17.744 ( -4.306 10.816 12.575) 17.136 19.990 ( 5.999 3.804 1.479) 7.256 20.366 ( -0.760 -3.192 -9.139) 9.710 25.918 ( -8.343 4.179 31.911) 33.248 26.722 ( -6.220 7.326 -20.468) 22.612 27.659 ( 11.269 9.037 3.580) 14.882 27.878 ( 3.363 1.481 3.124) 4.823 ======================= Grid point 530 (268/300) ======================= q-point: ( 0.55 0.27 -0.56) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.174 ( 2.444 4.260 11.096) 12.135 2.576 ( 1.543 6.543 -16.383) 17.709 2.901 ( 10.651 13.318 11.275) 20.443 3.349 ( -2.904 25.461 13.416) 28.925 3.513 ( -6.337 15.773 -11.115) 20.310 3.717 ( 8.896 22.319 -12.845) 27.245 3.913 ( 12.232 -0.756 6.834) 14.033 4.526 ( -9.681 0.645 -4.925) 10.881 5.183 ( 3.216 -9.485 7.996) 12.816 5.523 ( -4.778 -4.762 -6.864) 9.624 5.807 ( -1.607 -14.181 16.491) 21.809 6.180 ( 1.075 -8.277 -11.051) 13.849 6.755 ( 2.218 -6.670 9.440) 11.769 6.996 ( -1.814 -1.452 0.668) 2.418 7.170 ( -1.866 -6.242 -2.641) 7.030 7.425 ( -6.985 -6.019 -6.963) 11.554 8.434 ( 1.625 -0.758 15.404) 15.508 8.736 ( 0.121 -9.703 -6.161) 11.495 9.017 ( 13.153 3.055 -2.534) 13.739 9.220 ( -5.547 -1.421 0.906) 5.797 10.518 ( 2.216 4.159 -1.509) 4.948 10.726 ( -12.628 7.016 0.618) 14.460 10.858 ( -3.671 6.731 11.682) 13.973 11.142 ( -4.749 6.065 -8.307) 11.329 11.503 ( 5.415 6.706 0.035) 8.619 11.666 ( -2.220 5.662 -4.055) 7.309 12.914 ( 5.147 1.765 5.849) 7.989 13.269 ( 0.441 -4.550 -1.237) 4.736 13.455 ( 5.737 -8.050 1.601) 10.014 13.662 ( -1.120 0.994 -3.465) 3.774 13.994 ( -1.399 4.354 0.904) 4.662 14.029 ( -4.705 4.622 -4.079) 7.755 15.031 ( 13.141 10.388 -2.006) 16.871 15.383 ( -7.364 2.733 -5.232) 9.438 17.519 ( 12.016 8.330 -4.835) 15.400 17.540 ( -3.074 9.296 7.119) 12.106 19.987 ( 7.453 2.027 3.903) 8.654 20.379 ( -4.944 -2.020 -8.719) 10.224 25.838 ( -6.796 4.330 32.838) 33.813 26.510 ( -6.443 6.637 -15.571) 18.112 27.541 ( 8.984 11.628 5.769) 15.786 27.847 ( 4.435 4.395 -9.197) 11.116 ======================= Grid point 531 (269/300) ======================= q-point: (-0.36 -0.73 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.143 ( -0.322 1.936 6.780) 7.058 2.388 ( 5.697 11.236 -16.011) 20.373 2.790 ( 4.763 8.562 10.233) 14.168 2.881 ( -2.159 22.516 12.163) 25.682 3.155 ( 0.544 19.179 -17.657) 26.075 3.300 ( -2.730 15.882 -16.819) 23.293 4.108 ( 15.724 -4.740 7.297) 17.971 4.448 ( -11.003 -1.051 -3.904) 11.722 5.375 ( 3.918 -6.900 5.264) 9.522 5.541 ( -7.527 -2.264 -0.944) 7.917 6.056 ( -1.144 -10.884 12.006) 16.245 6.278 ( 0.421 -3.907 -6.393) 7.504 6.895 ( -3.584 -5.257 12.227) 13.783 7.071 ( 7.146 -5.216 -4.303) 9.838 7.247 ( -1.429 -2.826 2.994) 4.358 7.482 ( -4.753 -6.295 -9.609) 12.432 8.337 ( -2.583 11.882 14.617) 19.013 8.610 ( 8.364 17.019 -14.141) 23.656 9.252 ( -1.286 -17.706 8.492) 19.679 9.425 ( -1.557 -20.022 -4.467) 20.573 10.426 ( 3.714 8.986 -0.502) 9.736 10.471 ( -9.476 10.916 5.082) 15.322 10.826 ( 0.915 -2.140 5.962) 6.401 10.998 ( -3.736 4.070 -5.454) 7.763 11.417 ( 4.035 5.518 1.638) 7.029 11.554 ( -2.323 3.471 -6.083) 7.379 12.945 ( 6.720 0.909 7.729) 10.282 13.285 ( -5.478 0.404 -8.313) 9.964 13.625 ( 1.794 -2.771 4.496) 5.577 13.668 ( 5.685 -1.344 1.066) 5.939 13.872 ( -0.053 6.273 -4.328) 7.621 13.941 ( -5.131 -2.047 -6.403) 8.457 14.953 ( 13.581 8.147 -0.043) 15.837 15.205 ( -14.095 6.898 -3.530) 16.084 17.382 ( -1.450 6.795 3.355) 7.716 17.477 ( 10.720 3.234 -10.146) 15.110 20.027 ( 7.351 0.770 7.255) 10.357 20.342 ( -6.833 -0.346 -9.547) 11.745 25.785 ( -6.255 2.288 33.900) 34.548 26.346 ( -5.121 3.850 -10.475) 12.279 27.394 ( 7.312 10.597 4.681) 13.699 27.745 ( 3.437 6.788 -18.075) 19.611 ======================= Grid point 532 (270/300) ======================= q-point: (-0.27 -0.73 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.074 ( -1.862 6.281 1.344) 6.687 2.208 ( 3.352 11.193 -10.832) 15.933 2.574 ( 1.960 3.996 -0.355) 4.465 2.687 ( 2.904 10.912 0.248) 11.295 2.836 ( 5.658 9.954 -4.725) 12.387 3.049 ( -7.134 6.066 -15.470) 18.084 4.306 ( 13.059 -3.837 4.491) 14.333 4.393 ( -10.427 -1.999 -3.633) 11.222 5.487 ( -6.055 0.367 4.307) 7.440 5.518 ( 4.042 -2.163 1.141) 4.724 6.236 ( -1.176 -7.455 7.438) 10.597 6.322 ( -0.214 -1.031 -0.705) 1.267 6.946 ( -4.668 -1.911 12.910) 13.861 7.195 ( 3.422 -1.713 -9.974) 10.683 7.299 ( 2.232 -3.456 12.280) 12.951 7.561 ( -1.762 -6.224 -12.575) 14.141 8.095 ( -5.115 11.124 9.265) 15.354 8.320 ( 6.211 15.719 -11.913) 20.678 9.610 ( -2.189 -18.946 11.887) 22.473 9.781 ( 1.052 -15.589 -2.537) 15.829 10.166 ( -12.269 9.631 4.630) 16.270 10.288 ( 10.343 13.018 -4.986) 17.358 10.937 ( -6.034 -3.962 1.589) 7.391 10.952 ( 6.771 -5.040 -0.289) 8.446 11.379 ( 3.258 1.506 3.205) 4.812 11.490 ( -3.725 -0.234 -7.530) 8.404 12.988 ( 5.447 1.185 8.290) 9.990 13.188 ( -4.702 3.042 -10.516) 11.915 13.527 ( -3.695 7.831 5.900) 10.478 13.697 ( 4.871 7.056 -8.556) 12.113 13.882 ( 3.790 -7.598 4.816) 9.762 14.036 ( -2.475 -10.084 -8.934) 13.698 14.879 ( -1.523 9.038 3.267) 9.731 14.970 ( 1.099 7.425 -5.261) 9.166 17.284 ( -2.630 2.736 5.494) 6.677 17.507 ( 6.970 -1.759 -16.381) 17.889 20.061 ( 1.474 1.581 10.077) 10.306 20.280 ( -1.648 0.944 -10.995) 11.158 25.788 ( -7.649 -1.450 35.066) 35.920 26.269 ( -1.924 -0.113 -5.033) 5.390 27.288 ( 5.568 5.815 0.307) 8.057 27.598 ( 2.579 6.885 -22.753) 23.912 ======================= Grid point 533 (271/300) ======================= q-point: (-0.18 0.27 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.945 ( 4.058 7.537 -0.309) 8.565 1.976 ( 0.590 9.203 -7.060) 11.614 2.614 ( -0.507 -5.591 -4.745) 7.351 2.720 ( 7.642 -10.289 -6.514) 14.377 2.776 ( 2.505 -0.354 4.005) 4.737 2.896 ( -3.601 3.048 -14.373) 15.128 4.331 ( -11.448 -1.502 -2.594) 11.834 4.469 ( 11.275 -2.432 0.944) 11.573 5.395 ( -6.699 4.111 6.951) 10.492 5.587 ( 8.034 0.679 -2.199) 8.357 6.281 ( -3.016 5.225 5.868) 8.417 6.340 ( -0.412 -2.979 1.470) 3.347 6.968 ( -4.806 -1.903 13.402) 14.365 7.172 ( -3.033 1.957 1.871) 4.066 7.405 ( 3.044 -2.859 1.357) 4.391 7.608 ( 5.955 1.295 -8.003) 10.059 7.961 ( -5.643 -1.152 -0.023) 5.759 8.108 ( 5.017 8.604 -6.274) 11.771 9.741 ( -4.819 15.147 8.493) 18.022 9.843 ( -3.413 1.774 2.773) 4.742 10.136 ( 5.366 -6.061 4.747) 9.385 10.251 ( 1.556 -12.037 -7.460) 14.246 10.982 ( -5.761 -6.180 4.776) 9.706 11.157 ( 7.554 -9.596 -4.550) 13.033 11.420 ( 1.550 -3.108 5.660) 6.640 11.484 ( -6.316 -4.336 -8.062) 11.122 12.963 ( -1.500 5.149 4.925) 7.281 13.102 ( 5.054 4.786 -5.450) 8.840 13.386 ( -5.869 3.633 2.459) 7.327 13.588 ( 6.505 5.642 -9.967) 13.172 14.049 ( -2.890 -6.796 5.385) 9.139 14.198 ( 3.182 -8.245 -7.002) 11.276 14.634 ( -13.075 7.192 1.725) 15.022 14.940 ( 18.193 5.261 -6.184) 19.923 17.271 ( -4.599 -2.849 9.531) 10.959 17.569 ( 1.328 -4.615 -18.770) 19.375 19.997 ( -8.564 3.666 8.176) 12.395 20.274 ( 9.362 1.290 -8.891) 12.975 25.843 ( -11.400 -4.831 35.097) 37.217 26.317 ( 3.555 -4.925 0.645) 6.108 27.258 ( 0.336 -0.707 -8.023) 8.061 27.475 ( 5.861 4.550 -20.571) 21.868 ======================= Grid point 534 (272/300) ======================= q-point: (-0.09 0.27 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.822 ( 3.486 3.853 7.670) 9.264 2.007 ( 6.216 -7.015 -9.381) 13.261 2.710 ( 2.161 4.930 2.817) 6.075 2.781 ( 4.818 -4.470 -5.231) 8.400 2.910 ( -0.719 -14.085 4.567) 14.824 3.134 ( 5.072 -24.193 -16.704) 29.834 4.269 ( -11.300 -1.335 -3.266) 11.838 4.570 ( 9.173 -0.581 -0.915) 9.237 5.271 ( -5.943 5.913 9.688) 12.812 5.596 ( 8.027 3.697 -5.267) 10.288 6.104 ( -5.502 11.537 11.044) 16.892 6.328 ( 1.725 4.615 -5.546) 7.418 6.974 ( -9.249 0.488 11.760) 14.970 7.118 ( -5.712 -1.040 7.998) 9.883 7.461 ( 0.650 -3.222 -11.248) 11.718 7.600 ( 10.597 5.061 5.481) 12.959 7.989 ( -2.062 -3.845 -7.874) 9.001 8.091 ( 7.728 -2.041 1.479) 8.129 9.400 ( -5.962 18.098 5.369) 19.796 9.590 ( 1.082 17.629 -3.448) 17.996 10.396 ( 2.837 -11.564 12.518) 17.276 10.502 ( -0.120 -13.928 -5.986) 15.161 11.100 ( -7.882 -10.669 3.659) 13.760 11.371 ( 7.729 -6.828 -2.170) 10.539 11.511 ( -5.043 -6.526 1.567) 8.395 11.545 ( -6.080 -8.762 -5.617) 12.053 12.842 ( -0.087 5.583 0.357) 5.595 13.019 ( 8.643 8.964 -2.318) 12.666 13.305 ( -5.714 2.426 2.992) 6.891 13.566 ( 6.753 0.552 -6.794) 9.595 14.093 ( -6.719 -2.648 0.025) 7.222 14.334 ( 4.981 -2.620 -6.575) 8.655 14.521 ( -6.179 -3.002 5.318) 8.688 14.994 ( 19.412 1.754 -9.036) 21.484 17.357 ( -6.116 -8.095 12.906) 16.416 17.621 ( -4.077 -5.025 -16.935) 18.130 19.876 ( -8.446 3.185 6.472) 11.107 20.306 ( 12.046 2.296 -8.004) 14.644 25.916 ( -14.574 -6.405 33.197) 36.817 26.498 ( 8.161 -8.916 4.714) 12.974 27.265 ( -7.328 -5.213 -20.662) 22.535 27.470 ( 12.110 0.142 -8.254) 14.656 ======================= Grid point 540 (273/300) ======================= q-point: ( 0.36 0.36 -0.56) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.393 ( -0.043 -0.000 1.067) 1.068 2.534 ( 5.054 0.000 -3.543) 6.172 3.557 ( 11.107 0.000 16.480) 19.874 3.589 ( 9.528 0.000 16.548) 19.095 4.163 ( 0.265 0.000 -9.711) 9.715 4.375 ( 1.515 0.000 9.229) 9.352 4.687 ( -0.563 -0.000 15.120) 15.130 4.745 ( -9.343 -0.000 10.495) 14.051 4.862 ( 0.523 0.000 18.103) 18.111 4.983 ( 10.126 0.000 -22.964) 25.098 5.382 ( -3.258 -0.000 -0.239) 3.267 5.624 ( 5.451 0.000 -22.430) 23.083 6.570 ( 1.149 0.000 7.822) 7.906 6.852 ( -9.714 -0.000 2.618) 10.061 7.006 ( -9.333 -0.000 -7.983) 12.281 7.212 ( -13.295 -0.000 -4.416) 14.009 8.007 ( 1.289 0.000 1.777) 2.195 8.179 ( -2.785 -0.000 -2.023) 3.442 9.264 ( 11.614 0.000 22.071) 24.940 9.613 ( 20.318 0.000 -11.623) 23.408 10.533 ( -1.305 -0.000 3.334) 3.581 11.117 ( -17.298 -0.000 -8.910) 19.458 11.269 ( -0.989 -0.000 -10.739) 10.785 11.320 ( -13.473 -0.000 9.511) 16.492 11.686 ( 15.521 0.000 -10.197) 18.571 11.843 ( -7.043 -0.000 5.897) 9.186 12.891 ( 3.153 0.000 -3.861) 4.985 13.110 ( 2.845 0.000 0.513) 2.891 13.306 ( 7.326 0.000 7.905) 10.778 13.663 ( -13.911 -0.000 -5.138) 14.830 13.984 ( -3.618 -0.000 5.806) 6.841 14.249 ( 7.705 0.000 -15.035) 16.895 15.373 ( 16.277 0.000 -2.268) 16.435 15.423 ( -6.330 -0.000 22.660) 23.528 17.810 ( 12.706 0.000 -3.145) 13.089 17.987 ( -3.342 -0.000 13.302) 13.715 20.096 ( 0.378 0.000 6.076) 6.088 20.281 ( 5.229 0.000 -15.759) 16.604 26.005 ( -8.251 -0.000 31.591) 32.651 26.894 ( -3.645 -0.000 -27.653) 27.893 27.830 ( 12.304 0.000 0.721) 12.325 27.884 ( -0.758 -0.000 16.733) 16.750 ======================= Grid point 541 (274/300) ======================= q-point: ( 0.45 0.36 -0.56) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.348 ( -0.121 3.888 6.177) 7.300 2.580 ( 0.153 -2.533 -6.523) 6.999 3.492 ( 7.372 12.682 14.466) 20.602 3.724 ( 6.542 -1.951 16.395) 17.759 4.066 ( 1.690 9.182 -5.061) 10.620 4.298 ( 2.189 20.811 14.062) 25.212 4.435 ( -5.520 4.143 0.962) 6.969 4.711 ( 6.843 10.891 -17.725) 21.900 4.903 ( -1.565 0.186 12.723) 12.820 5.173 ( -1.636 -18.340 18.180) 25.875 5.418 ( 0.414 -2.075 -12.049) 12.233 5.730 ( 2.930 -11.705 -17.099) 20.928 6.620 ( 4.222 -1.439 7.031) 8.327 6.856 ( -4.389 -5.697 4.088) 8.272 6.976 ( -8.620 -3.394 -8.253) 12.407 7.158 ( -11.001 -5.456 -4.136) 12.957 8.097 ( 0.462 -8.035 3.378) 8.728 8.222 ( -2.477 -7.445 -2.088) 8.119 9.307 ( 7.603 6.545 19.549) 21.973 9.629 ( 15.237 9.806 -11.439) 21.429 10.547 ( 0.399 -0.925 2.780) 2.957 10.942 ( -15.691 3.945 -8.782) 18.409 11.152 ( -6.936 6.465 6.597) 11.551 11.281 ( -4.143 0.138 -5.228) 6.672 11.716 ( 7.209 4.418 -1.734) 8.630 11.815 ( -1.485 0.499 -1.579) 2.225 12.923 ( 3.785 -1.150 -1.895) 4.386 13.129 ( -1.000 -1.907 -1.615) 2.691 13.338 ( 5.944 1.891 8.236) 10.331 13.609 ( -8.106 -2.905 -4.828) 9.872 14.001 ( -2.286 -2.337 6.628) 7.390 14.224 ( 2.640 4.097 -9.688) 10.845 15.400 ( -1.486 3.530 10.751) 11.413 15.431 ( 11.123 3.297 -2.418) 11.851 17.838 ( 14.199 6.227 -4.311) 16.092 17.907 ( -5.634 7.323 12.800) 15.787 20.083 ( 1.650 2.103 4.024) 4.831 20.301 ( 1.348 -1.435 -12.306) 12.463 25.986 ( -6.160 2.486 32.374) 33.048 26.768 ( -4.049 5.278 -25.188) 26.052 27.862 ( 5.666 4.492 7.835) 10.661 27.919 ( 5.175 -0.132 3.559) 6.282 ======================= Grid point 542 (275/300) ======================= q-point: (-0.45 -0.64 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.288 ( 0.021 4.171 11.733) 12.452 2.585 ( -3.389 -0.446 -9.526) 10.121 3.284 ( 6.268 16.307 13.366) 21.997 3.691 ( -3.186 11.215 -8.791) 14.602 3.832 ( -6.321 21.719 23.172) 32.382 4.017 ( 17.018 6.178 4.832) 18.738 4.209 ( 2.525 19.302 -8.892) 21.401 4.491 ( -7.052 6.177 -14.147) 16.971 5.040 ( 2.106 -9.216 12.709) 15.839 5.404 ( -2.661 -3.494 -12.669) 13.408 5.546 ( -0.151 -15.534 19.472) 24.910 5.966 ( 1.717 -12.984 -15.199) 20.064 6.697 ( 2.191 -2.882 9.031) 9.730 6.941 ( -1.742 -3.017 -2.372) 4.214 7.025 ( 0.273 -7.933 -1.777) 8.134 7.223 ( -8.480 -8.393 -5.068) 12.963 8.308 ( -0.086 -12.513 7.280) 14.477 8.422 ( -1.455 -15.444 -1.734) 15.609 9.206 ( 0.948 9.497 13.023) 16.145 9.447 ( 10.459 16.329 -11.724) 22.659 10.565 ( 1.222 0.376 2.648) 2.941 10.746 ( -11.771 4.884 -4.373) 13.473 10.990 ( -5.021 7.508 11.850) 14.900 11.210 ( -0.698 4.465 -8.700) 9.803 11.645 ( -1.198 5.246 4.609) 7.085 11.762 ( 3.743 5.455 -7.668) 10.128 12.972 ( 4.120 -0.608 4.281) 5.973 13.171 ( -2.514 -4.460 -4.645) 6.912 13.393 ( 5.003 -2.780 6.528) 8.682 13.612 ( -3.391 -2.434 -6.395) 7.637 14.028 ( -2.035 -0.306 5.189) 5.582 14.119 ( -0.418 6.480 -2.670) 7.021 15.299 ( 2.210 7.995 2.439) 8.646 15.398 ( 3.332 5.393 -6.725) 9.242 17.710 ( -6.180 10.288 10.358) 15.853 17.778 ( 14.353 9.636 -7.042) 18.667 20.074 ( 3.695 1.510 4.485) 6.004 20.299 ( -3.189 -1.070 -10.072) 10.618 25.939 ( -4.541 4.401 32.815) 33.418 26.576 ( -4.262 7.367 -19.701) 21.461 27.782 ( 1.078 8.021 9.614) 12.567 27.944 ( 8.475 2.831 -8.113) 12.069 ======================= Grid point 543 (276/300) ======================= q-point: (-0.36 -0.64 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.223 ( -1.721 4.849 13.232) 14.197 2.510 ( -3.670 3.746 -12.670) 13.713 3.059 ( 4.774 13.537 12.231) 18.858 3.349 ( -4.722 26.073 17.252) 31.618 3.376 ( -4.412 15.398 -14.876) 21.860 3.756 ( 6.567 27.090 -18.656) 33.541 4.161 ( 15.104 -2.795 9.390) 18.003 4.343 ( -12.854 0.625 -7.156) 14.725 5.256 ( 2.545 -9.428 8.745) 13.109 5.432 ( -4.085 -3.947 -6.793) 8.855 5.849 ( -0.546 -13.240 16.417) 21.097 6.154 ( 1.108 -8.481 -12.278) 14.963 6.786 ( -3.646 -5.127 11.374) 12.998 7.017 ( 6.633 -4.842 -8.892) 12.104 7.169 ( 0.737 -5.573 5.459) 7.836 7.310 ( -4.827 -7.052 -6.728) 10.877 8.490 ( -1.460 -0.620 14.342) 14.430 8.706 ( -0.898 -12.380 -4.618) 13.244 9.122 ( -4.624 -5.119 0.937) 6.962 9.191 ( 9.301 12.248 -7.220) 16.990 10.538 ( -7.276 4.540 4.782) 9.819 10.591 ( 0.795 4.378 0.192) 4.453 10.870 ( 0.231 4.642 10.766) 11.726 11.083 ( 0.918 7.018 -9.220) 11.624 11.530 ( -4.262 5.568 4.122) 8.134 11.653 ( 4.282 7.315 -7.098) 11.055 13.013 ( 2.331 0.102 9.537) 9.818 13.225 ( -0.235 -2.696 -9.291) 9.678 13.524 ( 2.685 -6.550 3.559) 7.923 13.634 ( -1.815 -3.768 -5.882) 7.217 13.971 ( -1.569 7.810 1.009) 8.029 13.992 ( -0.370 4.053 0.393) 4.089 15.170 ( -1.490 6.672 1.618) 7.025 15.259 ( 1.437 8.646 -7.142) 11.307 17.508 ( -4.653 8.262 5.184) 10.806 17.671 ( 12.365 9.851 -10.832) 19.164 20.092 ( 2.331 0.394 7.280) 7.655 20.270 ( -3.558 -0.726 -9.950) 10.592 25.877 ( -4.006 4.906 33.359) 33.955 26.390 ( -3.139 6.084 -13.747) 15.357 27.622 ( -1.778 9.938 7.308) 12.463 27.893 ( 8.828 7.008 -16.038) 19.602 ======================= Grid point 544 (277/300) ======================= q-point: (-0.27 -0.64 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.128 ( -5.120 4.300 7.231) 9.848 2.367 ( -1.435 6.599 -12.998) 14.648 2.824 ( -5.418 18.147 12.195) 22.525 2.948 ( 3.975 13.490 8.699) 16.536 3.081 ( -0.786 11.390 -13.676) 17.815 3.266 ( 6.719 24.814 -18.784) 31.839 4.253 ( -13.594 -2.037 -6.126) 15.049 4.339 ( 12.514 -3.752 6.223) 14.470 5.427 ( -2.777 -4.417 3.597) 6.337 5.473 ( 1.837 -4.874 1.925) 5.553 6.084 ( -0.715 -9.803 11.784) 15.345 6.264 ( 0.918 -4.619 -7.212) 8.613 6.871 ( -4.795 -4.891 11.003) 12.961 7.151 ( 6.288 -4.506 -10.839) 13.316 7.263 ( -0.052 -3.733 9.039) 9.780 7.401 ( -1.068 -6.507 -6.979) 9.602 8.321 ( -6.607 13.879 13.077) 20.181 8.649 ( 4.532 14.932 -14.733) 21.461 9.266 ( -1.212 -17.093 8.577) 19.163 9.412 ( 2.219 -19.791 -4.911) 20.512 10.317 ( -10.904 11.066 8.060) 17.502 10.552 ( 9.808 6.857 -0.659) 11.985 10.868 ( 1.902 -0.529 5.086) 5.456 10.969 ( 3.090 2.919 -5.938) 7.302 11.405 ( -6.923 3.682 2.129) 8.125 11.546 ( 3.912 5.768 -4.659) 8.383 13.025 ( -2.999 0.154 6.192) 6.882 13.223 ( 5.562 2.324 -9.212) 11.009 13.618 ( -4.565 0.928 4.897) 6.759 13.720 ( -0.454 -6.573 -1.808) 6.832 13.865 ( 0.338 -0.947 -3.127) 3.285 13.898 ( 3.270 5.624 -3.821) 7.545 14.970 ( -13.943 8.407 -0.611) 16.293 15.165 ( 12.627 6.201 -0.868) 14.094 17.354 ( -3.514 5.833 1.892) 7.068 17.568 ( 7.632 6.086 -14.554) 17.525 20.085 ( -6.304 0.815 5.885) 8.662 20.270 ( 4.587 -0.957 -6.732) 8.202 25.822 ( -5.278 3.492 33.890) 34.476 26.274 ( -0.363 2.618 -7.434) 7.890 27.430 ( -4.301 8.732 1.134) 9.800 27.765 ( 8.851 9.477 -19.420) 23.352 ======================= Grid point 545 (278/300) ======================= q-point: (-0.18 -0.64 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.015 ( -5.600 4.503 -0.383) 7.196 2.215 ( 1.331 7.591 -7.767) 10.942 2.578 ( -1.563 3.796 0.694) 4.163 2.692 ( 1.358 13.872 -9.913) 17.104 2.904 ( -1.199 6.068 -13.175) 14.555 2.998 ( 11.054 8.667 3.636) 14.510 4.195 ( -13.248 -2.761 -5.556) 14.628 4.489 ( 9.030 -3.210 3.011) 10.046 5.417 ( -4.029 1.161 3.154) 5.247 5.613 ( 6.247 -3.944 3.019) 7.981 6.245 ( -1.044 -6.391 7.070) 9.588 6.313 ( -0.558 -0.741 -0.882) 1.280 6.929 ( -3.704 -2.347 12.394) 13.147 7.189 ( -0.486 0.665 -2.490) 2.623 7.353 ( -0.017 -3.855 -0.269) 3.864 7.537 ( 4.653 -8.446 -6.469) 11.611 8.041 ( -6.684 11.238 8.617) 15.659 8.359 ( 4.992 15.147 -12.110) 20.025 9.622 ( -1.702 -17.290 11.767) 20.983 9.788 ( 1.514 -18.663 -4.430) 19.241 10.028 ( -9.640 12.606 7.470) 17.540 10.439 ( 12.554 12.539 -4.617) 18.335 10.873 ( -3.513 -1.850 1.394) 4.208 11.061 ( 8.449 -6.272 -1.536) 10.634 11.322 ( -8.691 -1.182 -1.793) 8.952 11.481 ( 1.869 3.038 -0.306) 3.580 12.988 ( -4.841 0.709 -1.749) 5.196 13.218 ( 8.813 2.845 -0.996) 9.314 13.466 ( -6.055 7.911 4.582) 10.965 13.746 ( 4.772 7.656 -7.674) 11.844 13.876 ( -5.691 -8.807 -1.107) 10.544 14.029 ( 5.103 -9.833 -3.352) 11.574 14.704 ( -12.277 9.218 -0.498) 15.361 15.166 ( 15.642 4.826 -0.142) 16.370 17.250 ( -3.823 2.654 3.121) 5.603 17.508 ( 1.555 0.982 -16.573) 16.675 20.001 ( -9.539 2.427 3.304) 10.383 20.332 ( 8.832 -0.864 -3.680) 9.607 25.793 ( -8.246 0.673 33.674) 34.675 26.273 ( 3.540 -2.251 -0.156) 4.197 27.253 ( -6.788 4.936 -9.685) 12.816 27.629 ( 10.117 8.039 -16.868) 21.249 ======================= Grid point 546 (279/300) ======================= q-point: (-0.09 0.36 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.939 ( 1.221 -0.985 -7.077) 7.249 2.042 ( 6.138 12.414 -1.295) 13.909 2.563 ( -1.884 -6.703 -7.515) 10.245 2.692 ( -4.119 -9.547 -6.214) 12.113 2.833 ( 4.989 -4.157 -15.721) 17.009 2.980 ( 13.240 5.216 11.040) 18.011 4.142 ( -12.601 -2.306 -5.477) 13.932 4.595 ( 5.877 -2.206 0.383) 6.289 5.351 ( -2.657 4.178 5.684) 7.538 5.695 ( 7.347 0.784 -1.219) 7.488 6.253 ( -3.841 6.108 6.665) 9.822 6.334 ( -0.994 -2.806 1.425) 3.300 6.949 ( -4.062 -0.251 12.747) 13.381 7.133 ( -4.615 3.705 7.015) 9.178 7.389 ( -0.371 -2.381 -12.085) 12.323 7.747 ( 12.720 -5.448 0.213) 13.839 7.865 ( -6.236 2.213 -2.133) 6.953 8.172 ( 5.154 5.868 -3.382) 8.511 9.686 ( -6.499 15.434 8.940) 18.984 9.804 ( -3.269 2.763 2.565) 4.990 10.151 ( -0.210 -17.389 -3.476) 17.734 10.358 ( 10.737 0.140 0.975) 10.782 10.908 ( -6.029 -4.907 3.245) 8.423 11.257 ( 4.991 -9.076 -3.779) 11.025 11.330 ( -6.122 -6.307 -6.000) 10.642 11.450 ( -2.132 0.739 3.698) 4.332 12.928 ( -1.021 3.371 -1.997) 4.049 13.199 ( 3.290 4.698 0.021) 5.736 13.340 ( 0.757 3.581 5.805) 6.862 13.634 ( 4.529 4.785 -9.223) 11.335 13.973 ( -6.608 -5.607 -2.359) 8.982 14.242 ( 4.548 -8.718 -4.011) 10.620 14.490 ( -7.525 4.591 0.640) 8.838 15.198 ( 18.401 4.352 -2.828) 19.119 17.224 ( -5.373 -2.671 6.753) 9.033 17.490 ( -3.230 -2.538 -15.571) 16.104 19.890 ( -7.561 3.167 3.835) 9.051 20.397 ( 9.408 0.273 -4.713) 10.526 25.797 ( -11.123 -2.334 32.934) 34.840 26.406 ( 6.412 -7.217 6.574) 11.680 27.126 ( -7.463 0.079 -20.902) 22.194 27.572 ( 11.240 3.398 -10.857) 15.993 ======================= Grid point 553 (280/300) ======================= q-point: (-0.55 -0.55 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.383 ( -3.188 -0.000 6.792) 7.503 2.537 ( -2.130 -0.000 -4.458) 4.941 3.716 ( 1.790 0.000 15.102) 15.208 3.728 ( 4.220 0.000 18.625) 19.097 4.183 ( 6.143 0.000 -7.511) 9.703 4.372 ( -6.547 -0.000 -5.431) 8.506 4.713 ( -3.615 -0.000 15.539) 15.954 4.713 ( -0.676 -0.000 20.418) 20.429 4.941 ( 1.989 0.000 13.356) 13.503 5.052 ( 10.008 0.000 -20.777) 23.062 5.312 ( -5.265 -0.000 -2.152) 5.688 5.621 ( 5.257 0.000 -23.127) 23.717 6.659 ( 7.155 0.000 6.365) 9.576 6.772 ( -2.976 -0.000 6.001) 6.699 6.869 ( -6.276 -0.000 -6.717) 9.193 7.019 ( -10.709 -0.000 -5.466) 12.023 8.036 ( 2.057 0.000 1.689) 2.661 8.124 ( -3.892 -0.000 -1.722) 4.256 9.452 ( 3.693 0.000 21.106) 21.427 9.814 ( 13.908 0.000 -14.937) 20.409 10.552 ( 2.315 0.000 4.861) 5.384 10.847 ( -15.753 -0.000 -8.062) 17.697 11.176 ( -10.590 -0.000 8.860) 13.807 11.256 ( 3.858 0.000 -7.974) 8.858 11.755 ( -8.871 -0.000 8.224) 12.097 11.852 ( 12.700 0.000 -10.864) 16.713 12.942 ( 5.797 0.000 -2.056) 6.151 13.073 ( -6.958 -0.000 -2.834) 7.514 13.415 ( 4.484 0.000 5.852) 7.372 13.525 ( -4.146 -0.000 -1.436) 4.387 13.974 ( -1.720 -0.000 9.020) 9.182 14.258 ( 1.134 0.000 -13.662) 13.709 15.386 ( -9.207 -0.000 20.740) 22.692 15.593 ( 17.014 0.000 -10.122) 19.798 17.956 ( -7.247 -0.000 11.302) 13.426 17.993 ( 14.197 0.000 -5.017) 15.058 20.103 ( -2.383 -0.000 6.251) 6.690 20.288 ( 2.907 0.000 -13.608) 13.915 26.031 ( -3.855 -0.000 33.099) 33.323 26.753 ( -2.378 -0.000 -27.509) 27.612 27.909 ( -3.161 -0.000 13.257) 13.628 27.995 ( 10.832 0.000 -2.370) 11.088 ======================= Grid point 554 (281/300) ======================= q-point: (-0.45 -0.55 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.353 ( -3.333 1.765 11.062) 11.687 2.519 ( -5.620 -1.217 -4.340) 7.205 3.595 ( -0.015 11.691 16.777) 20.449 3.810 ( 1.711 2.358 3.931) 4.893 4.115 ( 2.204 8.000 10.123) 13.089 4.283 ( -12.051 7.352 1.809) 14.232 4.405 ( 3.710 13.199 2.537) 13.943 4.729 ( 5.125 17.662 -20.875) 27.820 4.941 ( -1.586 -3.823 19.209) 19.650 5.201 ( -2.124 -14.689 8.998) 17.356 5.410 ( 4.124 -4.557 -5.832) 8.472 5.702 ( 2.294 -11.087 -19.710) 22.730 6.705 ( 1.761 0.494 6.503) 6.755 6.855 ( 0.503 -4.406 -2.798) 5.244 6.887 ( 3.268 -7.654 2.124) 8.589 7.008 ( -7.209 -6.552 -5.205) 11.045 8.119 ( 0.808 -7.235 3.663) 8.149 8.179 ( -2.285 -8.767 -1.722) 9.222 9.412 ( -1.971 8.408 17.289) 19.326 9.761 ( 9.139 10.810 -16.372) 21.643 10.588 ( 3.087 0.028 6.500) 7.195 10.716 ( -11.817 1.780 -5.169) 13.020 11.084 ( -5.838 4.163 10.396) 12.629 11.266 ( 5.076 1.762 -8.161) 9.771 11.684 ( -8.848 2.122 7.870) 12.030 11.885 ( 9.559 3.408 -10.457) 14.572 12.980 ( 1.000 -0.471 2.064) 2.341 13.061 ( -2.052 -4.041 -5.173) 6.877 13.427 ( 3.261 1.139 6.380) 7.255 13.536 ( -1.721 -2.409 -3.948) 4.934 13.999 ( -2.244 -1.728 9.480) 9.894 14.205 ( -0.328 3.328 -8.998) 9.600 15.332 ( -10.152 2.149 14.392) 17.743 15.619 ( 14.988 7.232 -12.906) 21.059 17.844 ( -8.855 7.166 9.947) 15.123 18.021 ( 13.684 6.151 -7.589) 16.813 20.094 ( -3.033 -0.155 6.490) 7.165 20.274 ( 1.220 0.678 -11.570) 11.654 26.042 ( -1.959 2.786 33.285) 33.459 26.640 ( -1.839 5.325 -24.217) 24.863 27.879 ( -4.751 2.845 9.737) 11.202 28.045 ( 10.152 1.618 -5.840) 11.823 ======================= Grid point 555 (282/300) ======================= q-point: (-0.36 -0.55 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.309 ( -3.734 3.159 15.230) 15.996 2.477 ( -7.569 -0.129 -5.753) 9.508 3.350 ( -4.820 14.894 13.857) 20.907 3.638 ( 2.319 14.346 -13.157) 19.603 3.815 ( -7.846 23.645 23.294) 34.107 4.164 ( -6.764 6.171 -1.513) 9.280 4.251 ( 12.826 6.335 1.223) 14.357 4.361 ( -1.161 15.138 -18.674) 24.068 5.102 ( -0.286 -9.385 13.470) 16.419 5.327 ( -1.700 -3.655 -11.479) 12.166 5.624 ( 2.005 -13.368 16.676) 21.467 5.933 ( 1.650 -13.352 -16.941) 21.633 6.710 ( -4.215 -1.576 8.598) 9.705 6.952 ( 6.350 -5.115 -9.414) 12.454 7.073 ( 0.238 -6.577 3.579) 7.491 7.133 ( 2.591 -9.231 -1.331) 9.680 8.326 ( -1.066 -13.055 6.785) 14.752 8.402 ( -0.165 -15.683 -1.278) 15.736 9.198 ( -7.041 11.920 10.090) 17.131 9.526 ( 6.217 15.906 -15.504) 23.066 10.561 ( -7.390 3.395 4.714) 9.399 10.647 ( 2.625 0.703 2.589) 3.753 10.991 ( -0.529 5.231 11.950) 13.055 11.220 ( 6.441 6.034 -9.387) 12.884 11.580 ( -8.527 3.704 5.709) 10.910 11.825 ( 6.915 7.292 -8.349) 13.065 12.989 ( -5.591 -2.111 4.280) 7.351 13.159 ( 5.616 -4.919 -5.326) 9.171 13.472 ( 3.595 -2.198 6.338) 7.611 13.548 ( -3.335 -1.865 -7.638) 8.541 14.018 ( -2.399 -0.328 6.588) 7.019 14.107 ( -0.140 6.098 -1.728) 6.340 15.208 ( -11.175 4.663 5.403) 13.259 15.505 ( 10.707 11.504 -11.211) 19.305 17.637 ( -8.077 8.961 6.880) 13.888 17.940 ( 12.402 10.434 -11.924) 20.122 20.081 ( -6.267 -0.430 5.415) 8.294 20.256 ( 2.739 0.408 -7.606) 8.095 26.014 ( -0.958 5.191 32.883) 33.304 26.472 ( -1.327 6.899 -17.035) 18.427 27.759 ( -6.670 6.955 5.198) 10.949 28.048 ( 9.569 4.449 -11.428) 15.555 ======================= Grid point 556 (283/300) ======================= q-point: (-0.27 -0.55 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.213 ( -6.448 6.340 14.649) 17.216 2.394 ( -7.094 2.195 -7.698) 10.696 3.054 ( -10.753 12.380 6.428) 17.613 3.334 ( -1.840 21.666 12.299) 24.981 3.347 ( 2.926 19.246 -6.648) 20.571 3.797 ( 8.462 26.607 -17.153) 32.769 4.117 ( -13.979 0.582 -10.143) 17.280 4.375 ( 9.949 -2.516 8.477) 13.311 5.293 ( -1.853 -8.807 6.868) 11.321 5.384 ( 0.682 -5.122 -3.551) 6.269 5.900 ( -0.125 -12.005 15.109) 19.299 6.131 ( 2.061 -9.117 -13.122) 16.111 6.754 ( -4.453 -4.965 8.176) 10.551 7.086 ( 6.957 -5.255 -9.864) 13.165 7.175 ( -2.808 -5.338 2.273) 6.446 7.306 ( 5.817 -5.344 2.193) 8.198 8.476 ( -7.464 1.806 12.814) 14.938 8.696 ( 1.887 -11.858 -3.766) 12.584 9.031 ( -6.522 -3.374 -3.110) 7.974 9.293 ( 7.296 7.102 -7.036) 12.376 10.422 ( -8.695 6.507 7.343) 13.109 10.676 ( 6.636 1.088 4.404) 8.039 10.941 ( 4.632 3.167 10.175) 11.620 11.107 ( 7.096 8.915 -10.579) 15.549 11.444 ( -8.499 5.094 3.879) 10.641 11.702 ( 4.553 8.323 -5.343) 10.888 12.987 ( -6.057 -1.126 2.182) 6.536 13.270 ( 6.484 -2.436 -5.409) 8.788 13.556 ( -5.463 -4.816 -6.492) 9.756 13.564 ( 1.693 -3.482 4.480) 5.922 13.970 ( 0.758 7.490 2.021) 7.795 13.997 ( 0.126 2.975 1.151) 3.193 15.019 ( -12.304 7.114 -0.323) 14.217 15.362 ( 7.954 8.062 -3.900) 11.978 17.446 ( -5.590 7.007 2.225) 9.236 17.780 ( 9.450 11.884 -15.681) 21.827 20.034 ( -9.457 -0.088 1.450) 9.568 20.284 ( 5.410 -1.072 -1.614) 5.747 25.950 ( -1.669 6.490 31.686) 32.387 26.332 ( 0.413 4.803 -8.111) 9.435 27.555 ( -8.181 9.259 -0.678) 12.373 27.969 ( 8.463 8.190 -15.572) 19.524 ======================= Grid point 557 (284/300) ======================= q-point: (-0.18 -0.55 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.055 ( -8.313 5.812 7.418) 12.566 2.274 ( -5.461 3.801 -9.385) 11.504 2.743 ( -11.305 13.075 11.030) 20.505 2.967 ( -0.025 14.626 -5.931) 15.782 3.084 ( 3.843 14.890 -8.359) 17.503 3.361 ( 12.654 21.656 -9.254) 26.734 4.033 ( -13.029 -2.908 -7.793) 15.458 4.498 ( 6.901 -2.612 5.829) 9.404 5.384 ( -2.037 -2.850 -1.137) 3.683 5.535 ( 2.062 -8.036 7.434) 11.139 6.116 ( -0.455 -8.810 11.016) 14.113 6.258 ( 2.169 -4.836 -7.926) 9.535 6.849 ( -2.699 -5.695 9.014) 10.998 7.176 ( 1.721 -1.653 -5.086) 5.618 7.253 ( -2.138 -5.101 -1.661) 5.775 7.443 ( 6.436 -5.260 1.928) 8.533 8.239 ( -10.818 13.557 11.599) 20.866 8.641 ( 1.751 12.882 -15.997) 20.613 9.279 ( -0.487 -20.666 6.792) 21.759 9.448 ( 4.466 -15.111 -3.276) 16.094 10.216 ( -7.569 10.874 10.058) 16.634 10.694 ( 9.186 4.656 2.198) 10.530 10.921 ( 5.268 7.424 -1.174) 9.178 11.030 ( 5.983 -1.276 -4.014) 7.317 11.302 ( -6.645 4.148 3.280) 8.492 11.577 ( 1.283 6.336 -2.238) 6.841 12.954 ( -4.152 0.080 -3.398) 5.366 13.311 ( 4.202 1.194 -2.031) 4.818 13.563 ( -3.629 4.442 4.128) 7.067 13.646 ( -5.956 -9.332 -5.612) 12.412 13.883 ( 1.712 4.726 -1.267) 5.184 13.962 ( 6.057 -0.575 -0.087) 6.085 14.787 ( -10.399 8.343 -1.794) 13.453 15.316 ( 6.997 2.818 1.595) 7.710 17.304 ( -3.311 4.954 -0.887) 6.024 17.599 ( 5.010 9.470 -16.751) 19.884 19.964 ( -8.840 0.575 -0.058) 8.859 20.354 ( 5.647 -1.967 0.417) 5.994 25.866 ( -4.103 5.747 30.036) 30.855 26.285 ( 3.018 0.773 1.649) 3.525 27.313 ( -8.583 8.807 -9.442) 15.504 27.829 ( 7.664 9.153 -16.044) 19.998 ======================= Grid point 558 (285/300) ======================= q-point: (-0.09 -0.55 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.933 ( -5.149 2.045 -1.262) 5.683 2.186 ( -1.769 0.795 -5.592) 5.919 2.538 ( -4.457 3.096 2.188) 5.851 2.682 ( 2.073 15.388 -8.794) 17.844 2.843 ( 0.920 5.645 -17.413) 18.328 3.206 ( 13.263 7.514 5.186) 16.102 3.995 ( -10.935 -2.991 -6.322) 12.980 4.587 ( 3.547 -2.186 2.845) 5.045 5.393 ( -0.636 0.660 1.154) 1.474 5.693 ( 2.183 -5.353 5.165) 7.752 6.257 ( -0.494 -5.054 6.330) 8.115 6.305 ( 0.070 0.424 -1.015) 1.102 6.932 ( -1.575 -2.343 12.048) 12.375 7.169 ( -2.644 1.370 3.374) 4.500 7.313 ( -1.570 -3.350 -8.920) 9.657 7.625 ( 8.221 -9.064 -2.316) 12.454 7.966 ( -7.823 8.926 7.754) 14.177 8.372 ( 2.417 12.872 -12.282) 17.955 9.644 ( -0.709 -14.131 10.941) 17.885 9.791 ( 1.613 -19.516 -6.166) 20.531 9.954 ( -5.244 13.685 10.877) 18.251 10.588 ( 9.522 12.561 -4.757) 16.465 10.850 ( -0.098 1.045 0.649) 1.234 11.114 ( -3.246 -4.767 -3.297) 6.643 11.255 ( 3.836 -0.808 1.085) 4.068 11.482 ( -1.621 3.349 0.221) 3.727 12.937 ( -0.413 -0.706 -4.334) 4.410 13.268 ( -3.472 3.730 -0.662) 5.139 13.453 ( 3.085 5.060 5.813) 8.302 13.751 ( -2.776 0.604 -4.608) 5.413 13.791 ( -1.455 -2.839 -6.294) 7.056 14.110 ( 6.316 -8.030 -0.031) 10.217 14.567 ( -6.122 8.184 -2.495) 10.521 15.341 ( 7.100 0.629 2.111) 7.434 17.212 ( -1.384 2.737 -1.084) 3.253 17.459 ( 0.203 4.223 -14.512) 15.115 19.891 ( -6.099 1.579 1.184) 6.410 20.429 ( 5.088 -1.819 -1.290) 5.555 25.794 ( -6.871 3.072 30.115) 31.041 26.352 ( 4.393 -3.989 9.776) 11.436 27.093 ( -6.896 5.537 -19.889) 21.766 27.709 ( 7.546 6.151 -13.654) 16.769 ======================= Grid point 565 (286/300) ======================= q-point: (-0.45 -0.45 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.353 ( -5.528 -0.000 12.137) 13.336 2.459 ( -7.176 -0.000 -0.260) 7.180 3.780 ( 0.957 0.000 14.607) 14.638 3.810 ( -0.219 -0.000 12.197) 12.199 4.164 ( -17.898 -0.000 -7.335) 19.343 4.254 ( 4.224 0.000 1.410) 4.453 4.681 ( -8.307 -0.000 14.775) 16.950 4.802 ( 1.634 0.000 14.638) 14.729 4.984 ( -0.150 -0.000 3.128) 3.131 5.122 ( 8.983 0.000 -17.525) 19.693 5.253 ( -1.910 -0.000 1.325) 2.324 5.617 ( 5.536 0.000 -23.275) 23.925 6.748 ( 2.942 0.000 5.278) 6.042 6.783 ( -2.513 -0.000 -6.876) 7.321 6.868 ( 11.559 0.000 9.494) 14.958 6.896 ( -3.199 -0.000 -5.494) 6.357 8.065 ( -3.554 -0.000 -0.752) 3.633 8.078 ( 2.815 0.000 2.253) 3.606 9.500 ( -5.955 -0.000 15.615) 16.712 9.875 ( 1.728 0.000 -19.616) 19.692 10.638 ( 5.885 0.000 10.671) 12.186 10.647 ( -8.321 -0.000 -4.166) 9.306 11.098 ( -4.382 -0.000 9.375) 10.348 11.324 ( 9.338 0.000 -6.765) 11.531 11.644 ( -11.034 -0.000 8.237) 13.770 11.966 ( 8.564 0.000 -10.812) 13.793 12.946 ( -8.127 -0.000 -2.386) 8.470 13.039 ( 7.687 0.000 0.102) 7.688 13.477 ( 2.761 0.000 3.577) 4.518 13.490 ( -1.639 -0.000 -1.652) 2.327 13.984 ( -2.482 -0.000 11.497) 11.762 14.205 ( -1.765 -0.000 -11.915) 12.045 15.311 ( -10.328 -0.000 17.215) 20.075 15.770 ( 14.158 0.000 -16.285) 21.579 17.862 ( -10.506 -0.000 8.224) 13.342 18.154 ( 10.973 0.000 -8.063) 13.617 20.075 ( -4.661 -0.000 7.434) 8.774 20.271 ( 0.796 0.000 -10.863) 10.892 26.121 ( 0.143 0.000 33.734) 33.735 26.643 ( 0.170 0.000 -26.447) 26.448 27.883 ( -5.807 -0.000 8.535) 10.323 28.112 ( 7.650 0.000 -6.192) 9.842 ======================= Grid point 566 (287/300) ======================= q-point: (-0.36 -0.45 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.332 ( -5.954 0.472 14.439) 15.626 2.408 ( -8.638 -0.359 1.521) 8.778 3.599 ( -8.287 14.439 12.883) 21.051 3.825 ( 1.053 5.122 -2.615) 5.846 4.074 ( -14.655 -2.546 -2.433) 15.072 4.165 ( -4.802 12.023 23.059) 26.444 4.454 ( 2.585 10.926 -0.753) 11.253 4.726 ( 4.996 19.221 -20.153) 28.294 4.970 ( -3.298 -5.784 16.491) 17.784 5.182 ( -2.587 -8.885 3.300) 9.825 5.485 ( 6.545 -9.558 -0.673) 11.603 5.666 ( 2.910 -9.443 -21.501) 23.663 6.700 ( -2.023 2.060 2.464) 3.796 6.888 ( 5.707 -5.949 -3.604) 8.997 6.936 ( 0.296 -5.484 -3.279) 6.396 7.043 ( 12.224 -6.988 7.315) 15.867 8.122 ( -2.030 -8.191 2.184) 8.716 8.174 ( 2.118 -8.088 0.987) 8.419 9.370 ( -10.643 9.498 10.796) 17.890 9.746 ( -3.068 8.267 -19.573) 21.468 10.578 ( -4.268 2.398 0.542) 4.926 10.697 ( 5.940 0.594 11.481) 12.940 11.078 ( 0.247 2.160 10.327) 10.553 11.356 ( 10.934 3.374 -7.405) 13.630 11.566 ( -11.130 1.221 6.830) 13.116 11.966 ( 6.584 3.863 -9.745) 12.379 12.907 ( -6.271 -1.781 -0.039) 6.519 13.116 ( 5.102 -2.803 -1.073) 5.920 13.477 ( -1.333 -0.742 -1.319) 2.017 13.509 ( 3.136 -0.136 1.055) 3.312 13.989 ( -4.514 -0.949 10.542) 11.507 14.166 ( -0.652 1.199 -7.128) 7.258 15.227 ( -10.646 3.878 11.794) 16.355 15.751 ( 10.669 8.340 -17.005) 21.739 17.732 ( -10.535 6.380 6.583) 13.965 18.154 ( 9.186 5.672 -11.126) 15.503 20.045 ( -6.607 0.684 6.630) 9.385 20.260 ( 1.099 -0.383 -7.637) 7.726 26.155 ( 1.526 3.247 33.225) 33.418 26.554 ( 0.984 5.073 -21.977) 22.577 27.815 ( -7.562 3.741 4.388) 9.510 28.139 ( 6.562 1.157 -9.275) 11.420 ======================= Grid point 567 (288/300) ======================= q-point: (-0.27 -0.45 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.281 ( -7.720 2.873 12.676) 15.117 2.355 ( -7.977 0.540 4.508) 9.178 3.226 ( -16.363 15.740 3.934) 23.043 3.674 ( 5.901 13.515 -3.217) 15.094 3.755 ( -11.109 20.533 16.437) 28.551 4.014 ( -10.279 4.638 -3.211) 11.725 4.328 ( 5.822 22.604 -20.574) 31.115 4.410 ( 6.619 -0.067 6.084) 8.991 5.117 ( -3.180 -9.144 11.397) 14.954 5.287 ( 0.033 -5.029 -5.518) 7.466 5.705 ( 2.084 -11.016 11.157) 15.817 5.903 ( 2.694 -14.140 -17.351) 22.544 6.680 ( -2.021 -1.138 4.571) 5.126 7.030 ( 6.799 -5.174 -4.750) 9.776 7.053 ( 1.383 -5.903 -1.401) 6.223 7.267 ( 10.053 -6.036 5.551) 12.973 8.313 ( -4.056 -11.922 5.868) 13.893 8.422 ( 3.422 -15.772 0.033) 16.139 9.082 ( -12.545 11.721 3.080) 17.443 9.505 ( -1.573 11.134 -15.250) 18.948 10.489 ( -4.097 4.787 6.672) 9.177 10.744 ( 6.453 0.772 9.223) 11.283 11.058 ( 4.415 3.478 10.924) 12.285 11.318 ( 11.239 7.708 -9.244) 16.468 11.463 ( -10.010 2.906 5.155) 11.629 11.883 ( 4.946 7.700 -7.079) 11.570 12.916 ( -4.252 -2.570 1.131) 5.095 13.199 ( -0.678 -4.743 -3.453) 5.906 13.449 ( -6.502 -0.854 -8.853) 11.017 13.579 ( 9.023 -1.158 6.902) 11.419 13.994 ( -4.663 -1.418 6.609) 8.212 14.108 ( 0.938 5.037 -0.379) 5.137 15.066 ( -10.705 6.418 4.111) 13.141 15.580 ( 5.008 11.704 -12.241) 17.661 17.540 ( -7.669 7.308 3.803) 11.255 18.039 ( 8.318 10.595 -15.592) 20.604 19.980 ( -8.238 1.072 2.818) 8.773 20.284 ( 2.042 -1.725 -1.891) 3.274 26.132 ( 1.898 6.590 30.349) 31.114 26.423 ( 1.290 5.801 -10.912) 12.426 27.650 ( -9.101 7.601 -1.370) 11.936 28.114 ( 5.494 4.438 -13.517) 15.251 ======================= Grid point 568 (289/300) ======================= q-point: (-0.18 -0.45 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.145 ( -9.437 7.399 12.489) 17.314 2.276 ( -7.179 2.785 0.412) 7.711 2.856 ( -17.147 10.486 -0.139) 20.100 3.314 ( -5.435 21.610 11.358) 25.011 3.404 ( 4.587 17.369 -4.634) 18.553 3.871 ( 0.573 21.521 -21.699) 30.566 3.903 ( -1.052 3.577 -4.674) 5.979 4.502 ( 4.005 -2.684 8.313) 9.610 5.274 ( -1.441 -7.411 0.693) 7.581 5.399 ( -0.150 -7.480 4.167) 8.564 5.942 ( -0.733 -11.274 12.100) 16.554 6.126 ( 3.483 -9.935 -12.916) 16.663 6.739 ( -0.378 -5.113 5.329) 7.395 7.144 ( 4.043 -2.780 -4.162) 6.434 7.157 ( 1.006 -4.577 -0.187) 4.690 7.417 ( 6.895 -3.399 4.846) 9.087 8.371 ( -12.909 4.921 11.780) 18.155 8.719 ( 2.479 -5.520 -7.903) 9.954 8.926 ( -5.414 -10.852 -4.035) 12.781 9.347 ( 3.398 1.096 -5.366) 6.446 10.360 ( -4.338 7.638 10.644) 13.801 10.792 ( 6.776 0.774 6.697) 9.558 11.062 ( 7.190 2.286 8.415) 11.302 11.188 ( 7.277 11.626 -11.376) 17.819 11.350 ( -4.321 3.748 5.533) 7.959 11.734 ( 2.223 9.528 -4.177) 10.638 12.925 ( -2.028 -0.481 -2.008) 2.894 13.265 ( -5.061 -4.818 -4.627) 8.380 13.433 ( -7.977 -5.420 -6.908) 11.863 13.648 ( 6.823 2.300 4.394) 8.435 13.987 ( -2.137 2.610 1.756) 3.803 14.010 ( 3.298 3.745 3.758) 6.247 14.864 ( -8.777 7.573 -1.191) 11.654 15.409 ( -0.043 5.932 -3.895) 7.096 17.380 ( -3.713 5.858 0.826) 6.985 17.839 ( 7.521 13.150 -18.590) 23.981 19.912 ( -7.117 0.377 -0.007) 7.127 20.338 ( 1.446 -2.616 1.350) 3.280 26.040 ( 0.391 8.845 24.754) 26.290 26.345 ( 2.125 2.964 4.333) 5.663 27.412 ( -8.971 9.682 -8.742) 15.832 28.005 ( 3.979 7.739 -16.108) 18.308 ======================= Grid point 569 (290/300) ======================= q-point: (-0.09 -0.45 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.956 ( -9.162 6.069 7.985) 13.585 2.166 ( -5.319 2.503 -6.874) 9.045 2.601 ( -12.408 6.314 7.492) 15.810 2.946 ( -0.197 15.239 -4.968) 16.029 3.095 ( 2.342 18.412 -9.984) 21.075 3.481 ( 5.065 15.218 -11.916) 19.981 3.885 ( -1.752 -1.393 -2.891) 3.656 4.577 ( 1.650 -1.828 5.653) 6.166 5.367 ( 0.574 -3.307 -3.021) 4.516 5.561 ( -2.736 -8.842 9.210) 13.057 6.144 ( -0.717 -8.536 9.696) 12.937 6.272 ( 3.513 -4.781 -7.909) 9.887 6.868 ( 1.661 -6.146 7.697) 9.988 7.166 ( -2.419 0.381 2.810) 3.728 7.231 ( 0.844 -3.036 -5.274) 6.143 7.549 ( 7.027 -5.510 2.431) 9.255 8.100 ( -13.696 11.611 9.812) 20.461 8.582 ( -2.089 10.710 -17.592) 20.701 9.307 ( 1.606 -22.653 5.511) 23.369 9.503 ( 4.263 -12.384 -2.156) 13.274 10.175 ( -3.692 11.194 12.511) 17.189 10.819 ( 6.761 4.145 5.197) 9.481 10.959 ( -1.589 10.485 -13.890) 17.476 11.082 ( 5.173 2.767 6.403) 8.684 11.318 ( 7.502 1.646 3.554) 8.463 11.562 ( -2.210 7.609 -2.196) 8.222 12.911 ( -0.192 -0.390 -5.435) 5.452 13.269 ( -7.014 -0.404 -1.649) 7.217 13.509 ( -6.814 -7.650 -2.758) 10.610 13.605 ( 2.942 3.740 -1.861) 5.109 13.888 ( -0.067 5.357 -0.488) 5.380 14.058 ( 6.041 -2.806 3.922) 7.730 14.674 ( -4.178 7.338 -3.580) 9.172 15.345 ( -4.255 -0.384 1.414) 4.500 17.271 ( -0.494 4.227 -0.658) 4.306 17.616 ( 6.552 11.993 -18.291) 22.833 19.868 ( -4.208 0.050 -0.304) 4.219 20.401 ( 0.233 -3.077 1.019) 3.249 25.914 ( -2.261 7.975 24.555) 25.916 26.355 ( 2.026 -0.522 14.637) 14.786 27.154 ( -5.987 8.991 -18.343) 21.287 27.851 ( 2.931 7.559 -16.086) 18.013 ======================= Grid point 577 (291/300) ======================= q-point: (-0.36 -0.36 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.315 ( -6.396 -0.000 15.368) 16.646 2.345 ( -9.923 -0.000 5.431) 11.312 3.785 ( -8.139 -0.000 2.725) 8.583 3.835 ( -21.156 -0.000 5.448) 21.846 3.866 ( 0.768 0.000 3.055) 3.150 4.290 ( -3.338 -0.000 15.448) 15.804 4.614 ( -4.579 -0.000 7.499) 8.787 4.829 ( -2.391 -0.000 5.106) 5.638 4.979 ( -0.196 -0.000 -1.422) 1.436 5.178 ( 6.536 0.000 -14.799) 16.178 5.261 ( 0.885 0.000 3.923) 4.021 5.619 ( 5.625 0.000 -21.741) 22.456 6.754 ( 3.018 0.000 -10.500) 10.925 6.830 ( 5.350 0.000 9.024) 10.491 6.901 ( 5.576 0.000 -2.136) 5.971 7.083 ( 13.231 0.000 8.351) 15.646 8.024 ( -1.962 -0.000 0.276) 1.982 8.129 ( 3.252 0.000 2.350) 4.012 9.396 ( -14.379 -0.000 9.277) 17.111 9.716 ( -13.175 -0.000 -21.028) 24.814 10.595 ( 1.882 0.000 -3.137) 3.658 10.776 ( 5.538 0.000 18.601) 19.408 11.125 ( 3.612 0.000 9.439) 10.106 11.466 ( 13.338 0.000 -6.052) 14.647 11.503 ( -11.741 -0.000 6.286) 13.318 12.023 ( 4.755 0.000 -9.905) 10.987 12.850 ( -4.484 -0.000 -0.321) 4.496 13.118 ( 1.814 0.000 -0.562) 1.899 13.440 ( -4.390 -0.000 -4.586) 6.349 13.559 ( 8.283 0.000 4.892) 9.620 13.966 ( -6.350 -0.000 11.814) 13.413 14.144 ( -1.118 -0.000 -8.895) 8.965 15.221 ( -9.322 -0.000 12.507) 15.599 15.874 ( 9.186 0.000 -20.646) 22.598 17.728 ( -10.990 -0.000 5.460) 12.271 18.235 ( 4.956 0.000 -10.685) 11.778 20.025 ( -6.296 -0.000 9.105) 11.070 20.238 ( -0.715 -0.000 -8.474) 8.504 26.260 ( 2.712 0.000 33.517) 33.627 26.579 ( 3.155 0.000 -24.438) 24.641 27.805 ( -8.004 -0.000 3.514) 8.741 28.166 ( 3.844 0.000 -9.949) 10.666 ======================= Grid point 578 (292/300) ======================= q-point: (-0.27 -0.36 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.264 ( -9.439 1.102 7.358) 12.019 2.319 ( -7.252 -1.087 15.520) 17.165 3.410 ( -20.915 16.551 1.961) 26.744 3.788 ( -12.941 -0.458 -5.387) 14.025 3.912 ( -0.386 3.729 5.067) 6.303 4.168 ( -6.912 11.290 28.570) 31.488 4.488 ( 3.719 7.214 -4.412) 9.238 4.729 ( 3.718 16.078 -17.083) 23.752 4.975 ( -0.965 -5.161 8.038) 9.601 5.160 ( -3.525 -6.119 8.210) 10.830 5.558 ( 4.418 -14.515 -4.179) 15.738 5.643 ( 4.304 -5.666 -20.137) 21.357 6.710 ( 3.721 3.382 -1.598) 5.276 6.943 ( 5.529 -5.088 -2.031) 7.783 7.023 ( 9.177 -4.428 3.127) 10.659 7.239 ( 11.268 -5.473 6.232) 13.992 8.101 ( -1.929 -8.362 2.316) 8.888 8.222 ( 3.986 -7.736 1.145) 8.778 9.191 ( -18.090 9.710 3.716) 20.865 9.556 ( -13.426 2.589 -17.492) 22.202 10.572 ( 2.216 3.925 0.976) 4.612 10.832 ( 4.974 1.146 17.495) 18.224 11.162 ( 5.928 1.715 10.436) 12.124 11.426 ( -8.953 1.300 3.460) 9.686 11.516 ( 13.348 4.045 -5.936) 15.158 12.005 ( 3.481 3.315 -8.349) 9.633 12.847 ( -2.257 -2.201 0.914) 3.282 13.120 ( -3.927 -1.174 -2.572) 4.839 13.387 ( -7.103 0.581 -8.122) 10.805 13.651 ( 12.626 -0.825 7.369) 14.643 13.930 ( -9.057 -0.754 9.341) 13.032 14.149 ( 1.096 -0.859 -3.859) 4.102 15.123 ( -8.592 5.471 8.055) 12.986 15.796 ( 4.301 9.568 -19.692) 22.312 17.609 ( -8.657 5.144 4.376) 10.980 18.201 ( 3.423 4.509 -13.067) 14.240 19.969 ( -6.871 2.257 6.809) 9.933 20.242 ( -0.883 -2.285 -4.746) 5.341 26.305 ( 3.366 3.668 31.558) 31.948 26.517 ( 3.518 4.668 -17.794) 18.730 27.702 ( -8.921 4.832 -0.589) 10.163 28.165 ( 2.354 0.768 -12.603) 12.844 ======================= Grid point 579 (293/300) ======================= q-point: (-0.18 -0.36 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.180 ( -9.258 2.189 4.606) 10.569 2.299 ( -6.512 1.863 18.618) 19.812 2.947 ( -22.167 15.083 -1.621) 26.861 3.589 ( -15.898 10.706 0.283) 19.169 3.760 ( 5.177 13.984 4.658) 15.622 3.905 ( -5.097 12.582 3.983) 14.148 4.355 ( 7.144 20.019 -18.071) 27.899 4.490 ( 2.038 -0.200 4.772) 5.193 5.113 ( -1.773 -8.388 9.362) 12.695 5.275 ( -0.916 -6.528 0.529) 6.614 5.751 ( 0.668 -9.635 4.476) 10.645 5.891 ( 3.530 -14.886 -15.722) 21.937 6.705 ( 4.192 -0.203 2.590) 4.931 7.082 ( 5.048 -5.279 -0.584) 7.327 7.139 ( 7.180 -1.668 0.570) 7.393 7.418 ( 8.296 -3.821 5.194) 10.508 8.254 ( -7.228 -8.604 6.195) 12.831 8.494 ( 6.446 -16.059 -0.304) 17.308 8.867 ( -17.105 8.895 -5.007) 19.919 9.389 ( -7.872 3.450 -11.128) 14.061 10.491 ( 0.240 6.377 8.447) 10.587 10.870 ( 5.250 1.264 11.150) 12.388 11.187 ( 8.366 2.707 10.388) 13.610 11.324 ( -7.476 4.178 1.940) 8.781 11.486 ( 12.810 7.638 -5.891) 16.035 11.915 ( 2.796 7.625 -5.703) 9.924 12.893 ( 0.618 -2.426 0.734) 2.609 13.111 ( -8.631 -3.843 -4.599) 10.508 13.303 ( -9.310 -0.629 -9.981) 13.663 13.754 ( 9.754 1.520 6.359) 11.743 13.928 ( -6.726 -4.132 6.922) 10.499 14.134 ( 2.536 4.019 1.523) 4.990 14.947 ( -7.146 7.517 1.919) 10.548 15.553 ( -2.638 12.042 -13.656) 18.397 17.467 ( -3.655 5.595 3.161) 7.393 18.073 ( 4.650 9.334 -16.917) 19.873 19.890 ( -5.412 1.863 2.651) 6.308 20.282 ( -2.034 -3.213 -0.448) 3.829 26.265 ( 4.164 8.627 19.924) 22.107 26.432 ( 1.457 3.998 3.986) 5.831 27.507 ( -8.531 8.374 -7.029) 13.868 28.107 ( 0.704 4.256 -15.939) 16.512 ======================= Grid point 580 (294/300) ======================= q-point: (-0.09 -0.36 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.043 ( -9.844 6.989 9.105) 15.121 2.205 ( -4.935 6.060 8.629) 11.642 2.598 ( -17.762 5.424 -2.016) 18.680 3.256 ( -7.457 15.886 6.306) 18.648 3.419 ( -0.132 19.157 -5.482) 19.927 3.701 ( -5.463 11.119 -16.452) 20.595 4.033 ( 12.621 14.003 -5.762) 19.713 4.550 ( -0.856 -2.715 7.320) 7.854 5.269 ( 0.224 -7.208 1.155) 7.304 5.396 ( -2.359 -7.316 4.985) 9.162 5.962 ( -1.584 -11.356 9.242) 14.727 6.134 ( 3.490 -10.886 -12.329) 16.814 6.793 ( 5.950 -4.635 4.328) 8.695 7.168 ( 1.090 -0.509 3.106) 3.331 7.204 ( 3.931 -1.119 -1.179) 4.253 7.522 ( 5.628 -2.613 4.213) 7.500 8.202 ( -16.113 7.292 11.251) 20.962 8.641 ( -6.959 2.508 -18.944) 20.337 8.913 ( 3.988 -21.121 1.845) 21.574 9.352 ( -0.615 -5.618 -3.141) 6.466 10.367 ( -0.712 8.808 12.814) 15.566 10.897 ( 3.908 0.802 4.330) 5.887 11.114 ( -2.480 10.473 -0.656) 10.783 11.255 ( 7.980 3.596 8.614) 12.281 11.429 ( 11.348 4.866 -2.326) 12.565 11.738 ( 0.371 11.550 -3.779) 12.159 12.909 ( 0.129 1.029 -4.258) 4.383 13.135 ( -9.376 -6.248 -4.591) 12.167 13.296 ( -7.362 -6.887 -6.032) 11.748 13.724 ( 0.436 5.075 -0.640) 5.133 13.967 ( -0.295 1.650 5.247) 5.508 14.086 ( 4.500 1.590 5.928) 7.611 14.770 ( -3.523 6.808 -2.556) 8.080 15.327 ( -8.703 5.228 -6.475) 12.041 17.362 ( 0.500 5.157 3.127) 6.051 17.874 ( 6.921 12.433 -19.737) 24.332 19.845 ( -2.257 0.228 0.252) 2.283 20.325 ( -3.872 -3.627 1.017) 5.402 26.129 ( 2.326 10.777 15.601) 19.104 26.405 ( -0.594 1.880 20.331) 20.426 27.265 ( -4.846 9.701 -15.553) 18.961 27.967 ( -1.041 6.970 -17.728) 19.077 ======================= Grid point 589 (295/300) ======================= q-point: (-0.27 -0.27 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.222 ( -11.205 -0.000 10.442) 15.316 2.278 ( -6.217 -0.000 14.717) 15.976 3.466 ( -25.539 -0.000 -4.235) 25.887 3.588 ( -18.297 -0.000 -3.647) 18.657 3.980 ( 5.740 0.000 15.590) 16.613 4.288 ( -6.359 -0.000 27.003) 27.741 4.620 ( 2.778 0.000 -0.659) 2.855 4.786 ( -4.318 -0.000 0.050) 4.318 4.975 ( -0.050 -0.000 0.188) 0.194 5.204 ( 4.677 0.000 -15.342) 16.039 5.292 ( 2.013 0.000 2.016) 2.849 5.622 ( 4.827 0.000 -19.774) 20.355 6.805 ( 10.209 0.000 -13.809) 17.173 6.958 ( 7.319 0.000 12.365) 14.368 7.026 ( 12.025 0.000 0.611) 12.040 7.272 ( 8.545 0.000 8.351) 11.948 8.012 ( 0.046 0.000 0.617) 0.618 8.185 ( 3.750 0.000 1.182) 3.932 9.164 ( -21.823 -0.000 5.220) 22.439 9.398 ( -20.696 -0.000 -19.269) 28.277 10.644 ( 6.071 0.000 -4.787) 7.732 10.894 ( -0.222 -0.000 23.214) 23.215 11.233 ( 3.084 0.000 11.416) 11.825 11.406 ( 0.143 0.000 2.449) 2.453 11.647 ( 14.662 0.000 -5.930) 15.816 12.034 ( 1.190 0.000 -8.282) 8.367 12.816 ( -0.640 -0.000 0.896) 1.102 13.073 ( -6.518 -0.000 -2.952) 7.155 13.329 ( -8.292 -0.000 -7.584) 11.237 13.743 ( 11.398 0.000 8.708) 14.344 13.882 ( -8.950 -0.000 9.152) 12.801 14.127 ( 2.350 0.000 -4.824) 5.366 15.143 ( -6.297 -0.000 7.768) 9.999 15.882 ( 2.431 0.000 -22.997) 23.125 17.609 ( -7.558 -0.000 4.373) 8.731 18.222 ( -1.248 -0.000 -11.158) 11.228 19.963 ( -7.203 -0.000 10.627) 12.838 20.195 ( -1.327 -0.000 -7.679) 7.793 26.415 ( 2.421 0.000 32.591) 32.681 26.565 ( 6.127 0.000 -21.596) 22.448 27.689 ( -8.626 -0.000 -0.467) 8.638 28.154 ( 0.134 0.000 -13.013) 13.014 ======================= Grid point 590 (296/300) ======================= q-point: (-0.18 -0.27 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.150 ( -10.169 0.948 9.201) 13.747 2.280 ( -6.399 -1.639 15.549) 16.894 3.085 ( -23.506 15.671 0.386) 28.254 3.509 ( -19.352 -2.114 -8.364) 21.187 4.001 ( 5.361 6.458 12.116) 14.739 4.174 ( -5.595 11.728 26.628) 29.629 4.526 ( 3.738 6.951 -5.572) 9.661 4.699 ( -0.495 10.719 -12.860) 16.749 5.019 ( 5.148 -2.993 0.197) 5.958 5.134 ( -5.158 -5.001 12.160) 14.124 5.582 ( 3.138 -16.894 -10.585) 20.182 5.644 ( 4.014 -3.407 -15.522) 16.391 6.802 ( 10.823 4.556 -3.937) 12.385 7.049 ( 9.225 -3.031 1.706) 9.859 7.178 ( 9.870 -1.825 6.179) 11.787 7.391 ( 7.348 -5.807 5.427) 10.825 8.079 ( -2.501 -5.821 2.278) 6.733 8.294 ( 5.919 -9.177 -0.567) 10.935 8.890 ( -24.297 9.156 -1.981) 26.041 9.272 ( -18.725 -3.501 -12.712) 22.902 10.627 ( 4.587 5.098 0.848) 6.910 10.922 ( -2.053 -0.226 16.571) 16.699 11.261 ( 0.712 -0.376 12.254) 12.281 11.408 ( 8.131 4.801 3.084) 9.934 11.693 ( 14.022 4.837 -6.649) 16.255 12.007 ( 0.365 2.093 -6.699) 7.028 12.849 ( 1.901 -2.964 1.395) 3.788 13.011 ( -8.821 -0.001 -3.997) 9.684 13.231 ( -10.241 1.697 -9.668) 14.185 13.791 ( -14.307 -1.693 6.869) 15.960 13.880 ( 14.213 0.246 9.043) 16.847 14.175 ( 3.825 -1.663 -1.017) 4.293 15.048 ( -4.819 6.634 4.617) 9.410 15.734 ( -3.063 11.025 -20.687) 23.641 17.536 ( -3.297 3.492 4.438) 6.539 18.168 ( -1.577 2.467 -12.534) 12.871 19.905 ( -5.605 2.304 7.565) 9.693 20.200 ( -2.573 -2.668 -4.803) 6.067 26.454 ( 2.854 3.538 26.938) 27.319 26.527 ( 4.491 4.615 -10.518) 12.332 27.573 ( -7.603 5.549 -3.791) 10.147 28.121 ( -1.583 0.865 -15.182) 15.289 ======================= Grid point 591 (297/300) ======================= q-point: (-0.09 -0.27 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.073 ( -8.312 2.243 5.997) 10.492 2.289 ( -4.634 0.360 20.428) 20.951 2.625 ( -20.877 14.772 -2.094) 25.660 3.345 ( -15.316 4.352 -8.566) 18.080 3.827 ( -0.431 21.585 9.024) 23.399 3.893 ( 1.738 12.321 4.518) 13.238 4.398 ( 7.125 16.398 -16.033) 24.015 4.505 ( -1.669 -0.701 3.762) 4.175 5.135 ( -0.904 -6.644 11.778) 13.553 5.265 ( -0.311 -7.362 0.562) 7.390 5.760 ( -0.594 -9.343 1.018) 9.417 5.887 ( 3.295 -15.034 -15.105) 21.565 6.822 ( 11.187 0.942 2.072) 11.417 7.170 ( 5.996 -2.135 2.117) 6.707 7.236 ( 5.365 0.693 4.213) 6.856 7.537 ( 6.491 -1.966 4.266) 8.013 8.150 ( -10.692 -3.549 7.177) 13.357 8.567 ( -11.867 -0.035 -12.626) 17.327 8.608 ( 1.438 -12.630 -1.134) 12.762 9.215 ( -12.158 -4.927 -6.102) 14.468 10.541 ( 2.094 7.273 9.373) 12.047 10.927 ( -2.052 0.250 5.198) 5.594 11.290 ( 1.527 4.492 9.427) 10.554 11.358 ( 10.339 4.225 9.230) 14.489 11.647 ( 12.411 8.355 -7.382) 16.684 11.922 ( 0.836 6.995 -5.015) 8.647 12.929 ( 2.283 0.292 -0.508) 2.357 12.952 ( -9.730 -3.891 -4.326) 11.337 13.132 ( -8.597 -2.978 -9.762) 13.345 13.723 ( -12.984 -1.024 1.810) 13.150 14.002 ( 9.733 -0.936 9.632) 13.725 14.188 ( 3.652 3.528 3.205) 6.004 14.880 ( -3.009 7.861 0.242) 8.421 15.418 ( -8.622 12.778 -15.406) 21.793 17.468 ( 1.712 4.186 5.435) 7.070 18.059 ( 1.418 6.587 -16.184) 17.530 19.850 ( -1.650 1.317 3.267) 3.890 20.224 ( -5.231 -3.263 -1.831) 6.431 26.379 ( 6.290 10.280 2.253) 12.261 26.476 ( -3.289 2.625 25.974) 26.313 27.384 ( -3.643 8.445 -10.218) 13.747 28.027 ( -3.579 4.392 -17.918) 18.793 ======================= Grid point 601 (298/300) ======================= q-point: (-0.18 -0.18 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.100 ( -11.907 -0.000 13.960) 18.349 2.238 ( -5.361 -0.000 9.160) 10.613 3.115 ( -21.713 -0.000 -0.628) 21.722 3.295 ( -19.209 -0.000 -4.077) 19.637 4.121 ( 5.662 0.000 17.759) 18.640 4.303 ( -5.023 -0.000 27.929) 28.377 4.656 ( 2.391 0.000 -2.461) 3.431 4.723 ( -3.695 -0.000 -1.665) 4.053 4.978 ( -0.371 -0.000 2.481) 2.508 5.210 ( 3.970 0.000 -16.082) 16.565 5.332 ( 3.333 0.000 -1.056) 3.496 5.619 ( 4.229 0.000 -18.944) 19.410 6.948 ( 16.802 0.000 -14.821) 22.405 7.120 ( 8.754 0.000 15.337) 17.659 7.235 ( 16.902 0.000 1.030) 16.933 7.366 ( 0.026 0.000 9.746) 9.746 8.025 ( 1.568 0.000 -0.618) 1.686 8.239 ( 3.458 0.000 -1.051) 3.614 8.819 ( -28.484 -0.000 3.399) 28.687 9.022 ( -22.990 -0.000 -16.620) 28.369 10.722 ( 7.493 0.000 -6.260) 9.764 10.900 ( -8.953 -0.000 19.002) 21.006 11.284 ( 2.286 0.000 13.423) 13.616 11.553 ( 14.225 0.000 3.898) 14.749 11.826 ( 13.196 0.000 -6.366) 14.651 12.000 ( -2.424 -0.000 -6.600) 7.031 12.838 ( 3.471 0.000 0.338) 3.487 12.943 ( -9.328 -0.000 -3.628) 10.009 13.165 ( -10.269 -0.000 -7.686) 12.827 13.676 ( -16.176 -0.000 6.012) 17.257 14.006 ( 13.021 0.000 9.064) 15.865 14.175 ( 5.559 0.000 -1.523) 5.764 15.102 ( -2.560 -0.000 4.902) 5.530 15.784 ( -4.974 -0.000 -22.437) 22.981 17.559 ( -1.546 -0.000 5.225) 5.449 18.133 ( -5.927 -0.000 -9.288) 11.018 19.900 ( -6.925 -0.000 11.595) 13.505 20.151 ( -0.664 -0.000 -8.989) 9.014 26.531 ( -2.260 -0.000 30.706) 30.789 26.603 ( 8.873 0.000 -18.230) 20.275 27.575 ( -6.155 -0.000 -1.383) 6.308 28.084 ( -3.050 -0.000 -14.989) 15.296 ======================= Grid point 602 (299/300) ======================= q-point: (-0.09 -0.18 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 545 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.042 ( -10.102 -0.020 12.148) 15.800 2.238 ( -5.191 -2.326 7.548) 9.451 2.797 ( -17.166 14.902 6.452) 23.630 3.227 ( -15.459 -2.861 -8.244) 17.752 4.120 ( 4.664 8.038 14.230) 16.996 4.192 ( -4.061 12.802 23.651) 27.199 4.545 ( 1.226 7.546 -4.868) 9.064 4.645 ( -0.443 7.506 -11.583) 13.810 5.096 ( -3.421 -9.088 8.382) 12.827 5.107 ( 4.388 1.754 2.033) 5.144 5.583 ( 1.812 -15.289 -9.572) 18.129 5.645 ( 4.145 -4.084 -16.925) 17.897 6.985 ( 16.515 5.215 -4.250) 17.833 7.199 ( 9.210 -0.467 4.717) 10.358 7.311 ( 3.231 2.110 10.906) 11.568 7.515 ( 10.506 -7.754 2.918) 13.380 8.039 ( -3.993 -1.272 0.334) 4.204 8.370 ( 2.596 -11.074 -3.142) 11.800 8.516 ( -23.119 6.440 -4.343) 24.389 8.953 ( -20.632 -8.850 -8.201) 23.901 10.697 ( 3.884 5.780 2.999) 7.582 10.891 ( -5.844 -1.838 6.737) 9.106 11.347 ( 5.200 -1.053 15.171) 16.072 11.587 ( 12.293 7.309 5.326) 15.262 11.851 ( 11.081 5.356 -7.543) 14.435 11.970 ( -2.417 0.255 -6.014) 6.486 12.854 ( -7.726 0.288 -2.780) 8.215 12.926 ( 5.609 -4.123 -0.513) 6.980 13.047 ( -10.498 3.021 -7.937) 13.503 13.580 ( -17.038 -1.677 2.494) 17.301 14.092 ( 10.503 0.627 9.497) 14.174 14.243 ( 5.308 -1.231 0.869) 5.518 15.019 ( -1.477 7.560 3.609) 8.506 15.577 ( -8.696 11.933 -19.562) 24.509 17.551 ( 2.497 1.858 6.373) 7.092 18.077 ( -5.466 0.076 -10.327) 11.685 19.865 ( -4.042 0.799 9.075) 9.966 20.144 ( -1.841 -1.277 -7.854) 8.168 26.533 ( -6.538 2.335 25.885) 26.800 26.585 ( 9.482 5.584 -8.155) 13.696 27.484 ( -2.599 5.473 -2.751) 6.654 28.020 ( -4.766 1.488 -16.648) 17.380 ======================= Grid point 613 (300/300) ======================= q-point: (-0.09 -0.09 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.67e-09 3.67e-09 3.67e-09 3.67e-09 Number of triplets: 300 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.985 ( -11.118 -0.000 16.005) 19.488 2.196 ( -2.296 -0.000 0.029) 2.296 2.870 ( -13.895 -0.000 6.615) 15.389 3.059 ( -11.514 -0.000 -2.474) 11.776 4.250 ( 3.090 0.000 19.151) 19.399 4.336 ( -3.350 -0.000 25.154) 25.376 4.661 ( -0.717 -0.000 -1.748) 1.889 4.679 ( -1.337 -0.000 -2.016) 2.419 4.976 ( -1.625 -0.000 3.970) 4.290 5.205 ( 3.038 0.000 -15.921) 16.208 5.375 ( 3.593 0.000 -3.084) 4.735 5.613 ( 4.287 0.000 -19.123) 19.598 7.157 ( 17.843 0.000 -11.588) 21.276 7.286 ( 1.432 0.000 10.574) 10.670 7.361 ( -0.861 -0.000 18.943) 18.962 7.518 ( 23.798 0.000 -1.950) 23.877 8.043 ( 1.732 0.000 -5.130) 5.414 8.211 ( -14.706 -0.000 0.168) 14.707 8.460 ( -14.519 -0.000 0.014) 14.519 8.653 ( -21.203 -0.000 -11.496) 24.119 10.812 ( 8.584 0.000 -7.422) 11.348 10.815 ( -9.682 -0.000 13.160) 16.338 11.399 ( 5.520 0.000 16.788) 17.672 11.765 ( 13.094 0.000 2.619) 13.354 11.919 ( -6.188 -0.000 -4.005) 7.371 11.962 ( 8.850 0.000 -9.153) 12.731 12.808 ( -7.419 -0.000 -2.061) 7.699 12.896 ( 2.490 0.000 -6.290) 6.765 13.032 ( -1.918 -0.000 0.195) 1.928 13.448 ( -16.620 -0.000 0.802) 16.639 14.186 ( 7.243 0.000 8.614) 11.254 14.259 ( 6.027 0.000 0.062) 6.028 15.105 ( 0.564 0.000 5.453) 5.482 15.598 ( -10.716 -0.000 -18.293) 21.201 17.599 ( 3.767 0.000 7.189) 8.116 18.000 ( -8.766 -0.000 -6.622) 10.986 19.854 ( -4.888 -0.000 11.845) 12.814 20.120 ( 1.508 0.000 -11.689) 11.786 26.544 ( -10.200 -0.000 27.220) 29.068 26.689 ( 11.310 0.000 -14.868) 18.681 27.525 ( -1.046 -0.000 2.706) 2.902 27.969 ( -5.516 -0.000 -15.735) 16.674 =================== 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 3/45738 10.0 1463.205 1112.311 1272.305 -0.000 -322.443 0.000 3/45738 20.0 340.737 384.846 383.035 -0.000 -98.400 0.000 3/45738 30.0 146.452 178.979 178.817 -0.000 -41.370 0.000 3/45738 40.0 84.990 107.614 109.739 -0.000 -23.724 0.000 3/45738 50.0 57.141 73.676 76.465 -0.000 -15.906 0.000 3/45738 60.0 41.913 54.549 57.386 -0.000 -11.678 0.000 3/45738 70.0 32.579 42.597 45.270 -0.000 -9.092 0.000 3/45738 80.0 26.392 34.574 37.019 -0.000 -7.373 0.000 3/45738 90.0 22.048 28.895 31.107 -0.000 -6.159 0.000 3/45738 100.0 18.861 24.706 26.703 -0.000 -5.265 0.000 3/45738 110.0 16.440 21.514 23.322 -0.000 -4.583 0.000 3/45738 120.0 14.549 19.015 20.662 -0.000 -4.050 0.000 3/45738 130.0 13.038 17.014 18.526 -0.000 -3.624 0.000 3/45738 140.0 11.806 15.382 16.783 -0.000 -3.277 0.000 3/45738 150.0 10.785 14.029 15.337 -0.000 -2.992 0.000 3/45738 160.0 9.926 12.891 14.124 -0.000 -2.752 0.000 3/45738 170.0 9.195 11.923 13.094 -0.000 -2.550 0.000 3/45738 180.0 8.566 11.090 12.211 -0.000 -2.377 0.000 3/45738 190.0 8.019 10.366 11.446 -0.000 -2.228 0.000 3/45738 200.0 7.540 9.732 10.778 -0.000 -2.098 0.000 3/45738 210.0 7.116 9.172 10.190 -0.000 -1.983 0.000 3/45738 220.0 6.739 8.674 9.669 -0.000 -1.882 0.000 3/45738 230.0 6.401 8.229 9.205 -0.000 -1.792 0.000 3/45738 240.0 6.097 7.829 8.787 -0.000 -1.711 0.000 3/45738 250.0 5.821 7.467 8.410 -0.000 -1.638 0.000 3/45738 260.0 5.570 7.138 8.068 -0.000 -1.572 0.000 3/45738 270.0 5.341 6.837 7.756 -0.000 -1.512 0.000 3/45738 280.0 5.131 6.562 7.470 -0.000 -1.457 0.000 3/45738 290.0 4.937 6.309 7.206 -0.000 -1.406 0.000 3/45738 300.0 4.758 6.075 6.963 -0.000 -1.359 0.000 3/45738 310.0 4.592 5.859 6.738 -0.000 -1.315 0.000 3/45738 320.0 4.437 5.658 6.528 -0.000 -1.275 0.000 3/45738 330.0 4.293 5.471 6.332 -0.000 -1.237 0.000 3/45738 340.0 4.159 5.296 6.148 -0.000 -1.202 0.000 3/45738 350.0 4.033 5.133 5.976 -0.000 -1.168 0.000 3/45738 360.0 3.914 4.980 5.814 -0.000 -1.137 0.000 3/45738 370.0 3.803 4.835 5.661 -0.000 -1.107 0.000 3/45738 380.0 3.698 4.700 5.517 -0.000 -1.079 0.000 3/45738 390.0 3.598 4.572 5.380 -0.000 -1.053 0.000 3/45738 400.0 3.504 4.451 5.251 -0.000 -1.028 0.000 3/45738 410.0 3.415 4.336 5.128 -0.000 -1.004 0.000 3/45738 420.0 3.331 4.227 5.010 -0.000 -0.981 0.000 3/45738 430.0 3.251 4.124 4.899 -0.000 -0.960 0.000 3/45738 440.0 3.174 4.026 4.792 -0.000 -0.939 0.000 3/45738 450.0 3.101 3.932 4.690 -0.000 -0.919 0.000 3/45738 460.0 3.032 3.843 4.593 -0.000 -0.900 0.000 3/45738 470.0 2.966 3.758 4.499 -0.000 -0.882 0.000 3/45738 480.0 2.902 3.677 4.410 -0.000 -0.865 0.000 3/45738 490.0 2.841 3.599 4.324 -0.000 -0.848 0.000 3/45738 500.0 2.783 3.525 4.241 -0.000 -0.832 0.000 3/45738 510.0 2.727 3.453 4.162 -0.000 -0.816 0.000 3/45738 520.0 2.674 3.385 4.086 -0.000 -0.802 0.000 3/45738 530.0 2.622 3.319 4.012 -0.000 -0.787 0.000 3/45738 540.0 2.573 3.256 3.941 -0.000 -0.773 0.000 3/45738 550.0 2.525 3.195 3.873 -0.000 -0.760 0.000 3/45738 560.0 2.479 3.136 3.806 -0.000 -0.747 0.000 3/45738 570.0 2.435 3.080 3.743 -0.000 -0.735 0.000 3/45738 580.0 2.392 3.026 3.681 -0.000 -0.723 0.000 3/45738 590.0 2.351 2.973 3.621 -0.000 -0.711 0.000 3/45738 600.0 2.311 2.922 3.563 -0.000 -0.700 0.000 3/45738 610.0 2.273 2.873 3.507 -0.000 -0.689 0.000 3/45738 620.0 2.236 2.826 3.453 -0.000 -0.678 0.000 3/45738 630.0 2.200 2.780 3.401 -0.000 -0.668 0.000 3/45738 640.0 2.165 2.736 3.350 -0.000 -0.658 0.000 3/45738 650.0 2.131 2.693 3.300 -0.000 -0.648 0.000 3/45738 660.0 2.098 2.652 3.252 -0.000 -0.639 0.000 3/45738 670.0 2.067 2.612 3.205 -0.000 -0.630 0.000 3/45738 680.0 2.036 2.573 3.160 -0.000 -0.621 0.000 3/45738 690.0 2.006 2.535 3.116 -0.000 -0.612 0.000 3/45738 700.0 1.977 2.498 3.073 -0.000 -0.604 0.000 3/45738 710.0 1.949 2.462 3.031 -0.000 -0.596 0.000 3/45738 720.0 1.922 2.428 2.991 -0.000 -0.588 0.000 3/45738 730.0 1.895 2.394 2.951 -0.000 -0.580 0.000 3/45738 740.0 1.870 2.361 2.913 -0.000 -0.572 0.000 3/45738 750.0 1.844 2.329 2.875 -0.000 -0.565 0.000 3/45738 760.0 1.820 2.298 2.839 -0.000 -0.558 0.000 3/45738 770.0 1.796 2.268 2.803 -0.000 -0.551 0.000 3/45738 780.0 1.773 2.239 2.768 -0.000 -0.544 0.000 3/45738 790.0 1.750 2.210 2.734 -0.000 -0.537 0.000 3/45738 800.0 1.728 2.182 2.701 -0.000 -0.531 0.000 3/45738 810.0 1.707 2.155 2.669 -0.000 -0.525 0.000 3/45738 820.0 1.686 2.128 2.637 -0.000 -0.518 0.000 3/45738 830.0 1.665 2.102 2.606 -0.000 -0.512 0.000 3/45738 840.0 1.645 2.077 2.576 -0.000 -0.506 0.000 3/45738 850.0 1.626 2.052 2.547 -0.000 -0.501 0.000 3/45738 860.0 1.607 2.028 2.518 -0.000 -0.495 0.000 3/45738 870.0 1.588 2.005 2.490 -0.000 -0.490 0.000 3/45738 880.0 1.570 1.982 2.462 -0.000 -0.484 0.000 3/45738 890.0 1.553 1.959 2.435 -0.000 -0.479 0.000 3/45738 900.0 1.535 1.937 2.409 -0.000 -0.474 0.000 3/45738 910.0 1.518 1.916 2.383 -0.000 -0.469 0.000 3/45738 920.0 1.502 1.895 2.358 -0.000 -0.464 0.000 3/45738 930.0 1.485 1.874 2.333 -0.000 -0.459 0.000 3/45738 940.0 1.470 1.854 2.309 -0.000 -0.454 0.000 3/45738 950.0 1.454 1.835 2.285 -0.000 -0.449 0.000 3/45738 960.0 1.439 1.815 2.262 -0.000 -0.445 0.000 3/45738 970.0 1.424 1.797 2.239 -0.000 -0.440 0.000 3/45738 980.0 1.409 1.778 2.217 -0.000 -0.436 0.000 3/45738 990.0 1.395 1.760 2.195 -0.000 -0.432 0.000 3/45738 1000.0 1.381 1.742 2.174 -0.000 -0.427 0.000 3/45738 Thermal conductivity related properties were written into "kappa-m11119.hdf5". Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-07 23:45:30]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|