----------------------------- ------- calculate fc2 ------- ----------------------------- _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1 -------------------------[time 2026-01-08 08:03:03]------------------------- Compiled with OpenMP support (max 48 threads). Running in phonopy.load mode. Python version 3.14.2 Spglib version 2.6.1 Crystal structure was read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". Unit of length: angstrom Settings: Supercell: [2 1 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 4.024388012735954 -4.057675470000001 0.000000000000000 b 4.024388012735954 4.057675470000001 0.000000000000000 c -3.891020374960855 0.000000000000000 4.404675240205614 Atomic positions (fractional): *1 O 0.85441792753935 0.72052691750075 0.21379919654646 15.999 2 O 0.27947308249925 0.14558207246065 0.28620080345354 15.999 3 O 0.14558207246065 0.27947308249925 0.78620080345354 15.999 4 O 0.72052691750075 0.85441792753935 0.71379919654646 15.999 *5 Cu 0.50000000000000 0.50000000000000 0.50000000000000 63.546 6 Cu 0.50000000000000 0.50000000000000 0.00000000000000 63.546 *7 Cu 0.00000000000000 0.50000000000000 0.00000000000000 63.546 8 Cu 0.50000000000000 0.00000000000000 0.50000000000000 63.546 *9 Pb 0.86312956635342 0.13687043364658 0.25000000000000 207.200 10 Pb 0.13687043364658 0.86312956635342 0.75000000000000 207.200 -------------------------------- unit cell --------------------------------- Lattice vectors: a 8.048776025471907 0.000000000000000 0.000000000000000 b 0.000000000000000 8.115350940000003 0.000000000000000 c -3.891020374960855 0.000000000000000 4.404675240205614 Atomic positions (fractional): *1 O 0.78747242252005 0.93305449498070 0.21379919654646 15.999 > 1 2 O 0.21252757747995 0.93305449498070 0.28620080345354 15.999 > 2 3 O 0.21252757747995 0.06694550501930 0.78620080345354 15.999 > 3 4 O 0.78747242252005 0.06694550501930 0.71379919654646 15.999 > 4 5 O 0.28747242252005 0.43305449498070 0.21379919654646 15.999 > 1 6 O 0.71252757747995 0.43305449498070 0.28620080345354 15.999 > 2 7 O 0.71252757747995 0.56694550501930 0.78620080345354 15.999 > 3 8 O 0.28747242252005 0.56694550501930 0.71379919654646 15.999 > 4 *9 Cu 0.50000000000000 0.00000000000000 0.50000000000000 63.546 > 5 10 Cu 0.50000000000000 0.00000000000000 0.00000000000000 63.546 > 6 *11 Cu 0.75000000000000 0.75000000000000 0.00000000000000 63.546 > 7 12 Cu 0.75000000000000 0.25000000000000 0.50000000000000 63.546 > 8 13 Cu 0.00000000000000 0.50000000000000 0.50000000000000 63.546 > 5 14 Cu 0.00000000000000 0.50000000000000 0.00000000000000 63.546 > 6 15 Cu 0.25000000000000 0.25000000000000 0.00000000000000 63.546 > 7 16 Cu 0.25000000000000 0.75000000000000 0.50000000000000 63.546 > 8 *17 Pb 0.50000000000000 0.63687043364658 0.25000000000000 207.200 > 9 18 Pb 0.50000000000000 0.36312956635342 0.75000000000000 207.200 > 10 19 Pb 0.00000000000000 0.13687043364658 0.25000000000000 207.200 > 9 20 Pb 0.00000000000000 0.86312956635342 0.75000000000000 207.200 > 10 -------------------------------- super cell -------------------------------- Lattice vectors: a 16.097552050943815 0.000000000000000 0.000000000000000 b 0.000000000000000 8.115350940000003 0.000000000000000 c -7.782040749921710 0.000000000000000 8.809350480411227 Atomic positions (fractional): *1 O 0.39373621126003 0.93305449498070 0.10689959827323 15.999 > 1 2 O 0.89373621126003 0.93305449498070 0.10689959827323 15.999 > 1 3 O 0.39373621126003 0.93305449498070 0.60689959827323 15.999 > 1 4 O 0.89373621126003 0.93305449498070 0.60689959827323 15.999 > 1 5 O 0.10626378873997 0.93305449498070 0.14310040172677 15.999 > 2 6 O 0.60626378873997 0.93305449498070 0.14310040172677 15.999 > 2 7 O 0.10626378873997 0.93305449498070 0.64310040172677 15.999 > 2 8 O 0.60626378873997 0.93305449498070 0.64310040172677 15.999 > 2 9 O 0.10626378873997 0.06694550501930 0.39310040172677 15.999 > 3 10 O 0.60626378873997 0.06694550501930 0.39310040172677 15.999 > 3 11 O 0.10626378873997 0.06694550501930 0.89310040172677 15.999 > 3 12 O 0.60626378873997 0.06694550501930 0.89310040172677 15.999 > 3 13 O 0.39373621126003 0.06694550501930 0.35689959827323 15.999 > 4 14 O 0.89373621126003 0.06694550501930 0.35689959827323 15.999 > 4 15 O 0.39373621126003 0.06694550501930 0.85689959827323 15.999 > 4 16 O 0.89373621126003 0.06694550501930 0.85689959827323 15.999 > 4 17 O 0.14373621126003 0.43305449498070 0.10689959827323 15.999 > 1 18 O 0.64373621126003 0.43305449498070 0.10689959827323 15.999 > 1 19 O 0.14373621126003 0.43305449498070 0.60689959827323 15.999 > 1 20 O 0.64373621126003 0.43305449498070 0.60689959827323 15.999 > 1 21 O 0.35626378873997 0.43305449498070 0.14310040172677 15.999 > 2 22 O 0.85626378873997 0.43305449498070 0.14310040172677 15.999 > 2 23 O 0.35626378873997 0.43305449498070 0.64310040172677 15.999 > 2 24 O 0.85626378873997 0.43305449498070 0.64310040172677 15.999 > 2 25 O 0.35626378873997 0.56694550501930 0.39310040172677 15.999 > 3 26 O 0.85626378873997 0.56694550501930 0.39310040172677 15.999 > 3 27 O 0.35626378873997 0.56694550501930 0.89310040172677 15.999 > 3 28 O 0.85626378873997 0.56694550501930 0.89310040172677 15.999 > 3 29 O 0.14373621126003 0.56694550501930 0.35689959827323 15.999 > 4 30 O 0.64373621126003 0.56694550501930 0.35689959827323 15.999 > 4 31 O 0.14373621126003 0.56694550501930 0.85689959827323 15.999 > 4 32 O 0.64373621126003 0.56694550501930 0.85689959827323 15.999 > 4 *33 Cu 0.25000000000000 0.00000000000000 0.25000000000000 63.546 > 5 34 Cu 0.75000000000000 0.00000000000000 0.25000000000000 63.546 > 5 35 Cu 0.25000000000000 0.00000000000000 0.75000000000000 63.546 > 5 36 Cu 0.75000000000000 0.00000000000000 0.75000000000000 63.546 > 5 37 Cu 0.25000000000000 0.00000000000000 0.00000000000000 63.546 > 6 38 Cu 0.75000000000000 0.00000000000000 0.00000000000000 63.546 > 6 39 Cu 0.25000000000000 0.00000000000000 0.50000000000000 63.546 > 6 40 Cu 0.75000000000000 0.00000000000000 0.50000000000000 63.546 > 6 *41 Cu 0.37500000000000 0.75000000000000 0.00000000000000 63.546 > 7 42 Cu 0.87500000000000 0.75000000000000 0.00000000000000 63.546 > 7 43 Cu 0.37500000000000 0.75000000000000 0.50000000000000 63.546 > 7 44 Cu 0.87500000000000 0.75000000000000 0.50000000000000 63.546 > 7 45 Cu 0.37500000000000 0.25000000000000 0.25000000000000 63.546 > 8 46 Cu 0.87500000000000 0.25000000000000 0.25000000000000 63.546 > 8 47 Cu 0.37500000000000 0.25000000000000 0.75000000000000 63.546 > 8 48 Cu 0.87500000000000 0.25000000000000 0.75000000000000 63.546 > 8 49 Cu 0.00000000000000 0.50000000000000 0.25000000000000 63.546 > 5 50 Cu 0.50000000000000 0.50000000000000 0.25000000000000 63.546 > 5 51 Cu 0.00000000000000 0.50000000000000 0.75000000000000 63.546 > 5 52 Cu 0.50000000000000 0.50000000000000 0.75000000000000 63.546 > 5 53 Cu 0.00000000000000 0.50000000000000 0.00000000000000 63.546 > 6 54 Cu 0.50000000000000 0.50000000000000 0.00000000000000 63.546 > 6 55 Cu 0.00000000000000 0.50000000000000 0.50000000000000 63.546 > 6 56 Cu 0.50000000000000 0.50000000000000 0.50000000000000 63.546 > 6 57 Cu 0.12500000000000 0.25000000000000 0.00000000000000 63.546 > 7 58 Cu 0.62500000000000 0.25000000000000 0.00000000000000 63.546 > 7 59 Cu 0.12500000000000 0.25000000000000 0.50000000000000 63.546 > 7 60 Cu 0.62500000000000 0.25000000000000 0.50000000000000 63.546 > 7 61 Cu 0.12500000000000 0.75000000000000 0.25000000000000 63.546 > 8 62 Cu 0.62500000000000 0.75000000000000 0.25000000000000 63.546 > 8 63 Cu 0.12500000000000 0.75000000000000 0.75000000000000 63.546 > 8 64 Cu 0.62500000000000 0.75000000000000 0.75000000000000 63.546 > 8 *65 Pb 0.25000000000000 0.63687043364658 0.12500000000000 207.200 > 9 66 Pb 0.75000000000000 0.63687043364658 0.12500000000000 207.200 > 9 67 Pb 0.25000000000000 0.63687043364658 0.62500000000000 207.200 > 9 68 Pb 0.75000000000000 0.63687043364658 0.62500000000000 207.200 > 9 69 Pb 0.25000000000000 0.36312956635342 0.37500000000000 207.200 > 10 70 Pb 0.75000000000000 0.36312956635342 0.37500000000000 207.200 > 10 71 Pb 0.25000000000000 0.36312956635342 0.87500000000000 207.200 > 10 72 Pb 0.75000000000000 0.36312956635342 0.87500000000000 207.200 > 10 73 Pb 0.00000000000000 0.13687043364658 0.12500000000000 207.200 > 9 74 Pb 0.50000000000000 0.13687043364658 0.12500000000000 207.200 > 9 75 Pb 0.00000000000000 0.13687043364658 0.62500000000000 207.200 > 9 76 Pb 0.50000000000000 0.13687043364658 0.62500000000000 207.200 > 9 77 Pb 0.00000000000000 0.86312956635342 0.37500000000000 207.200 > 10 78 Pb 0.50000000000000 0.86312956635342 0.37500000000000 207.200 > 10 79 Pb 0.00000000000000 0.86312956635342 0.87500000000000 207.200 > 10 80 Pb 0.50000000000000 0.86312956635342 0.87500000000000 207.200 > 10 ---------------------------------------------------------------------------- NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". --------------------------- Dielectric constant ---------------------------- 9.8254912 0.0000000 -0.2081895 0.0000000 10.4411777 0.0000000 -0.2081891 0.0000000 9.3261817 -------------------------- Born effective charges -------------------------- 1 O -2.1220605 -0.6827542 0.0208170 -0.6946738 -2.4019181 0.1022214 0.0124619 0.0740577 -2.4551678 2 O -2.1220605 0.6827542 0.0208170 0.6946738 -2.4019181 -0.1022214 0.0124619 -0.0740577 -2.4551678 3 O -2.1220605 -0.6827542 0.0208170 -0.6946738 -2.4019181 0.1022214 0.0124619 0.0740577 -2.4551678 4 O -2.1220605 0.6827542 0.0208170 0.6946738 -2.4019181 -0.1022214 0.0124619 -0.0740577 -2.4551678 5 Cu 1.0398517 0.4198291 0.4030503 0.5064583 0.1501598 0.0357785 0.5043828 0.1230363 0.8542712 6 Cu 1.0398517 -0.4198291 0.4030503 -0.5064583 0.1501598 -0.0357785 0.5043828 -0.1230363 0.8542712 7 Cu 0.0964358 -0.2613008 0.1157112 -0.4114640 1.1594669 0.4997617 -0.0193609 0.4341998 0.5335449 8 Cu 0.0964358 0.2613008 0.1157112 0.4114640 1.1594669 -0.4997617 -0.0193609 -0.4341998 0.5335449 9 Pb 3.1078335 0.0000000 -0.5603955 0.0000000 3.4942096 0.0000000 -0.5099457 0.0000000 3.5225196 10 Pb 3.1078335 0.0000000 -0.5603955 0.0000000 3.4942096 0.0000000 -0.5099457 0.0000000 3.5225196 ---------------------------------------------------------------------------- Displacement-force dataset was read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". -------------------------------- Symfc start ------------------------------- Symfc version 1.5.4 (https://github.com/symfc/symfc) Citation: A. Seko and A. Togo, Phys. Rev. B, 110, 214302 (2024) Computing [2] order force constants. Permutation basis: 240/240 Permutation basis: 4368/4368 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 994 Number of blocks in projector: 994 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: 206 Use standard eigh solver. --- Eigsh_solver_block: 2 / 6 --- Block_size: 202 Use standard eigh solver. --- Eigsh_solver_block: 3 / 6 --- Block_size: 202 Use standard eigh solver. --- Eigsh_solver_block: 4 / 6 --- Block_size: 128 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 128 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 128 Use standard eigh solver. Tree of FC basis block matrices: - (994, 963), data: False |-- (128, 124), data: True |-- (128, 124), data: True |-- (128, 124), data: True |-- (202, 196), data: True |-- (202, 196), data: True |-- (206, 199), data: True ----- Solver_atoms: 1 -- 80 / 80 Time (Solver_compr_matrix_reshape): 0.002 Solver_block: 100 / 320 - Time: 0.182 Solver_block: 200 / 320 - Time: 0.191 Solver_block: 300 / 320 - Time: 0.191 Solver_block: 320 / 320 - Time: 0.060 Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 0.638 --------------------------------- Symfc end -------------------------------- Max drift of force constants: 0.00000000 (yy) 0.00000000 (yy) Permutation basis: 240/240 Permutation basis: 4368/4368 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 994 Number of blocks in projector: 994 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: 206 Use standard eigh solver. --- Eigsh_solver_block: 2 / 6 --- Block_size: 202 Use standard eigh solver. --- Eigsh_solver_block: 3 / 6 --- Block_size: 202 Use standard eigh solver. --- Eigsh_solver_block: 4 / 6 --- Block_size: 128 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 128 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 128 Use standard eigh solver. Tree of FC basis block matrices: - (994, 963), data: False |-- (128, 124), data: True |-- (128, 124), data: True |-- (128, 124), data: True |-- (202, 196), data: True |-- (202, 196), data: True |-- (206, 199), data: True Max drift after symmetrization by symfc projector: 0.00000000 (yy) 0.00000000 (yy) Force constants are written into "force_constants.hdf5". ---------------------------------------------------------------------------- One of the following run modes may be specified for phonon calculations. - Mesh sampling (MESH, --mesh) - Q-points (QPOINTS, --qpoints) - Band structure (BAND, --band) - Animation (ANIME, --anime) - Modulation (MODULATION, --modulation) - Characters of Irreps (IRREPS, --irreps) - Create displacements (CREATE_DISPLACEMENTS, -d) ---------------------------------------------------------------------------- Summary of calculation was written in "phonopy.yaml". -------------------------[time 2026-01-08 08:03:12]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate fc3 ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 08:03:12]------------------------- Compiled with OpenMP support (max 48 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: force constants HDF5 data compression filter: gzip Crystal structure was read from "phono3py_mlp_eval_fc3_disp.yaml.xz". Supercell (dim): [2 1 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 4.024388012735954 -4.057675470000001 0.000000000000000 b 4.024388012735954 4.057675470000001 0.000000000000000 c -3.891020374960855 0.000000000000000 4.404675240205614 Atomic positions (fractional): 1 O 0.85441792753935 0.72052691750075 0.21379919654646 15.999 2 O 0.27947308249925 0.14558207246065 0.28620080345354 15.999 3 O 0.14558207246065 0.27947308249925 0.78620080345354 15.999 4 O 0.72052691750075 0.85441792753935 0.71379919654646 15.999 5 Cu 0.50000000000000 0.50000000000000 0.50000000000000 63.546 6 Cu 0.50000000000000 0.50000000000000 0.00000000000000 63.546 7 Cu 0.00000000000000 0.50000000000000 0.00000000000000 63.546 8 Cu 0.50000000000000 0.00000000000000 0.50000000000000 63.546 9 Pb 0.86312956635342 0.13687043364658 0.25000000000000 207.200 10 Pb 0.13687043364658 0.86312956635342 0.75000000000000 207.200 -------------------------------- supercell --------------------------------- Lattice vectors: a 16.097552050943815 0.000000000000000 0.000000000000000 b 0.000000000000000 8.115350940000003 0.000000000000000 c -7.782040749921710 0.000000000000000 8.809350480411227 Atomic positions (fractional): 1 O 0.39373621126003 0.93305449498070 0.10689959827323 15.999 > 1 2 O 0.89373621126003 0.93305449498070 0.10689959827323 15.999 > 1 3 O 0.39373621126003 0.93305449498070 0.60689959827323 15.999 > 1 4 O 0.89373621126003 0.93305449498070 0.60689959827323 15.999 > 1 5 O 0.10626378873997 0.93305449498070 0.14310040172677 15.999 > 5 6 O 0.60626378873997 0.93305449498070 0.14310040172677 15.999 > 5 7 O 0.10626378873997 0.93305449498070 0.64310040172677 15.999 > 5 8 O 0.60626378873997 0.93305449498070 0.64310040172677 15.999 > 5 9 O 0.10626378873997 0.06694550501930 0.39310040172677 15.999 > 9 10 O 0.60626378873997 0.06694550501930 0.39310040172677 15.999 > 9 11 O 0.10626378873997 0.06694550501930 0.89310040172677 15.999 > 9 12 O 0.60626378873997 0.06694550501930 0.89310040172677 15.999 > 9 13 O 0.39373621126003 0.06694550501930 0.35689959827323 15.999 > 13 14 O 0.89373621126003 0.06694550501930 0.35689959827323 15.999 > 13 15 O 0.39373621126003 0.06694550501930 0.85689959827323 15.999 > 13 16 O 0.89373621126003 0.06694550501930 0.85689959827323 15.999 > 13 17 O 0.14373621126003 0.43305449498070 0.10689959827323 15.999 > 1 18 O 0.64373621126003 0.43305449498070 0.10689959827323 15.999 > 1 19 O 0.14373621126003 0.43305449498070 0.60689959827323 15.999 > 1 20 O 0.64373621126003 0.43305449498070 0.60689959827323 15.999 > 1 21 O 0.35626378873997 0.43305449498070 0.14310040172677 15.999 > 5 22 O 0.85626378873997 0.43305449498070 0.14310040172677 15.999 > 5 23 O 0.35626378873997 0.43305449498070 0.64310040172677 15.999 > 5 24 O 0.85626378873997 0.43305449498070 0.64310040172677 15.999 > 5 25 O 0.35626378873997 0.56694550501930 0.39310040172677 15.999 > 9 26 O 0.85626378873997 0.56694550501930 0.39310040172677 15.999 > 9 27 O 0.35626378873997 0.56694550501930 0.89310040172677 15.999 > 9 28 O 0.85626378873997 0.56694550501930 0.89310040172677 15.999 > 9 29 O 0.14373621126003 0.56694550501930 0.35689959827323 15.999 > 13 30 O 0.64373621126003 0.56694550501930 0.35689959827323 15.999 > 13 31 O 0.14373621126003 0.56694550501930 0.85689959827323 15.999 > 13 32 O 0.64373621126003 0.56694550501930 0.85689959827323 15.999 > 13 33 Cu 0.25000000000000 0.00000000000000 0.25000000000000 63.546 > 33 34 Cu 0.75000000000000 0.00000000000000 0.25000000000000 63.546 > 33 35 Cu 0.25000000000000 0.00000000000000 0.75000000000000 63.546 > 33 36 Cu 0.75000000000000 0.00000000000000 0.75000000000000 63.546 > 33 37 Cu 0.25000000000000 0.00000000000000 0.00000000000000 63.546 > 37 38 Cu 0.75000000000000 0.00000000000000 0.00000000000000 63.546 > 37 39 Cu 0.25000000000000 0.00000000000000 0.50000000000000 63.546 > 37 40 Cu 0.75000000000000 0.00000000000000 0.50000000000000 63.546 > 37 41 Cu 0.37500000000000 0.75000000000000 0.00000000000000 63.546 > 41 42 Cu 0.87500000000000 0.75000000000000 0.00000000000000 63.546 > 41 43 Cu 0.37500000000000 0.75000000000000 0.50000000000000 63.546 > 41 44 Cu 0.87500000000000 0.75000000000000 0.50000000000000 63.546 > 41 45 Cu 0.37500000000000 0.25000000000000 0.25000000000000 63.546 > 45 46 Cu 0.87500000000000 0.25000000000000 0.25000000000000 63.546 > 45 47 Cu 0.37500000000000 0.25000000000000 0.75000000000000 63.546 > 45 48 Cu 0.87500000000000 0.25000000000000 0.75000000000000 63.546 > 45 49 Cu 0.00000000000000 0.50000000000000 0.25000000000000 63.546 > 33 50 Cu 0.50000000000000 0.50000000000000 0.25000000000000 63.546 > 33 51 Cu 0.00000000000000 0.50000000000000 0.75000000000000 63.546 > 33 52 Cu 0.50000000000000 0.50000000000000 0.75000000000000 63.546 > 33 53 Cu 0.00000000000000 0.50000000000000 0.00000000000000 63.546 > 37 54 Cu 0.50000000000000 0.50000000000000 0.00000000000000 63.546 > 37 55 Cu 0.00000000000000 0.50000000000000 0.50000000000000 63.546 > 37 56 Cu 0.50000000000000 0.50000000000000 0.50000000000000 63.546 > 37 57 Cu 0.12500000000000 0.25000000000000 0.00000000000000 63.546 > 41 58 Cu 0.62500000000000 0.25000000000000 0.00000000000000 63.546 > 41 59 Cu 0.12500000000000 0.25000000000000 0.50000000000000 63.546 > 41 60 Cu 0.62500000000000 0.25000000000000 0.50000000000000 63.546 > 41 61 Cu 0.12500000000000 0.75000000000000 0.25000000000000 63.546 > 45 62 Cu 0.62500000000000 0.75000000000000 0.25000000000000 63.546 > 45 63 Cu 0.12500000000000 0.75000000000000 0.75000000000000 63.546 > 45 64 Cu 0.62500000000000 0.75000000000000 0.75000000000000 63.546 > 45 65 Pb 0.25000000000000 0.63687043364658 0.12500000000000 207.200 > 65 66 Pb 0.75000000000000 0.63687043364658 0.12500000000000 207.200 > 65 67 Pb 0.25000000000000 0.63687043364658 0.62500000000000 207.200 > 65 68 Pb 0.75000000000000 0.63687043364658 0.62500000000000 207.200 > 65 69 Pb 0.25000000000000 0.36312956635342 0.37500000000000 207.200 > 69 70 Pb 0.75000000000000 0.36312956635342 0.37500000000000 207.200 > 69 71 Pb 0.25000000000000 0.36312956635342 0.87500000000000 207.200 > 69 72 Pb 0.75000000000000 0.36312956635342 0.87500000000000 207.200 > 69 73 Pb 0.00000000000000 0.13687043364658 0.12500000000000 207.200 > 65 74 Pb 0.50000000000000 0.13687043364658 0.12500000000000 207.200 > 65 75 Pb 0.00000000000000 0.13687043364658 0.62500000000000 207.200 > 65 76 Pb 0.50000000000000 0.13687043364658 0.62500000000000 207.200 > 65 77 Pb 0.00000000000000 0.86312956635342 0.37500000000000 207.200 > 69 78 Pb 0.50000000000000 0.86312956635342 0.37500000000000 207.200 > 69 79 Pb 0.00000000000000 0.86312956635342 0.87500000000000 207.200 > 69 80 Pb 0.50000000000000 0.86312956635342 0.87500000000000 207.200 > 69 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz". --------------------------- Dielectric constant ---------------------------- 9.8254912 0.0000000 -0.2081895 0.0000000 10.4411777 0.0000000 -0.2081891 0.0000000 9.3261817 -------------------------- Born effective charges -------------------------- 1 O -2.1220605 -0.6827542 0.0208170 -0.6946738 -2.4019181 0.1022214 0.0124619 0.0740577 -2.4551678 2 O -2.1220605 0.6827542 0.0208170 0.6946738 -2.4019181 -0.1022214 0.0124619 -0.0740577 -2.4551678 3 O -2.1220605 -0.6827542 0.0208170 -0.6946738 -2.4019181 0.1022214 0.0124619 0.0740577 -2.4551678 4 O -2.1220605 0.6827542 0.0208170 0.6946738 -2.4019181 -0.1022214 0.0124619 -0.0740577 -2.4551678 5 Cu 1.0398517 0.4198291 0.4030503 0.5064583 0.1501598 0.0357785 0.5043828 0.1230363 0.8542712 6 Cu 1.0398517 -0.4198291 0.4030503 -0.5064583 0.1501598 -0.0357785 0.5043828 -0.1230363 0.8542712 7 Cu 0.0964358 -0.2613008 0.1157112 -0.4114640 1.1594669 0.4997617 -0.0193609 0.4341998 0.5335449 8 Cu 0.0964358 0.2613008 0.1157112 0.4114640 1.1594669 -0.4997617 -0.0193609 -0.4341998 0.5335449 9 Pb 3.1078335 0.0000000 -0.5603955 0.0000000 3.4942096 0.0000000 -0.5099457 0.0000000 3.5225196 10 Pb 3.1078335 0.0000000 -0.5603955 0.0000000 3.4942096 0.0000000 -0.5099457 0.0000000 3.5225196 ---------------------------------------------------------------------------- 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] [-0.0066 0.0000 0.0075] [ 0.0066 0.0000 -0.0075] Computing fc3[ 33, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0066 0.0000 0.0075] [ 0.0066 0.0000 -0.0075] Computing fc3[ 41, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0066 0.0000 0.0075] [ 0.0066 0.0000 -0.0075] Computing fc3[ 65, 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] [-0.0066 0.0000 0.0075] [ 0.0066 0.0000 -0.0075] Expanding fc3. Symmetrizing fc3 by traditional approach (N=3). Symmetrizing fc2 by traditional approach (N=3). Max drift of fc3: -0.00000018 (yyy) -0.00000018 (yyy) -0.00000018 (yyy) fc3 was written into "fc3.hdf5". Max drift of fc2: 0.00000003 (xz) 0.00000003 (xz) fc2 was written into "fc2.hdf5". --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperatures: 0.0 300.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 ----------- None of ph-ph interaction calculation was performed. ----------- Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-08 08:03:20]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate LTC ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 08:03:21]------------------------- Compiled with OpenMP support (max 48 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: conductivity-RTA HDF5 data compression filter: gzip Crystal structure was read from "phono3py.yaml". Supercell (dim): [2 1 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 4.024388012735954 -4.057675470000001 0.000000000000000 b 4.024388012735954 4.057675470000001 0.000000000000000 c -3.891020374960855 0.000000000000000 4.404675240205614 Atomic positions (fractional): 1 O 0.85441792753935 0.72052691750075 0.21379919654646 15.999 2 O 0.27947308249925 0.14558207246065 0.28620080345354 15.999 3 O 0.14558207246065 0.27947308249925 0.78620080345354 15.999 4 O 0.72052691750075 0.85441792753935 0.71379919654646 15.999 5 Cu 0.50000000000000 0.50000000000000 0.50000000000000 63.546 6 Cu 0.50000000000000 0.50000000000000 0.00000000000000 63.546 7 Cu 0.00000000000000 0.50000000000000 0.00000000000000 63.546 8 Cu 0.50000000000000 0.00000000000000 0.50000000000000 63.546 9 Pb 0.86312956635342 0.13687043364658 0.25000000000000 207.200 10 Pb 0.13687043364658 0.86312956635342 0.75000000000000 207.200 -------------------------------- supercell --------------------------------- Lattice vectors: a 16.097552050943815 0.000000000000000 0.000000000000000 b 0.000000000000000 8.115350940000003 0.000000000000000 c -7.782040749921710 0.000000000000000 8.809350480411227 Atomic positions (fractional): 1 O 0.39373621126003 0.93305449498070 0.10689959827323 15.999 > 1 2 O 0.89373621126003 0.93305449498070 0.10689959827323 15.999 > 1 3 O 0.39373621126003 0.93305449498070 0.60689959827323 15.999 > 1 4 O 0.89373621126003 0.93305449498070 0.60689959827323 15.999 > 1 5 O 0.10626378873997 0.93305449498070 0.14310040172677 15.999 > 5 6 O 0.60626378873997 0.93305449498070 0.14310040172677 15.999 > 5 7 O 0.10626378873997 0.93305449498070 0.64310040172677 15.999 > 5 8 O 0.60626378873997 0.93305449498070 0.64310040172677 15.999 > 5 9 O 0.10626378873997 0.06694550501930 0.39310040172677 15.999 > 9 10 O 0.60626378873997 0.06694550501930 0.39310040172677 15.999 > 9 11 O 0.10626378873997 0.06694550501930 0.89310040172677 15.999 > 9 12 O 0.60626378873997 0.06694550501930 0.89310040172677 15.999 > 9 13 O 0.39373621126003 0.06694550501930 0.35689959827323 15.999 > 13 14 O 0.89373621126003 0.06694550501930 0.35689959827323 15.999 > 13 15 O 0.39373621126003 0.06694550501930 0.85689959827323 15.999 > 13 16 O 0.89373621126003 0.06694550501930 0.85689959827323 15.999 > 13 17 O 0.14373621126003 0.43305449498070 0.10689959827323 15.999 > 1 18 O 0.64373621126003 0.43305449498070 0.10689959827323 15.999 > 1 19 O 0.14373621126003 0.43305449498070 0.60689959827323 15.999 > 1 20 O 0.64373621126003 0.43305449498070 0.60689959827323 15.999 > 1 21 O 0.35626378873997 0.43305449498070 0.14310040172677 15.999 > 5 22 O 0.85626378873997 0.43305449498070 0.14310040172677 15.999 > 5 23 O 0.35626378873997 0.43305449498070 0.64310040172677 15.999 > 5 24 O 0.85626378873997 0.43305449498070 0.64310040172677 15.999 > 5 25 O 0.35626378873997 0.56694550501930 0.39310040172677 15.999 > 9 26 O 0.85626378873997 0.56694550501930 0.39310040172677 15.999 > 9 27 O 0.35626378873997 0.56694550501930 0.89310040172677 15.999 > 9 28 O 0.85626378873997 0.56694550501930 0.89310040172677 15.999 > 9 29 O 0.14373621126003 0.56694550501930 0.35689959827323 15.999 > 13 30 O 0.64373621126003 0.56694550501930 0.35689959827323 15.999 > 13 31 O 0.14373621126003 0.56694550501930 0.85689959827323 15.999 > 13 32 O 0.64373621126003 0.56694550501930 0.85689959827323 15.999 > 13 33 Cu 0.25000000000000 0.00000000000000 0.25000000000000 63.546 > 33 34 Cu 0.75000000000000 0.00000000000000 0.25000000000000 63.546 > 33 35 Cu 0.25000000000000 0.00000000000000 0.75000000000000 63.546 > 33 36 Cu 0.75000000000000 0.00000000000000 0.75000000000000 63.546 > 33 37 Cu 0.25000000000000 0.00000000000000 0.00000000000000 63.546 > 37 38 Cu 0.75000000000000 0.00000000000000 0.00000000000000 63.546 > 37 39 Cu 0.25000000000000 0.00000000000000 0.50000000000000 63.546 > 37 40 Cu 0.75000000000000 0.00000000000000 0.50000000000000 63.546 > 37 41 Cu 0.37500000000000 0.75000000000000 0.00000000000000 63.546 > 41 42 Cu 0.87500000000000 0.75000000000000 0.00000000000000 63.546 > 41 43 Cu 0.37500000000000 0.75000000000000 0.50000000000000 63.546 > 41 44 Cu 0.87500000000000 0.75000000000000 0.50000000000000 63.546 > 41 45 Cu 0.37500000000000 0.25000000000000 0.25000000000000 63.546 > 45 46 Cu 0.87500000000000 0.25000000000000 0.25000000000000 63.546 > 45 47 Cu 0.37500000000000 0.25000000000000 0.75000000000000 63.546 > 45 48 Cu 0.87500000000000 0.25000000000000 0.75000000000000 63.546 > 45 49 Cu 0.00000000000000 0.50000000000000 0.25000000000000 63.546 > 33 50 Cu 0.50000000000000 0.50000000000000 0.25000000000000 63.546 > 33 51 Cu 0.00000000000000 0.50000000000000 0.75000000000000 63.546 > 33 52 Cu 0.50000000000000 0.50000000000000 0.75000000000000 63.546 > 33 53 Cu 0.00000000000000 0.50000000000000 0.00000000000000 63.546 > 37 54 Cu 0.50000000000000 0.50000000000000 0.00000000000000 63.546 > 37 55 Cu 0.00000000000000 0.50000000000000 0.50000000000000 63.546 > 37 56 Cu 0.50000000000000 0.50000000000000 0.50000000000000 63.546 > 37 57 Cu 0.12500000000000 0.25000000000000 0.00000000000000 63.546 > 41 58 Cu 0.62500000000000 0.25000000000000 0.00000000000000 63.546 > 41 59 Cu 0.12500000000000 0.25000000000000 0.50000000000000 63.546 > 41 60 Cu 0.62500000000000 0.25000000000000 0.50000000000000 63.546 > 41 61 Cu 0.12500000000000 0.75000000000000 0.25000000000000 63.546 > 45 62 Cu 0.62500000000000 0.75000000000000 0.25000000000000 63.546 > 45 63 Cu 0.12500000000000 0.75000000000000 0.75000000000000 63.546 > 45 64 Cu 0.62500000000000 0.75000000000000 0.75000000000000 63.546 > 45 65 Pb 0.25000000000000 0.63687043364658 0.12500000000000 207.200 > 65 66 Pb 0.75000000000000 0.63687043364658 0.12500000000000 207.200 > 65 67 Pb 0.25000000000000 0.63687043364658 0.62500000000000 207.200 > 65 68 Pb 0.75000000000000 0.63687043364658 0.62500000000000 207.200 > 65 69 Pb 0.25000000000000 0.36312956635342 0.37500000000000 207.200 > 69 70 Pb 0.75000000000000 0.36312956635342 0.37500000000000 207.200 > 69 71 Pb 0.25000000000000 0.36312956635342 0.87500000000000 207.200 > 69 72 Pb 0.75000000000000 0.36312956635342 0.87500000000000 207.200 > 69 73 Pb 0.00000000000000 0.13687043364658 0.12500000000000 207.200 > 65 74 Pb 0.50000000000000 0.13687043364658 0.12500000000000 207.200 > 65 75 Pb 0.00000000000000 0.13687043364658 0.62500000000000 207.200 > 65 76 Pb 0.50000000000000 0.13687043364658 0.62500000000000 207.200 > 65 77 Pb 0.00000000000000 0.86312956635342 0.37500000000000 207.200 > 69 78 Pb 0.50000000000000 0.86312956635342 0.37500000000000 207.200 > 69 79 Pb 0.00000000000000 0.86312956635342 0.87500000000000 207.200 > 69 80 Pb 0.50000000000000 0.86312956635342 0.87500000000000 207.200 > 69 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py.yaml". --------------------------- Dielectric constant ---------------------------- 9.8254912 0.0000000 -0.2081895 0.0000000 10.4411777 0.0000000 -0.2081891 0.0000000 9.3261817 -------------------------- Born effective charges -------------------------- 1 O -2.1220605 -0.6827542 0.0208170 -0.6946738 -2.4019181 0.1022214 0.0124619 0.0740577 -2.4551678 2 O -2.1220605 0.6827542 0.0208170 0.6946738 -2.4019181 -0.1022214 0.0124619 -0.0740577 -2.4551678 3 O -2.1220605 -0.6827542 0.0208170 -0.6946738 -2.4019181 0.1022214 0.0124619 0.0740577 -2.4551678 4 O -2.1220605 0.6827542 0.0208170 0.6946738 -2.4019181 -0.1022214 0.0124619 -0.0740577 -2.4551678 5 Cu 1.0398517 0.4198291 0.4030503 0.5064583 0.1501598 0.0357785 0.5043828 0.1230363 0.8542712 6 Cu 1.0398517 -0.4198291 0.4030503 -0.5064583 0.1501598 -0.0357785 0.5043828 -0.1230363 0.8542712 7 Cu 0.0964358 -0.2613008 0.1157112 -0.4114640 1.1594669 0.4997617 -0.0193609 0.4341998 0.5335449 8 Cu 0.0964358 0.2613008 0.1157112 0.4114640 1.1594669 -0.4997617 -0.0193609 -0.4341998 0.5335449 9 Pb 3.1078335 0.0000000 -0.5603955 0.0000000 3.4942096 0.0000000 -0.5099457 0.0000000 3.5225196 10 Pb 3.1078335 0.0000000 -0.5603955 0.0000000 3.4942096 0.0000000 -0.5099457 0.0000000 3.5225196 ---------------------------------------------------------------------------- fc3 was read from "fc3.hdf5". fc2 was read from "fc2.hdf5". ----------------------------- Force constants ------------------------------ Max drift of fc3: -0.00000018 (yyy) -0.00000018 (yyy) -0.00000018 (yyy) Max drift of fc2: 0.00000000 (yy) 0.00000000 (yy) --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperature: 0.0 10.0 20.0 30.0 40.0 ... 1000.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 Length for sampling mesh generation: 50.00 Generating grid system ... [ 10 10 11 ] 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: 0.79, Number of G-points: 307, Lambda: 0.26 Running harmonic phonon calculations... -------------------- Lattice thermal conductivity (RTA) -------------------- ======================= Grid point 0 (1/306) ======================= 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 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.000 ( 0.000 0.000 0.000) 0.000 0.000 ( 0.000 0.000 0.000) 0.000 0.000 ( 0.000 0.000 0.000) 0.000 0.829 ( 0.000 0.000 0.000) 0.000 1.827 ( 0.000 0.000 0.000) 0.000 1.983 ( 0.000 0.000 0.000) 0.000 2.489 ( 0.000 0.000 0.000) 0.000 2.509 ( 0.000 0.000 0.000) 0.000 2.874 ( 0.000 0.000 0.000) 0.000 2.914 ( 0.000 0.000 0.000) 0.000 3.103 ( 0.000 0.000 0.000) 0.000 3.296 ( 0.000 0.000 0.000) 0.000 3.327 ( 0.000 0.000 0.000) 0.000 3.533 ( 0.000 0.000 0.000) 0.000 3.988 ( 0.000 0.000 0.000) 0.000 4.083 ( 0.000 0.000 0.000) 0.000 5.774 ( 0.000 0.000 0.000) 0.000 5.866 ( 0.000 0.000 0.000) 0.000 8.199 ( 0.000 0.000 0.000) 0.000 8.884 ( 0.000 0.000 0.000) 0.000 9.574 ( 0.000 0.000 0.000) 0.000 10.781 ( 0.000 0.000 0.000) 0.000 14.167 ( 0.000 0.000 0.000) 0.000 14.578 ( 0.000 0.000 0.000) 0.000 15.562 ( 0.000 0.000 0.000) 0.000 15.675 ( 0.000 0.000 0.000) 0.000 16.522 ( 0.000 0.000 0.000) 0.000 16.808 ( 0.000 0.000 0.000) 0.000 17.834 ( 0.000 0.000 0.000) 0.000 18.362 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 1 (2/306) ======================= q-point: ( 0.10 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 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.310 ( 6.791 -10.241 8.080) 14.706 0.323 ( 9.869 -11.680 4.273) 15.877 0.757 ( 23.052 -14.443 22.124) 35.064 0.943 ( 10.484 -5.599 1.181) 11.944 1.831 ( 0.556 -1.617 -1.371) 2.192 1.961 ( -2.674 -0.806 -1.680) 3.260 2.491 ( -0.010 0.809 0.459) 0.930 2.517 ( -1.807 0.538 3.526) 3.998 2.872 ( 0.296 1.163 -2.762) 3.011 2.901 ( -2.939 -0.852 1.209) 3.290 3.107 ( -0.859 -0.759 -0.933) 1.478 3.267 ( -2.739 0.338 -3.032) 4.100 3.364 ( 3.219 3.344 1.670) 4.933 3.558 ( -0.869 -1.202 -1.585) 2.171 3.983 ( -0.246 0.286 -0.321) 0.495 4.102 ( 1.710 -2.130 -3.253) 4.248 5.717 ( -5.547 5.860 0.648) 8.095 6.163 ( -8.297 14.954 25.113) 30.383 8.256 ( 1.565 -1.545 6.636) 6.991 8.791 ( 2.136 -3.138 -20.235) 20.588 9.689 ( 6.136 0.597 10.322) 12.023 11.185 ( -19.127 -39.823 -25.395) 50.956 14.189 ( 2.307 -1.910 -1.294) 3.262 14.586 ( 1.320 -3.820 -3.790) 5.540 15.585 ( 3.010 1.523 2.148) 3.999 15.645 ( -1.547 1.418 -1.750) 2.733 16.763 ( 4.357 5.822 5.106) 8.886 17.199 ( -4.983 7.140 17.139) 19.224 18.003 ( 13.519 14.862 3.845) 20.456 18.585 ( -10.899 -10.710 -7.949) 17.224 ======================= Grid point 2 (3/306) ======================= q-point: ( 0.20 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 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 552 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.589 ( 6.166 -8.831 6.372) 12.515 0.622 ( 9.145 -10.767 3.252) 14.496 1.109 ( 3.647 -8.001 2.435) 9.124 1.479 ( 23.240 -10.372 19.764) 32.223 1.852 ( -2.875 -1.923 1.118) 3.635 1.924 ( 1.582 -4.624 -5.252) 7.175 2.474 ( 0.731 1.838 -0.811) 2.138 2.541 ( 0.529 -0.041 2.385) 2.443 2.806 ( -2.442 2.267 -2.047) 3.911 2.889 ( -2.002 -0.430 0.252) 2.063 3.092 ( -1.463 -2.784 -3.093) 4.411 3.200 ( -2.540 0.454 -1.934) 3.225 3.367 ( 0.982 2.794 0.864) 3.085 3.527 ( -0.985 1.718 -1.482) 2.473 3.968 ( -0.109 0.847 -0.738) 1.129 4.124 ( 3.861 -3.038 -4.732) 6.821 5.516 ( -10.591 12.865 2.329) 16.825 6.155 ( -3.106 5.987 9.933) 12.007 8.386 ( 1.182 -0.006 6.580) 6.686 8.649 ( 5.453 -7.067 -18.966) 20.962 9.904 ( 0.722 -1.567 18.731) 18.810 11.136 ( -6.931 -16.745 -18.056) 25.582 14.222 ( 2.275 -1.637 -2.994) 4.101 14.643 ( 4.278 -9.205 -5.838) 11.710 15.566 ( -2.892 1.770 -2.753) 4.368 15.638 ( 4.587 5.080 4.551) 8.220 16.826 ( 4.601 -1.370 1.393) 4.998 17.252 ( -1.464 0.971 8.567) 8.745 18.039 ( 7.457 7.116 3.450) 10.869 18.451 ( -10.087 -0.676 -5.330) 11.429 ======================= Grid point 3 (4/306) ======================= q-point: ( 0.30 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 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.816 ( 5.622 -6.930 3.836) 9.713 0.877 ( 6.955 -8.450 2.668) 11.265 1.208 ( -0.356 -3.188 -0.591) 3.262 1.776 ( -6.361 0.426 0.013) 6.375 2.009 ( 5.036 -9.262 10.695) 15.017 2.090 ( 17.131 -8.324 2.818) 19.253 2.459 ( 2.853 1.114 -1.844) 3.576 2.569 ( -0.114 1.363 2.646) 2.979 2.740 ( -1.817 0.351 -0.291) 1.874 2.866 ( -1.742 -0.750 -1.109) 2.197 3.067 ( -0.583 -3.362 -6.453) 7.300 3.157 ( -1.964 0.854 0.992) 2.361 3.337 ( -0.876 3.124 0.376) 3.266 3.467 ( -1.017 2.881 -1.560) 3.430 3.944 ( 0.359 1.689 -1.034) 2.012 4.176 ( 5.070 -5.928 -5.462) 9.522 5.207 ( -13.653 16.575 3.042) 21.689 6.155 ( -1.206 2.868 4.723) 5.656 8.317 ( -0.200 0.936 -12.435) 12.471 8.801 ( 8.709 -8.125 6.267) 13.458 10.139 ( -1.831 -3.382 19.248) 19.628 11.019 ( -3.109 -6.592 -18.336) 19.731 14.215 ( 0.951 -0.699 -3.950) 4.123 14.794 ( 7.392 -13.895 -6.342) 16.968 15.471 ( -3.540 3.832 -0.641) 5.256 15.660 ( 3.034 7.525 4.317) 9.191 16.947 ( 6.744 -4.812 0.634) 8.309 17.324 ( -0.009 -2.192 5.086) 5.538 18.083 ( 4.881 4.188 2.946) 7.074 18.239 ( -11.169 4.229 -4.785) 12.866 ======================= Grid point 4 (5/306) ======================= q-point: ( 0.40 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 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 552 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.978 ( 4.710 -4.184 1.206) 6.414 1.047 ( 2.590 -4.393 2.211) 5.558 1.196 ( -1.613 -0.878 -1.931) 2.665 1.692 ( -4.539 0.392 -0.748) 4.617 2.199 ( 2.143 -5.205 2.367) 6.107 2.375 ( 5.621 -2.673 3.670) 7.226 2.495 ( 3.440 -0.148 -0.241) 3.452 2.578 ( 0.658 0.043 4.718) 4.764 2.763 ( 1.338 -2.998 0.503) 3.321 2.856 ( 0.359 -0.975 -0.490) 1.149 3.006 ( -0.721 -0.063 -7.228) 7.264 3.158 ( 0.433 -0.921 0.861) 1.333 3.291 ( -1.886 2.128 1.507) 3.219 3.399 ( -1.120 3.097 -1.726) 3.718 3.916 ( 0.470 1.679 -0.854) 1.942 4.288 ( 6.909 -9.732 -4.880) 12.894 4.863 ( -13.392 16.454 3.445) 21.493 6.157 ( -0.423 1.252 2.007) 2.404 8.182 ( -0.019 0.438 -8.858) 8.868 9.077 ( 6.959 -5.187 7.842) 11.698 10.361 ( -3.185 -4.304 18.494) 19.254 10.824 ( -0.859 0.053 -19.487) 19.506 14.190 ( 0.275 -0.327 -2.724) 2.757 15.008 ( 8.229 -15.536 -6.667) 18.802 15.367 ( -4.637 7.799 3.350) 9.672 15.626 ( 0.619 6.388 2.013) 6.726 17.100 ( 6.194 -3.666 1.012) 7.268 17.429 ( 2.830 -5.716 2.943) 7.025 17.977 ( -10.747 7.564 -3.799) 13.680 18.118 ( 2.288 1.594 1.457) 3.146 ======================= Grid point 5 (6/306) ======================= q-point: (-0.50 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 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 276 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.050 ( -0.000 -0.000 0.000) 0.000 1.089 ( 0.000 -0.000 0.000) 0.000 1.181 ( 0.000 -0.000 0.000) 0.000 1.654 ( 0.000 -0.000 0.000) 0.000 2.251 ( -0.000 -0.000 0.000) 0.000 2.432 ( 0.000 -0.000 0.000) 0.000 2.509 ( 0.000 -0.000 0.000) 0.000 2.635 ( 0.000 -0.000 0.000) 0.000 2.835 ( 0.000 -0.000 0.000) 0.000 2.853 ( 0.000 0.000 0.000) 0.000 2.932 ( -0.000 0.000 0.000) 0.000 3.181 ( 0.000 -0.000 0.000) 0.000 3.287 ( 0.000 -0.000 0.000) 0.000 3.344 ( 0.000 -0.000 0.000) 0.000 3.903 ( 0.000 -0.000 0.000) 0.000 4.430 ( 0.000 -0.000 0.000) 0.000 4.627 ( 0.000 0.000 0.000) 0.000 6.157 ( 0.000 -0.000 0.000) 0.000 8.129 ( 0.000 -0.000 0.000) 0.000 9.207 ( 0.000 -0.000 0.000) 0.000 10.557 ( -0.000 -0.000 0.000) 0.000 10.616 ( 0.000 0.000 -0.000) 0.000 14.178 ( 0.000 -0.000 0.000) 0.000 15.191 ( 0.000 -0.000 0.000) 0.000 15.242 ( 0.000 0.000 0.000) 0.000 15.595 ( 0.000 -0.000 0.000) 0.000 17.170 ( 0.000 -0.000 0.000) 0.000 17.558 ( 0.000 -0.000 0.000) 0.000 17.781 ( 0.000 -0.000 0.000) 0.000 18.131 ( 0.000 -0.000 0.000) 0.000 ======================= Grid point 12 (7/306) ======================= q-point: ( 0.10 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 305 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.459 ( 8.654 -0.000 9.641) 12.955 0.470 ( 11.033 -0.000 8.688) 14.044 0.987 ( 10.513 -0.000 4.590) 11.472 1.353 ( 28.701 -0.000 19.674) 34.797 1.806 ( 1.745 -0.000 -3.416) 3.836 1.861 ( -6.581 0.000 -2.410) 7.008 2.509 ( 1.091 -0.000 0.248) 1.119 2.534 ( -1.278 0.000 2.915) 3.183 2.831 ( -2.681 0.000 -2.660) 3.777 2.900 ( 0.569 -0.000 0.771) 0.958 3.043 ( -4.523 0.000 -3.394) 5.655 3.203 ( -2.837 0.000 -1.464) 3.193 3.419 ( 0.696 -0.000 -0.720) 1.001 3.534 ( -0.153 0.000 -0.492) 0.515 3.978 ( -0.174 0.000 -0.326) 0.369 4.082 ( 3.767 -0.000 -4.565) 5.919 5.710 ( -6.706 0.000 2.158) 7.045 6.260 ( -18.199 0.000 13.626) 22.735 8.389 ( 3.262 -0.000 13.963) 14.339 8.555 ( 5.001 -0.000 -26.148) 26.622 9.890 ( 3.672 -0.000 13.654) 14.139 10.773 ( 5.393 -0.000 -7.481) 9.222 14.204 ( 4.849 -0.000 -2.306) 5.369 14.521 ( 2.302 -0.000 -7.043) 7.410 15.620 ( -0.240 0.000 -3.526) 3.534 15.682 ( 6.576 -0.000 2.953) 7.209 16.845 ( 1.941 -0.000 1.235) 2.301 17.280 ( -8.505 0.000 10.292) 13.352 18.265 ( -5.502 0.000 -2.270) 5.952 18.306 ( 2.131 -0.000 -1.052) 2.376 ======================= Grid point 13 (8/306) ======================= q-point: ( 0.20 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.681 ( 7.590 -3.364 7.331) 11.076 0.722 ( 11.117 -3.356 6.811) 13.462 1.172 ( 8.898 -0.110 3.868) 9.703 1.755 ( -6.915 -1.852 -2.286) 7.515 1.826 ( 4.134 -4.114 0.609) 5.864 1.906 ( 20.986 -4.916 12.414) 24.874 2.508 ( 2.038 2.233 -0.869) 3.146 2.571 ( 1.715 -0.998 2.006) 2.822 2.770 ( -2.881 0.809 -1.349) 3.283 2.874 ( -2.945 2.431 -1.264) 4.022 2.970 ( -2.988 -4.317 -3.843) 6.506 3.166 ( -2.220 0.069 0.298) 2.241 3.395 ( -1.130 1.318 -0.953) 1.981 3.512 ( -1.196 0.803 -1.456) 2.048 3.975 ( 0.604 0.617 0.032) 0.864 4.085 ( 4.678 -1.620 -6.347) 8.049 5.572 ( -10.298 10.433 3.488) 15.069 6.171 ( -12.299 -1.011 5.945) 13.698 8.341 ( 6.167 0.771 -22.622) 23.460 8.654 ( 6.349 -3.426 17.295) 18.740 10.079 ( -0.954 -1.146 16.407) 16.475 10.798 ( 4.235 -8.020 -13.067) 15.907 14.234 ( 5.336 1.726 -3.284) 6.499 14.520 ( 5.096 -7.250 -8.010) 11.945 15.561 ( 0.421 3.243 -2.790) 4.299 15.800 ( 6.643 2.239 4.056) 8.099 16.891 ( 4.253 0.140 1.679) 4.574 17.291 ( -4.330 -0.684 6.149) 7.551 18.147 ( -4.620 1.198 -1.695) 5.064 18.304 ( -3.190 1.031 -1.419) 3.641 ======================= Grid point 14 (9/306) ======================= q-point: ( 0.30 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.878 ( 6.320 -3.645 4.566) 8.607 0.958 ( 10.139 -2.264 5.231) 11.631 1.255 ( 5.380 5.164 1.458) 7.599 1.670 ( -5.479 -2.122 -2.494) 6.383 1.999 ( 5.727 -9.814 3.374) 11.853 2.277 ( 8.606 -4.308 7.316) 12.089 2.512 ( 5.841 1.413 -1.745) 6.258 2.612 ( -0.201 2.210 1.277) 2.561 2.716 ( -1.319 -0.737 -0.478) 1.584 2.815 ( -1.568 -2.268 -1.360) 3.075 2.956 ( -0.662 -2.520 -3.667) 4.498 3.151 ( -1.751 -0.108 1.439) 2.269 3.342 ( -2.753 1.555 -0.847) 3.273 3.458 ( -1.760 1.569 -1.997) 3.090 3.975 ( 1.989 2.319 -0.184) 3.061 4.110 ( 5.426 -4.380 -5.998) 9.198 5.293 ( -12.920 16.764 4.159) 21.570 6.117 ( -8.888 -4.277 1.844) 10.034 8.194 ( 7.130 0.415 -17.521) 18.921 8.986 ( 7.357 -2.319 18.901) 20.414 10.256 ( -3.562 -3.496 16.087) 16.844 10.756 ( 3.350 -4.534 -17.139) 18.043 14.223 ( 4.588 3.124 -3.465) 6.543 14.652 ( 8.290 -12.678 -6.742) 16.580 15.502 ( 0.793 4.573 -0.402) 4.658 15.844 ( 2.727 7.849 3.583) 9.049 17.005 ( 7.909 -3.031 2.139) 8.736 17.325 ( -1.878 -2.748 3.439) 4.786 18.042 ( -8.990 -0.879 -3.417) 9.658 18.214 ( -2.333 4.674 -0.341) 5.235 ======================= Grid point 15 (10/306) ======================= q-point: ( 0.40 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.017 ( 3.744 -2.216 2.258) 4.902 1.125 ( 8.089 2.175 3.297) 9.001 1.256 ( 4.396 6.162 2.646) 8.019 1.630 ( -0.658 -1.801 -1.734) 2.586 2.207 ( 3.157 -4.776 4.394) 7.217 2.397 ( 1.251 -2.432 0.343) 2.756 2.510 ( -1.740 1.322 -2.432) 3.270 2.635 ( 1.383 -1.539 3.956) 4.464 2.729 ( 1.449 -4.155 -2.199) 4.919 2.849 ( 0.834 -1.415 0.275) 1.665 2.932 ( 0.614 -0.765 -3.653) 3.783 3.157 ( -0.435 -0.924 0.604) 1.187 3.288 ( -3.118 0.337 0.968) 3.282 3.387 ( -2.185 2.040 -2.437) 3.856 3.954 ( 1.969 3.401 -1.370) 4.162 4.219 ( 8.220 -7.938 -3.254) 11.882 4.963 ( -12.217 17.580 4.262) 21.828 6.086 ( -7.509 -5.721 -0.478) 9.452 8.132 ( 7.565 0.255 -9.219) 11.928 9.240 ( 2.747 2.444 12.848) 13.364 10.446 ( -3.497 -6.257 15.687) 17.247 10.635 ( 4.550 -0.388 -17.521) 18.107 14.213 ( 4.522 2.972 -1.362) 5.580 14.864 ( 9.145 -14.030 -5.464) 17.616 15.457 ( -0.048 6.454 3.162) 7.187 15.756 ( -1.112 10.708 0.916) 10.804 17.156 ( 4.752 -1.276 1.841) 5.254 17.419 ( 4.334 -7.097 2.322) 8.633 17.866 ( -9.956 3.071 -3.316) 10.934 18.140 ( -2.968 1.098 -0.978) 3.313 ======================= Grid point 16 (11/306) ======================= q-point: (-0.50 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.060 ( -0.613 1.677 1.017) 2.055 1.163 ( 3.538 5.538 0.130) 6.573 1.295 ( 6.131 6.443 5.239) 10.322 1.662 ( 4.491 -1.549 -0.894) 4.834 2.273 ( 0.065 1.556 2.040) 2.567 2.386 ( -4.126 -0.905 -3.204) 5.302 2.496 ( 1.326 -2.020 -1.893) 3.070 2.604 ( -3.110 2.533 -3.006) 5.012 2.842 ( -0.866 2.248 0.698) 2.508 2.849 ( 1.553 -3.473 0.932) 3.917 2.929 ( 0.319 -3.601 2.147) 4.204 3.164 ( -1.257 -1.373 -0.093) 1.864 3.275 ( -1.114 0.200 -0.557) 1.262 3.331 ( -0.439 -1.164 -0.388) 1.303 3.924 ( 1.079 2.274 -0.674) 2.606 4.405 ( 6.347 -6.787 -1.505) 9.413 4.703 ( -3.897 10.262 3.586) 11.548 6.058 ( -6.970 -6.648 -2.230) 9.886 8.175 ( 7.595 -0.156 -0.381) 7.606 9.242 ( -5.367 7.998 3.123) 10.126 10.436 ( 1.238 1.253 -16.633) 16.726 10.748 ( 4.155 -5.440 17.009) 18.334 14.232 ( 4.275 3.068 1.490) 5.468 15.088 ( 8.114 -13.027 -4.218) 15.916 15.374 ( -4.805 12.722 6.435) 15.045 15.628 ( 0.540 5.855 -1.979) 6.204 17.169 ( -2.237 2.123 0.305) 3.100 17.559 ( -1.341 2.252 -1.256) 2.907 17.761 ( 3.379 -7.011 0.542) 7.802 18.085 ( -4.088 -1.567 -1.423) 4.604 ======================= Grid point 17 (12/306) ======================= q-point: (-0.40 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.988 ( -3.102 6.262 -0.553) 7.010 1.088 ( -2.083 7.974 -0.569) 8.261 1.338 ( 5.665 7.194 3.953) 9.974 1.746 ( 7.164 -1.339 -1.188) 7.384 2.206 ( -1.144 5.491 -12.080) 13.318 2.249 ( -12.051 3.916 3.354) 13.108 2.477 ( -2.999 2.665 0.320) 4.024 2.526 ( 1.147 -1.576 -3.761) 4.236 2.778 ( -1.102 3.363 -0.664) 3.600 2.875 ( 0.821 -0.272 1.251) 1.521 3.058 ( -0.313 -5.241 5.330) 7.482 3.155 ( -1.646 0.327 0.796) 1.857 3.276 ( 3.241 -0.829 -0.979) 3.486 3.377 ( 0.097 -4.119 1.096) 4.263 3.918 ( 0.506 0.231 0.756) 0.938 4.357 ( -6.604 7.499 2.467) 10.292 4.841 ( 14.031 -11.163 -0.212) 17.932 6.026 ( -6.794 -7.505 -3.966) 10.872 8.300 ( 7.092 -0.434 4.497) 8.409 9.040 ( -9.056 11.012 1.506) 14.336 10.223 ( 0.639 3.035 -19.230) 19.478 11.065 ( 6.204 -2.613 18.236) 19.439 14.269 ( 3.413 3.534 3.455) 6.006 15.164 ( -7.752 14.546 3.905) 16.939 15.288 ( 5.514 -9.653 -2.010) 11.297 15.594 ( 2.987 2.413 -0.335) 3.854 17.080 ( -5.162 5.083 0.573) 7.267 17.407 ( -4.742 4.541 -4.804) 8.136 17.930 ( -1.606 -8.140 -3.625) 9.054 18.116 ( 5.992 -5.356 4.161) 9.050 ======================= Grid point 18 (13/306) ======================= q-point: (-0.30 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.826 ( -4.300 9.594 -2.482) 10.802 0.906 ( -6.447 10.858 -1.274) 12.692 1.325 ( 2.837 9.210 1.470) 9.749 1.777 ( -4.654 8.725 -11.269) 14.993 1.879 ( -1.019 3.924 -6.535) 7.691 2.087 ( -8.317 7.858 2.942) 11.814 2.445 ( -1.690 -0.177 1.911) 2.557 2.524 ( 0.421 -1.347 -2.938) 3.259 2.766 ( 2.427 -0.241 0.536) 2.497 2.901 ( 1.187 0.064 0.442) 1.268 3.143 ( 0.779 0.137 -0.831) 1.147 3.154 ( -1.950 -3.408 5.341) 6.629 3.324 ( 2.780 0.130 0.523) 2.831 3.446 ( 0.461 -4.427 1.179) 4.605 3.942 ( 0.357 -0.865 1.391) 1.677 4.227 ( -5.474 5.209 2.450) 7.944 5.180 ( 14.580 -13.304 0.161) 19.738 5.983 ( -6.897 -8.303 -6.238) 12.467 8.399 ( 3.968 0.974 -2.424) 4.751 8.874 ( -6.367 10.712 14.772) 19.326 9.962 ( -0.800 2.851 -21.057) 21.264 11.352 ( 8.089 1.529 16.856) 18.759 14.294 ( 1.746 4.267 3.484) 5.779 14.933 ( -6.511 13.533 3.354) 15.387 15.421 ( 0.897 -9.081 -3.353) 9.721 15.622 ( 5.856 3.833 2.695) 7.500 16.942 ( -6.019 6.879 0.854) 9.180 17.252 ( -3.762 1.009 -7.620) 8.558 17.895 ( -6.649 -5.357 -4.099) 9.471 18.362 ( 9.296 -6.840 4.766) 12.487 ======================= Grid point 19 (14/306) ======================= q-point: (-0.20 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.593 ( -6.764 11.417 -3.952) 13.847 0.651 ( -6.560 13.168 -1.926) 14.837 1.199 ( -3.047 13.533 0.473) 13.879 1.265 ( -8.789 22.614 -13.715) 27.870 1.891 ( 3.561 1.692 -2.645) 4.748 1.965 ( -4.792 1.923 2.872) 5.909 2.462 ( -0.489 -1.079 1.632) 2.017 2.506 ( -0.188 -0.665 -2.327) 2.427 2.829 ( 2.186 -1.806 1.950) 3.441 2.910 ( 1.006 -0.074 -1.109) 1.500 3.140 ( 0.410 1.152 0.288) 1.257 3.230 ( -0.138 -3.674 2.695) 4.559 3.338 ( 0.715 1.503 -0.050) 1.666 3.516 ( 0.429 -3.791 0.896) 3.919 3.969 ( 0.243 -0.728 0.833) 1.132 4.150 ( -3.063 2.287 1.694) 4.181 5.508 ( 11.900 -10.408 2.315) 15.978 5.915 ( -7.521 -8.617 -9.461) 14.843 8.323 ( -0.357 3.758 -5.678) 6.818 8.939 ( -0.955 8.352 20.991) 22.612 9.695 ( -1.642 0.801 -18.777) 18.866 11.614 ( 10.849 2.914 15.351) 19.022 14.275 ( -0.207 4.975 1.720) 5.268 14.762 ( -2.903 9.888 2.484) 10.601 15.465 ( -2.122 -6.822 -3.597) 7.999 15.697 ( 7.393 4.907 4.243) 9.835 16.778 ( -6.902 5.812 -2.356) 9.326 17.124 ( -2.848 -0.792 -7.507) 8.068 17.836 ( -5.742 -3.976 -2.528) 7.427 18.588 ( 6.721 -5.623 3.758) 9.535 ======================= Grid point 20 (15/306) ======================= q-point: (-0.10 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 305 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.334 ( 0.000 13.057 0.000) 13.057 0.413 ( 0.000 15.858 0.000) 15.858 0.763 ( 0.000 29.769 0.000) 29.769 1.019 ( 0.000 13.584 0.000) 13.584 1.860 ( 0.000 2.627 0.000) 2.627 1.961 ( -0.000 -1.458 -0.000) 1.458 2.483 ( -0.000 -0.560 -0.000) 0.560 2.498 ( -0.000 -0.842 -0.000) 0.842 2.882 ( -0.000 -1.598 -0.000) 1.598 2.909 ( -0.000 -0.395 -0.000) 0.395 3.127 ( 0.000 1.552 0.000) 1.552 3.291 ( -0.000 -3.031 -0.000) 3.031 3.314 ( 0.000 1.701 0.000) 1.701 3.565 ( -0.000 -2.607 -0.000) 2.607 3.982 ( -0.000 -0.464 -0.000) 0.464 4.127 ( 0.000 0.607 0.000) 0.607 5.786 ( -0.000 -6.846 -0.000) 6.846 5.799 ( -0.000 -5.328 -0.000) 5.328 8.240 ( 0.000 3.221 0.000) 3.221 8.975 ( 0.000 7.214 0.000) 7.214 9.564 ( -0.000 -0.893 -0.000) 0.893 11.838 ( -0.000 -3.011 -0.000) 3.011 14.220 ( 0.000 4.192 0.000) 4.192 14.661 ( 0.000 6.518 0.000) 6.518 15.494 ( -0.000 -4.860 -0.000) 4.860 15.728 ( 0.000 4.170 0.000) 4.170 16.606 ( 0.000 6.215 0.000) 6.215 17.059 ( -0.000 -0.032 -0.000) 0.032 17.812 ( -0.000 -1.782 -0.000) 1.782 18.730 ( -0.000 -4.959 -0.000) 4.959 ======================= Grid point 23 (16/306) ======================= q-point: ( 0.20 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.827 ( 6.450 -0.000 6.366) 9.062 0.933 ( 13.632 -0.000 6.239) 14.992 1.367 ( 10.869 -0.000 5.322) 12.102 1.615 ( -6.153 0.000 -3.647) 7.153 1.843 ( 5.326 -0.000 1.165) 5.452 2.215 ( 10.416 -0.000 8.343) 13.346 2.542 ( 2.973 -0.000 -1.915) 3.536 2.632 ( 6.880 -0.000 1.317) 7.005 2.741 ( -2.199 0.000 0.875) 2.367 2.759 ( -8.499 0.000 -6.124) 10.476 2.919 ( 0.071 -0.000 0.247) 0.257 3.149 ( -1.994 0.000 1.276) 2.367 3.361 ( -2.910 0.000 -1.427) 3.241 3.477 ( -2.032 0.000 -2.355) 3.111 4.007 ( 2.654 -0.000 1.714) 3.160 4.060 ( 4.895 -0.000 -7.332) 8.816 5.556 ( -10.736 0.000 3.874) 11.413 6.019 ( -14.983 0.000 1.930) 15.107 8.200 ( 10.123 -0.000 -21.131) 23.430 8.958 ( 7.268 -0.000 24.024) 25.100 10.212 ( -3.329 0.000 13.929) 14.322 10.681 ( 6.442 -0.000 -14.554) 15.916 14.313 ( 8.206 -0.000 -2.050) 8.459 14.440 ( 6.265 -0.000 -8.453) 10.522 15.572 ( 2.092 -0.000 -1.783) 2.748 15.938 ( 5.784 -0.000 3.133) 6.578 16.975 ( 6.204 -0.000 2.320) 6.624 17.289 ( -3.744 0.000 4.275) 5.682 18.021 ( -8.600 0.000 -2.836) 9.055 18.276 ( -3.554 0.000 -1.418) 3.826 ======================= Grid point 24 (17/306) ======================= q-point: ( 0.30 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.967 ( 4.749 -1.328 4.444) 6.638 1.171 ( 14.214 1.118 4.983) 15.104 1.453 ( 4.380 8.145 2.579) 9.601 1.580 ( 2.193 -2.211 -0.403) 3.140 2.018 ( 7.327 -7.750 6.107) 12.290 2.347 ( 1.087 -1.441 2.881) 3.400 2.554 ( -0.476 1.194 -4.347) 4.533 2.579 ( -3.001 -0.925 -3.620) 4.792 2.706 ( 1.682 1.276 -0.315) 2.134 2.776 ( 2.786 -3.767 0.018) 4.686 2.923 ( -0.110 -0.025 0.135) 0.176 3.144 ( -1.577 -0.240 1.366) 2.100 3.302 ( -3.908 0.545 -0.590) 3.990 3.416 ( -2.466 0.357 -2.989) 3.891 4.026 ( 3.838 1.715 -5.114) 6.620 4.101 ( 6.452 -2.000 1.246) 6.869 5.366 ( -12.711 12.905 3.831) 18.514 5.897 ( -13.483 -8.156 -0.943) 15.786 8.139 ( 12.152 0.178 -14.775) 19.131 9.302 ( 5.309 1.789 22.525) 23.211 10.314 ( -5.257 -3.398 11.734) 13.299 10.606 ( 7.289 -1.167 -15.895) 17.525 14.330 ( 8.031 6.625 -2.361) 10.676 14.553 ( 9.427 -10.792 -4.678) 15.074 15.580 ( 3.401 3.112 0.672) 4.659 15.973 ( 0.406 5.063 0.729) 5.131 17.114 ( 9.360 -1.455 3.330) 10.040 17.300 ( -1.818 -2.248 2.373) 3.740 17.888 ( -8.863 -0.325 -2.276) 9.156 18.178 ( -6.415 1.260 -2.842) 7.129 ======================= Grid point 25 (18/306) ======================= q-point: ( 0.40 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 552 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.065 ( 2.545 -0.641 2.580) 3.680 1.292 ( 4.510 3.612 -0.303) 5.786 1.482 ( 8.596 8.019 7.197) 13.784 1.649 ( 8.060 1.212 0.236) 8.154 2.259 ( 3.734 -3.986 7.171) 9.015 2.363 ( -3.006 -0.645 -3.147) 4.400 2.421 ( -3.725 -2.701 -2.760) 5.366 2.661 ( 1.627 -2.638 2.364) 3.898 2.678 ( 3.367 -1.649 -4.626) 5.954 2.838 ( 0.456 -2.772 -0.092) 2.810 2.919 ( -0.035 1.008 0.162) 1.022 3.134 ( -1.475 -0.562 -0.659) 1.710 3.254 ( -3.655 -0.614 1.140) 3.877 3.347 ( -1.864 0.735 -2.820) 3.460 3.989 ( 2.700 1.991 -4.387) 5.523 4.252 ( 9.135 -3.229 1.934) 9.880 5.061 ( -12.068 15.563 3.009) 19.923 5.840 ( -12.174 -10.639 -2.374) 16.341 8.174 ( 12.859 0.074 -6.894) 14.590 9.451 ( -2.746 8.222 11.335) 14.270 10.396 ( -4.744 -4.525 -1.627) 6.755 10.619 ( 10.410 -3.556 1.250) 11.072 14.341 ( 8.106 5.789 0.037) 9.961 14.777 ( 9.882 -11.707 -2.724) 15.560 15.595 ( 3.396 5.835 3.917) 7.805 15.847 ( -3.792 9.142 -2.240) 10.147 17.216 ( 0.885 1.864 1.510) 2.557 17.433 ( 9.100 -8.025 2.599) 12.408 17.748 ( -8.756 1.852 -2.035) 9.179 18.048 ( -7.788 -1.102 -3.298) 8.529 ======================= Grid point 26 (19/306) ======================= q-point: (-0.50 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.093 ( -0.138 2.193 1.220) 2.513 1.254 ( -0.097 4.881 -1.071) 4.998 1.533 ( 4.570 8.023 4.320) 10.194 1.757 ( 11.696 3.130 0.773) 12.132 2.248 ( -5.883 -0.897 -6.019) 8.464 2.326 ( -1.655 2.468 4.104) 5.067 2.464 ( 3.538 -2.974 -2.588) 5.298 2.582 ( -2.626 4.255 -2.445) 5.566 2.826 ( 2.375 -4.659 -0.362) 5.241 2.879 ( -1.000 -2.430 3.545) 4.413 2.891 ( -1.543 0.000 1.040) 1.860 3.124 ( -0.919 -1.839 -0.684) 2.167 3.256 ( -0.669 -2.549 1.039) 2.833 3.313 ( 1.178 -0.005 -0.856) 1.456 3.956 ( 1.829 2.117 -1.686) 3.267 4.413 ( 5.168 -2.647 0.251) 5.812 4.815 ( -3.566 8.943 2.636) 9.982 5.794 ( -11.755 -11.064 -3.457) 16.508 8.295 ( 12.266 -0.062 -0.591) 12.280 9.326 ( -7.951 11.632 4.330) 14.740 10.273 ( -2.257 0.895 -13.765) 13.978 10.929 ( 9.186 -7.318 14.490) 18.652 14.383 ( 7.353 5.611 2.414) 9.559 15.006 ( 7.876 -10.766 -1.817) 13.463 15.537 ( -6.078 12.899 3.850) 14.770 15.703 ( 4.596 5.476 -1.157) 7.242 17.183 ( -1.824 3.359 0.681) 3.882 17.532 ( -6.924 4.968 -3.451) 9.194 17.708 ( 4.836 -8.926 -1.204) 10.223 17.983 ( -3.527 -5.399 0.655) 6.482 ======================= Grid point 27 (20/306) ======================= q-point: (-0.40 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 552 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.031 ( -2.283 6.467 -0.079) 6.858 1.132 ( -4.649 7.469 -2.366) 9.110 1.519 ( 2.080 5.425 1.735) 6.064 1.856 ( 11.065 4.188 -0.775) 11.857 2.078 ( -5.647 6.253 -7.600) 11.347 2.272 ( -5.098 6.358 2.169) 8.433 2.472 ( -2.639 1.240 -1.286) 3.187 2.495 ( 1.715 0.472 -1.799) 2.530 2.802 ( 0.502 2.596 -1.330) 2.960 2.890 ( -0.119 -0.491 1.299) 1.394 2.994 ( -2.301 -7.884 2.890) 8.706 3.132 ( -1.111 -1.715 0.126) 2.047 3.321 ( 0.573 -4.640 0.910) 4.763 3.358 ( 5.006 0.731 2.121) 5.485 3.951 ( 1.615 1.740 0.992) 2.573 4.361 ( -6.508 5.121 -0.401) 8.291 4.912 ( 12.592 -7.121 2.097) 14.617 5.742 ( -11.756 -11.168 -4.484) 16.824 8.427 ( 9.009 1.206 -0.789) 9.123 9.153 ( -6.548 11.350 10.489) 16.785 10.037 ( -2.792 3.261 -18.431) 18.925 11.279 ( 7.684 -6.256 13.641) 16.860 14.425 ( 5.497 6.153 3.302) 8.887 15.173 ( 2.561 -6.036 -1.480) 6.722 15.300 ( -6.494 10.758 0.030) 12.566 15.749 ( 8.935 5.795 4.062) 11.398 17.110 ( -3.288 5.915 1.911) 7.032 17.306 ( -8.507 3.639 -7.644) 12.002 17.762 ( -3.465 -5.414 -3.832) 7.484 18.150 ( 6.243 -9.835 4.286) 12.412 ======================= Grid point 28 (21/306) ======================= q-point: (-0.30 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.863 ( -5.987 10.384 -2.811) 12.311 0.936 ( -3.829 9.555 -1.712) 10.435 1.483 ( 1.175 7.093 1.008) 7.260 1.775 ( -3.384 17.409 -7.164) 19.127 1.923 ( 7.681 3.631 -1.459) 8.621 2.104 ( -8.235 7.979 1.272) 11.537 2.446 ( -1.502 -0.413 1.669) 2.283 2.489 ( 0.920 -0.216 -2.413) 2.591 2.805 ( 3.033 0.094 0.295) 3.048 2.897 ( -1.137 -0.961 -0.311) 1.521 3.088 ( -0.784 -7.043 1.294) 7.203 3.142 ( -0.822 -1.211 0.561) 1.568 3.394 ( 0.619 -4.743 0.474) 4.807 3.416 ( 2.695 2.719 2.072) 4.353 3.967 ( 1.166 1.218 1.537) 2.282 4.223 ( -4.856 3.473 -0.436) 5.987 5.234 ( 14.548 -11.068 2.958) 18.517 5.676 ( -12.035 -10.873 -5.453) 17.111 8.430 ( 2.493 4.639 -4.040) 6.637 9.167 ( -0.395 9.158 21.302) 23.191 9.735 ( -3.083 2.937 -21.735) 22.148 11.561 ( 5.426 -5.596 9.080) 11.967 14.427 ( 2.551 7.058 2.195) 7.819 15.040 ( -4.317 11.907 0.407) 12.672 15.295 ( 0.092 -6.527 -1.881) 6.793 15.844 ( 9.132 6.444 4.899) 12.203 16.963 ( -7.847 8.350 -0.372) 11.464 17.125 ( -2.640 0.741 -5.991) 6.589 17.740 ( -3.123 -3.977 -2.071) 5.464 18.388 ( 4.796 -10.040 2.683) 11.446 ======================= Grid point 29 (22/306) ======================= q-point: (-0.20 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.644 ( 0.000 12.123 0.000) 12.123 0.767 ( 0.000 12.544 0.000) 12.544 1.377 ( 0.000 12.619 0.000) 12.619 1.437 ( 0.000 24.378 0.000) 24.378 1.949 ( 0.000 1.922 0.000) 1.922 1.954 ( 0.000 4.866 0.000) 4.866 2.462 ( -0.000 -1.126 -0.000) 1.126 2.479 ( -0.000 -0.324 -0.000) 0.324 2.845 ( -0.000 -1.085 -0.000) 1.085 2.893 ( -0.000 -1.031 -0.000) 1.031 3.149 ( -0.000 -0.182 -0.000) 0.182 3.175 ( -0.000 -6.258 -0.000) 6.258 3.392 ( 0.000 4.433 0.000) 4.433 3.467 ( -0.000 -5.154 -0.000) 5.154 3.974 ( 0.000 0.210 0.000) 0.210 4.159 ( 0.000 1.967 0.000) 1.967 5.561 ( -0.000 -10.743 -0.000) 10.743 5.613 ( -0.000 -9.536 -0.000) 9.536 8.349 ( 0.000 5.405 0.000) 5.405 9.223 ( 0.000 12.461 0.000) 12.461 9.527 ( -0.000 -2.168 -0.000) 2.168 11.728 ( -0.000 -5.856 -0.000) 5.856 14.363 ( 0.000 7.118 0.000) 7.118 14.879 ( 0.000 10.565 0.000) 10.565 15.355 ( -0.000 -5.917 -0.000) 5.917 15.865 ( 0.000 6.480 0.000) 6.480 16.789 ( 0.000 7.929 0.000) 7.929 17.067 ( 0.000 0.914 0.000) 0.914 17.750 ( -0.000 -3.103 -0.000) 3.103 18.555 ( -0.000 -9.059 -0.000) 9.059 ======================= Grid point 34 (23/306) ======================= q-point: ( 0.30 0.30 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 305 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.054 ( 3.324 -0.000 3.379) 4.740 1.328 ( 3.661 -0.000 -1.971) 4.158 1.598 ( 12.154 -0.000 7.463) 14.263 1.703 ( 7.524 -0.000 2.590) 7.957 2.152 ( 8.854 -0.000 9.010) 12.632 2.353 ( -1.854 0.000 -0.023) 1.854 2.386 ( -8.935 0.000 -5.656) 10.574 2.589 ( 5.337 -0.000 -2.674) 5.970 2.736 ( -0.803 0.000 0.897) 1.204 2.761 ( 3.187 -0.000 -4.086) 5.182 2.935 ( -0.147 0.000 1.986) 1.992 3.129 ( -1.958 0.000 -0.067) 1.959 3.252 ( -4.510 0.000 0.461) 4.533 3.352 ( -1.816 0.000 -3.353) 3.813 4.009 ( 3.929 -0.000 -6.841) 7.889 4.226 ( 7.924 -0.000 4.764) 9.246 5.342 ( -13.488 0.000 3.548) 13.947 5.622 ( -14.390 0.000 -3.639) 14.842 8.176 ( 14.688 -0.000 -9.209) 17.336 9.575 ( -0.770 0.000 15.085) 15.105 10.308 ( -7.516 0.000 7.092) 10.334 10.581 ( 12.660 -0.000 -8.381) 15.183 14.509 ( 10.212 -0.000 -3.844) 10.912 14.534 ( 10.014 -0.000 1.241) 10.091 15.671 ( 5.023 -0.000 2.777) 5.740 15.972 ( -4.015 0.000 -2.855) 4.927 17.278 ( -1.626 0.000 0.747) 1.789 17.284 ( 11.898 -0.000 4.294) 12.649 17.769 ( -7.611 0.000 -0.673) 7.641 18.036 ( -10.223 0.000 -4.845) 11.313 ======================= Grid point 35 (24/306) ======================= q-point: ( 0.40 0.30 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.116 ( 1.792 0.171 2.075) 2.747 1.311 ( 0.273 0.475 -2.603) 2.661 1.725 ( 1.790 6.480 0.406) 6.735 1.862 ( 14.411 3.053 7.210) 16.400 2.219 ( -5.278 -0.731 -4.856) 7.209 2.346 ( -2.134 -0.611 3.443) 4.097 2.382 ( 6.480 -3.173 3.790) 8.150 2.662 ( 6.529 -3.864 -1.923) 7.827 2.683 ( -0.838 3.667 -1.570) 4.076 2.785 ( 0.005 -4.069 -1.801) 4.450 2.955 ( -0.195 1.496 3.045) 3.398 3.097 ( -1.991 -0.377 -1.160) 2.335 3.208 ( -4.015 -0.906 0.908) 4.215 3.315 ( 1.257 -0.131 -2.038) 2.398 3.988 ( 3.704 0.394 -4.731) 6.021 4.375 ( 7.807 -0.194 3.542) 8.576 5.100 ( -13.130 11.804 1.358) 17.708 5.502 ( -13.373 -11.566 -3.543) 18.032 8.295 ( 14.936 0.026 -3.187) 15.272 9.566 ( -6.545 6.299 1.752) 9.251 10.270 ( -7.361 -0.719 -0.241) 7.400 10.769 ( 14.230 -4.238 6.178) 16.082 14.542 ( 9.858 7.091 0.670) 12.162 14.760 ( 9.757 -8.900 0.473) 13.215 15.758 ( 3.708 4.280 5.001) 7.555 15.829 ( -4.820 3.766 -4.820) 7.787 17.250 ( -0.222 1.913 -0.724) 2.057 17.508 ( 10.813 -4.680 2.312) 12.007 17.662 ( -7.599 3.462 -0.356) 8.358 17.860 ( -10.608 -3.954 -3.690) 11.908 ======================= Grid point 36 (25/306) ======================= q-point: (-0.50 0.30 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.132 ( 0.113 2.054 0.957) 2.269 1.263 ( -1.749 2.907 -2.256) 4.074 1.612 ( -3.949 3.271 -3.801) 6.383 2.018 ( 11.648 7.466 3.742) 14.332 2.160 ( -0.077 1.394 -1.294) 1.904 2.353 ( -2.920 -0.491 3.272) 4.413 2.478 ( 4.887 1.245 -2.367) 5.571 2.583 ( -2.298 4.643 -1.588) 5.418 2.788 ( 2.414 -5.378 -0.338) 5.905 2.812 ( -2.027 -4.329 0.489) 4.805 2.940 ( -1.428 3.636 2.276) 4.521 3.080 ( -1.142 -1.989 -0.870) 2.453 3.211 ( -1.558 -3.665 0.760) 4.055 3.362 ( 6.412 -0.479 1.086) 6.521 3.998 ( 4.699 1.286 -0.725) 4.926 4.458 ( 0.827 2.828 0.462) 2.982 4.880 ( -2.967 4.277 1.300) 5.365 5.447 ( -13.324 -12.306 -3.707) 18.512 8.452 ( 12.443 0.745 0.026) 12.465 9.396 ( -6.342 7.533 1.592) 9.975 10.124 ( -5.838 3.603 -8.056) 10.581 11.097 ( 9.847 -7.365 10.293) 16.036 14.588 ( 8.086 6.856 2.358) 10.861 14.978 ( 6.979 -7.854 0.565) 10.522 15.576 ( -8.153 8.945 -3.663) 12.645 15.877 ( 7.928 3.987 5.403) 10.389 17.211 ( 0.626 2.383 -1.781) 3.040 17.440 ( -11.533 6.942 -3.867) 14.006 17.641 ( 0.635 -3.972 -2.756) 4.875 17.900 ( 1.793 -10.105 3.828) 10.954 ======================= Grid point 37 (26/306) ======================= q-point: (-0.40 0.30 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.083 ( -1.652 6.301 -0.400) 6.526 1.123 ( -4.326 6.497 -2.760) 8.279 1.532 ( -1.416 -1.255 -2.151) 2.864 2.071 ( 8.542 7.582 -1.661) 11.542 2.103 ( 0.789 8.328 1.952) 8.590 2.312 ( -4.812 7.278 1.682) 8.886 2.432 ( -0.767 0.254 -2.984) 3.092 2.524 ( 0.531 2.809 0.012) 2.859 2.814 ( 2.679 -0.917 -2.713) 3.921 2.865 ( -4.564 -3.238 2.480) 6.121 2.930 ( 0.368 -2.135 1.384) 2.571 3.093 ( -0.580 -2.610 -0.285) 2.689 3.261 ( -0.418 -5.139 0.315) 5.165 3.462 ( 4.817 0.145 1.679) 5.104 4.046 ( 5.636 4.354 2.609) 7.585 4.323 ( -7.649 5.272 -2.166) 9.539 4.998 ( 11.091 -7.575 2.614) 13.683 5.388 ( -13.484 -12.020 -3.963) 18.493 8.538 ( 5.809 3.840 -1.444) 7.112 9.334 ( -1.259 3.799 10.381) 11.126 9.868 ( -4.628 7.871 -13.172) 16.027 11.383 ( 4.967 -8.099 6.817) 11.694 14.608 ( 4.673 7.391 2.111) 8.996 15.128 ( 2.948 -5.698 0.368) 6.426 15.333 ( -5.633 9.897 -2.521) 11.663 15.987 ( 7.992 4.670 5.197) 10.616 17.151 ( -5.216 2.621 -8.093) 9.978 17.178 ( -4.470 7.662 2.455) 9.203 17.645 ( -1.653 -3.537 -1.751) 4.280 18.116 ( 3.463 -11.508 2.541) 12.284 ======================= Grid point 38 (27/306) ======================= q-point: (-0.30 0.30 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 305 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.926 ( 0.000 10.569 0.000) 10.569 1.016 ( 0.000 7.507 0.000) 7.507 1.528 ( 0.000 0.100 0.000) 0.100 1.933 ( 0.000 15.264 0.000) 15.264 2.092 ( 0.000 6.091 0.000) 6.091 2.126 ( 0.000 11.466 0.000) 11.466 2.429 ( -0.000 -1.507 -0.000) 1.507 2.497 ( 0.000 1.951 0.000) 1.951 2.841 ( 0.000 0.728 0.000) 0.728 2.854 ( -0.000 -2.191 -0.000) 2.191 3.003 ( -0.000 -6.802 -0.000) 6.802 3.118 ( -0.000 -2.159 -0.000) 2.159 3.328 ( -0.000 -5.709 -0.000) 5.709 3.489 ( 0.000 2.285 0.000) 2.285 4.036 ( 0.000 5.987 0.000) 5.987 4.209 ( 0.000 1.649 0.000) 1.649 5.296 ( -0.000 -9.949 -0.000) 9.949 5.339 ( -0.000 -12.448 -0.000) 12.448 8.492 ( 0.000 5.934 0.000) 5.934 9.458 ( -0.000 -3.327 -0.000) 3.327 9.562 ( 0.000 14.468 0.000) 14.468 11.555 ( -0.000 -8.027 -0.000) 8.027 14.554 ( 0.000 8.029 0.000) 8.029 15.151 ( 0.000 10.854 0.000) 10.854 15.216 ( -0.000 -5.306 -0.000) 5.306 16.020 ( 0.000 5.484 0.000) 5.484 16.973 ( 0.000 6.694 0.000) 6.694 17.120 ( 0.000 3.722 0.000) 3.722 17.666 ( -0.000 -3.496 -0.000) 3.496 18.297 ( -0.000 -11.494 -0.000) 11.494 ======================= Grid point 45 (28/306) ======================= q-point: (-0.60 0.40 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.154 ( 0.980 -0.000 1.247) 1.586 1.292 ( 0.456 -0.000 -1.974) 2.026 1.665 ( -8.164 0.000 -7.017) 10.766 2.141 ( 9.692 -0.000 9.577) 13.626 2.173 ( 3.020 -0.000 -1.674) 3.453 2.318 ( -1.822 0.000 0.070) 1.823 2.499 ( 5.036 -0.000 3.077) 5.902 2.693 ( -1.674 0.000 -2.385) 2.914 2.699 ( 3.011 -0.000 1.444) 3.339 2.716 ( 1.810 -0.000 -3.310) 3.772 2.997 ( -0.630 0.000 2.736) 2.807 3.053 ( -2.211 0.000 -1.115) 2.476 3.160 ( -3.348 0.000 0.485) 3.383 3.353 ( 6.498 -0.000 0.332) 6.507 4.010 ( 6.274 -0.000 -1.969) 6.575 4.498 ( 6.037 -0.000 2.626) 6.583 5.014 ( -16.535 0.000 0.239) 16.537 5.219 ( -9.459 0.000 -4.114) 10.315 8.462 ( 13.637 -0.000 0.288) 13.640 9.493 ( -6.089 0.000 -5.073) 7.926 10.181 ( -8.445 0.000 0.953) 8.498 10.989 ( 12.227 -0.000 7.535) 14.362 14.725 ( 8.760 -0.000 -0.139) 8.761 14.829 ( 8.514 -0.000 3.480) 9.198 15.693 ( -7.904 0.000 -6.060) 9.960 15.927 ( 6.382 -0.000 6.616) 9.192 17.239 ( 1.388 -0.000 -4.353) 4.569 17.580 ( 1.630 -0.000 -1.333) 2.106 17.607 ( -13.949 0.000 -4.046) 14.524 17.702 ( 3.296 -0.000 5.551) 6.456 ======================= Grid point 47 (29/306) ======================= q-point: (-0.50 0.40 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.163 ( 0.073 1.205 0.435) 1.283 1.259 ( -1.054 3.382 -1.612) 3.892 1.491 ( -5.827 -1.299 -5.182) 7.905 2.196 ( 3.771 2.160 -0.623) 4.390 2.258 ( 3.077 4.924 2.942) 6.509 2.348 ( 0.264 -2.102 4.228) 4.729 2.534 ( 2.479 4.265 -2.833) 5.689 2.607 ( -1.211 4.013 -0.120) 4.194 2.740 ( -1.712 -4.374 0.724) 4.753 2.756 ( 1.944 -2.728 -1.333) 3.605 2.987 ( -0.879 2.989 1.220) 3.345 3.032 ( -1.117 -1.767 -0.705) 2.206 3.154 ( -1.297 -3.122 0.290) 3.393 3.447 ( 5.259 -0.694 0.690) 5.350 4.111 ( 9.948 0.766 2.022) 10.180 4.512 ( -3.122 8.646 -0.323) 9.198 4.847 ( -5.101 -5.520 0.274) 7.521 5.133 ( -8.358 -6.754 -2.897) 11.129 8.606 ( 8.245 1.514 0.967) 8.439 9.376 ( -3.180 0.413 -2.236) 3.909 10.057 ( -5.478 5.357 -1.863) 7.886 11.209 ( 6.191 -4.685 5.263) 9.380 14.774 ( 5.279 5.401 1.011) 7.620 14.993 ( 5.229 -4.696 2.140) 7.347 15.517 ( -5.928 4.169 -4.302) 8.428 16.062 ( 5.391 1.433 5.519) 7.847 17.190 ( 0.953 0.924 -6.844) 6.972 17.379 ( -9.160 6.846 0.767) 11.461 17.577 ( -1.043 -1.797 -1.043) 2.325 17.858 ( 3.202 -7.912 2.833) 8.993 ======================= Grid point 48 (30/306) ======================= q-point: (-0.40 0.40 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.139 ( 0.000 3.160 0.000) 3.160 1.156 ( 0.000 7.459 0.000) 7.459 1.471 ( -0.000 -3.587 -0.000) 3.587 2.176 ( 0.000 4.968 0.000) 4.968 2.236 ( 0.000 4.921 0.000) 4.921 2.397 ( -0.000 -0.827 -0.000) 0.827 2.410 ( 0.000 10.294 0.000) 10.294 2.567 ( 0.000 3.278 0.000) 3.278 2.782 ( -0.000 -3.695 -0.000) 3.695 2.802 ( -0.000 -4.064 -0.000) 4.064 2.949 ( 0.000 2.749 0.000) 2.749 3.052 ( -0.000 -2.892 -0.000) 2.892 3.199 ( -0.000 -4.636 -0.000) 4.636 3.495 ( -0.000 -0.987 -0.000) 0.987 4.228 ( -0.000 -0.053 -0.000) 0.053 4.280 ( 0.000 12.999 0.000) 12.999 5.007 ( -0.000 -14.384 -0.000) 14.384 5.105 ( -0.000 -5.153 -0.000) 5.153 8.624 ( 0.000 4.287 0.000) 4.287 9.375 ( -0.000 -2.983 -0.000) 2.983 9.895 ( 0.000 11.361 0.000) 11.361 11.354 ( -0.000 -7.433 -0.000) 7.433 14.741 ( 0.000 6.748 0.000) 6.748 15.094 ( -0.000 -4.551 -0.000) 4.551 15.381 ( 0.000 7.141 0.000) 7.141 16.115 ( 0.000 2.201 0.000) 2.201 17.107 ( 0.000 3.909 0.000) 3.909 17.253 ( 0.000 6.669 0.000) 6.669 17.589 ( -0.000 -2.516 -0.000) 2.516 18.012 ( -0.000 -10.862 -0.000) 10.862 ======================= Grid point 58 (31/306) ======================= q-point: ( 0.50 -0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 168 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.172 ( 0.000 0.000 0.000) 0.000 1.277 ( 0.000 0.000 0.000) 0.000 1.399 ( -0.000 -0.000 -0.000) 0.000 2.226 ( 0.000 0.000 0.000) 0.000 2.302 ( 0.000 0.000 0.000) 0.000 2.388 ( 0.000 0.000 0.000) 0.000 2.572 ( -0.000 -0.000 -0.000) 0.000 2.626 ( 0.000 0.000 0.000) 0.000 2.696 ( 0.000 0.000 0.000) 0.000 2.744 ( 0.000 0.000 0.000) 0.000 3.007 ( 0.000 0.000 0.000) 0.000 3.010 ( 0.000 0.000 0.000) 0.000 3.124 ( 0.000 0.000 0.000) 0.000 3.478 ( 0.000 0.000 0.000) 0.000 4.223 ( 0.000 0.000 0.000) 0.000 4.608 ( 0.000 0.000 0.000) 0.000 4.666 ( -0.000 -0.000 -0.000) 0.000 5.043 ( 0.000 0.000 0.000) 0.000 8.681 ( 0.000 0.000 0.000) 0.000 9.333 ( 0.000 0.000 0.000) 0.000 10.051 ( 0.000 0.000 0.000) 0.000 11.248 ( 0.000 0.000 0.000) 0.000 14.847 ( 0.000 0.000 0.000) 0.000 15.018 ( 0.000 0.000 0.000) 0.000 15.474 ( 0.000 0.000 0.000) 0.000 16.139 ( 0.000 0.000 0.000) 0.000 17.157 ( 0.000 0.000 0.000) 0.000 17.370 ( 0.000 0.000 0.000) 0.000 17.555 ( 0.000 0.000 0.000) 0.000 17.844 ( -0.000 -0.000 -0.000) 0.000 ======================= Grid point 105 (32/306) ======================= q-point: ( 0.00 0.00 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.309 ( 6.825 -0.000 14.706) 16.212 0.325 ( -2.750 0.000 15.241) 15.487 0.717 ( 6.997 -0.000 33.237) 33.965 0.883 ( -2.172 0.000 1.305) 2.534 1.769 ( 1.548 -0.000 -4.255) 4.528 2.011 ( -4.768 0.000 1.617) 5.035 2.482 ( 1.215 -0.000 -1.226) 1.726 2.777 ( -14.802 0.000 -2.770) 15.059 2.831 ( 1.791 -0.000 -3.702) 4.113 2.917 ( -0.672 0.000 0.503) 0.840 3.097 ( 0.463 -0.000 -0.882) 0.996 3.273 ( -1.061 0.000 -2.464) 2.683 3.363 ( 1.715 -0.000 2.108) 2.717 3.532 ( 0.073 -0.000 -0.200) 0.213 3.984 ( -0.104 0.000 -0.571) 0.580 4.057 ( -1.508 0.000 -2.415) 2.847 5.795 ( -0.097 0.000 1.978) 1.981 6.425 ( 21.823 -0.000 -1.979) 21.913 8.323 ( 0.948 -0.000 11.703) 11.742 8.709 ( -7.483 0.000 -14.671) 16.470 10.608 ( -86.234 0.000 9.855) 86.795 10.696 ( 1.101 -0.000 -8.037) 8.112 14.169 ( -2.317 0.000 -0.033) 2.317 14.525 ( -2.074 0.000 -5.064) 5.473 15.557 ( 2.941 -0.000 -0.371) 2.964 15.646 ( -2.386 0.000 -2.390) 3.377 16.812 ( 0.871 -0.000 0.485) 0.997 17.339 ( 33.963 -0.000 1.205) 33.984 17.885 ( 17.244 -0.000 2.298) 17.396 18.350 ( -1.026 0.000 -1.174) 1.559 ======================= Grid point 106 (33/306) ======================= q-point: ( 0.10 0.00 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.512 ( 3.824 -4.218 10.664) 12.089 0.548 ( 2.303 -4.573 13.495) 14.434 0.993 ( 4.868 -6.573 4.461) 9.317 1.295 ( 20.297 -7.035 24.893) 32.880 1.759 ( 1.948 -3.153 -3.385) 5.019 1.950 ( -6.827 -0.855 -0.323) 6.888 2.474 ( 1.672 1.121 -2.932) 3.557 2.610 ( -5.788 2.969 2.063) 6.824 2.806 ( 0.163 0.081 -3.174) 3.180 2.913 ( -1.031 0.569 0.516) 1.285 3.068 ( -2.689 -0.874 -2.656) 3.879 3.219 ( -2.158 0.156 -1.831) 2.834 3.390 ( 1.101 1.512 1.165) 2.203 3.531 ( -0.280 0.017 -1.165) 1.198 3.971 ( -0.049 0.629 -0.860) 1.066 4.025 ( 0.397 -1.652 -4.014) 4.359 5.760 ( -4.745 6.008 2.925) 8.196 6.390 ( -0.840 11.693 0.955) 11.762 8.395 ( -9.185 0.147 -16.101) 18.537 8.517 ( 2.745 -1.977 16.968) 17.302 10.161 ( -11.809 5.709 21.624) 25.291 10.808 ( -8.081 -22.912 -14.297) 28.190 14.160 ( 0.289 -1.527 -1.830) 2.401 14.465 ( 0.136 -4.540 -7.723) 8.959 15.578 ( -1.919 0.718 -2.719) 3.405 15.630 ( 5.721 -0.266 1.111) 5.834 16.817 ( 2.076 2.539 1.837) 3.759 17.384 ( -0.609 5.691 3.626) 6.776 18.051 ( 12.760 8.873 1.508) 15.614 18.396 ( -2.053 -8.795 -7.375) 11.660 ======================= Grid point 107 (34/306) ======================= q-point: ( 0.20 0.00 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 552 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.719 ( 4.976 -5.323 5.785) 9.303 0.784 ( 3.092 -5.844 11.297) 13.090 1.159 ( 2.596 -4.039 2.224) 5.291 1.804 ( 14.615 -5.217 2.689) 15.750 1.855 ( -7.915 -1.871 -1.868) 8.345 1.923 ( 9.762 -10.280 14.601) 20.351 2.430 ( 2.005 2.381 -4.229) 5.251 2.586 ( 0.151 -0.287 1.167) 1.212 2.764 ( -1.327 1.007 -1.695) 2.377 2.878 ( -2.082 1.351 -1.124) 2.724 3.011 ( -3.169 -1.959 -3.519) 5.125 3.187 ( -1.095 0.177 -0.256) 1.139 3.382 ( -0.575 1.965 0.653) 2.149 3.495 ( -1.037 1.778 -1.458) 2.523 3.949 ( 0.443 1.449 -1.244) 1.961 4.025 ( 1.880 -3.706 -4.308) 5.986 5.585 ( -10.191 13.270 3.910) 17.182 6.267 ( -2.174 6.374 1.146) 6.831 8.164 ( -3.565 -2.888 -14.782) 15.477 8.804 ( 4.690 -2.780 20.642) 21.350 10.283 ( 0.127 -1.057 14.000) 14.040 10.769 ( -5.214 -12.320 -16.622) 21.337 14.154 ( 0.967 -0.956 -3.625) 3.872 14.499 ( 4.308 -10.719 -7.741) 13.906 15.513 ( -2.179 0.865 -1.943) 3.045 15.720 ( 6.256 3.432 3.344) 7.880 16.857 ( 3.888 -0.314 1.983) 4.376 17.371 ( -1.189 1.177 3.523) 3.900 18.095 ( 5.767 4.824 1.865) 7.746 18.318 ( -5.759 -0.229 -6.772) 8.892 ======================= Grid point 108 (35/306) ======================= q-point: ( 0.30 0.00 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.886 ( 4.715 -4.007 2.940) 6.851 1.001 ( 2.584 -5.028 8.840) 10.493 1.202 ( -0.705 -0.234 0.386) 0.837 1.744 ( -7.240 -1.048 -2.755) 7.817 2.044 ( 9.967 -7.285 1.065) 12.391 2.327 ( 7.457 -5.993 10.226) 14.003 2.400 ( 5.404 -0.191 -4.076) 6.772 2.614 ( 0.565 -0.436 1.778) 1.916 2.732 ( -0.375 -1.298 -0.808) 1.574 2.826 ( -0.742 -0.411 -2.797) 2.923 2.956 ( -2.175 0.077 -3.150) 3.828 3.175 ( -0.694 0.272 0.504) 0.900 3.348 ( -1.649 1.697 0.694) 2.466 3.439 ( -1.681 2.447 -0.933) 3.112 3.922 ( 0.700 1.745 -1.111) 2.184 4.076 ( 3.679 -6.624 -3.723) 8.442 5.287 ( -13.496 17.245 4.332) 22.323 6.198 ( -1.064 2.633 -0.460) 2.877 8.053 ( -0.502 -4.646 -9.050) 10.186 9.121 ( 4.241 -1.037 20.477) 20.937 10.444 ( 4.677 -2.464 2.538) 5.865 10.640 ( -5.824 -6.046 -11.396) 14.154 14.140 ( 1.377 -1.102 -3.251) 3.699 14.654 ( 7.785 -14.395 -6.820) 17.730 15.468 ( -1.834 1.102 0.487) 2.194 15.744 ( 2.487 8.286 3.519) 9.339 16.976 ( 7.004 -3.797 2.312) 8.296 17.396 ( -0.421 -1.867 2.058) 2.810 18.103 ( -4.702 0.615 -2.929) 5.574 18.147 ( -0.736 6.411 -2.129) 6.796 ======================= Grid point 109 (36/306) ======================= q-point: ( 0.40 0.00 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 552 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.000 ( 3.995 -1.941 1.476) 4.680 1.136 ( -2.552 -1.620 4.662) 5.556 1.199 ( 1.457 1.599 3.364) 3.999 1.658 ( -3.697 -1.262 -2.405) 4.587 2.198 ( 5.980 -0.722 -1.563) 6.223 2.398 ( 1.982 -1.802 -1.680) 3.162 2.485 ( 1.557 -0.325 -0.889) 1.822 2.672 ( -1.208 0.319 0.800) 1.484 2.770 ( 2.242 -7.144 0.665) 7.517 2.848 ( 2.848 -1.349 0.245) 3.161 2.896 ( 0.190 1.063 -1.609) 1.938 3.176 ( -0.201 -0.224 1.073) 1.115 3.335 ( -1.526 -0.312 2.348) 2.818 3.364 ( -2.724 3.285 -1.582) 4.551 3.904 ( 0.399 0.743 -0.281) 0.888 4.206 ( 6.719 -9.924 -2.867) 12.322 4.950 ( -13.345 17.133 4.592) 22.197 6.156 ( -0.496 0.763 -1.983) 2.182 8.068 ( 1.026 -5.916 -0.910) 6.072 9.323 ( -1.868 3.819 14.235) 14.856 10.359 ( 4.900 1.256 -23.087) 23.634 10.709 ( -1.245 -6.197 13.016) 14.469 14.153 ( 1.857 -1.400 -0.680) 2.423 14.875 ( 9.035 -14.992 -5.801) 18.441 15.444 ( -2.393 3.498 3.913) 5.769 15.661 ( -1.710 8.826 1.288) 9.082 17.134 ( 5.430 -2.347 2.138) 6.290 17.471 ( 3.209 -5.745 1.208) 6.691 17.881 ( -8.459 6.408 -5.264) 11.846 18.132 ( 0.885 1.213 -0.239) 1.520 ======================= Grid point 110 (37/306) ======================= q-point: (-0.50 0.00 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.053 ( -0.383 1.304 0.201) 1.374 1.102 ( -1.757 2.814 0.904) 3.439 1.252 ( -0.012 2.994 6.455) 7.116 1.639 ( 1.127 -1.697 -1.557) 2.564 2.189 ( 2.614 3.091 -6.665) 7.798 2.416 ( -0.123 -1.813 -1.002) 2.075 2.481 ( 0.105 0.001 -2.103) 2.105 2.593 ( -4.130 1.421 -2.682) 5.125 2.830 ( -1.516 3.625 1.591) 4.239 2.863 ( 0.749 -1.199 -0.912) 1.682 2.990 ( 4.112 -4.755 3.908) 7.402 3.204 ( -0.227 -0.910 2.077) 2.279 3.257 ( -2.607 3.029 -2.064) 4.497 3.373 ( -0.019 -2.611 2.115) 3.361 3.911 ( -0.111 -1.050 0.782) 1.314 4.407 ( 6.709 -9.325 -1.581) 11.596 4.682 ( -6.602 9.701 4.460) 12.553 6.119 ( -0.277 -0.359 -3.445) 3.475 8.192 ( 1.295 -6.433 5.887) 8.816 9.275 ( -9.871 8.850 6.332) 14.692 10.149 ( 6.261 3.167 -22.150) 23.235 10.944 ( 2.566 -4.356 14.837) 15.674 14.202 ( 1.630 -1.121 2.349) 3.071 15.105 ( 8.452 -13.185 -4.310) 16.244 15.350 ( -6.712 13.069 6.238) 15.961 15.581 ( -1.221 -0.689 -1.218) 1.857 17.174 ( -1.392 1.377 0.200) 1.969 17.532 ( -4.324 4.856 -2.492) 6.963 17.777 ( 7.300 -6.146 -0.586) 9.561 18.116 ( -1.179 -0.305 -1.065) 1.617 ======================= Grid point 111 (38/306) ======================= q-point: (-0.40 0.00 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 552 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.940 ( -4.777 6.760 -2.340) 8.602 1.051 ( -4.620 5.565 2.124) 7.538 1.263 ( 0.142 4.492 4.032) 6.038 1.684 ( 4.584 -1.963 -1.552) 5.222 2.038 ( -2.992 5.120 -11.714) 13.129 2.346 ( -8.871 5.718 0.790) 10.584 2.490 ( 2.532 -3.274 -2.839) 5.019 2.515 ( -4.090 0.315 0.399) 4.121 2.755 ( -2.443 3.447 -0.319) 4.237 2.869 ( 0.817 0.698 1.022) 1.483 3.104 ( 2.351 -1.888 -0.456) 3.050 3.176 ( 0.124 4.276 4.859) 6.473 3.275 ( 1.026 -4.157 -0.178) 4.285 3.433 ( 0.474 -3.175 1.539) 3.560 3.938 ( -0.294 -1.636 1.231) 2.069 4.387 ( -7.156 6.533 3.955) 10.466 4.824 ( 12.901 -13.614 0.017) 18.755 6.078 ( -0.241 -1.006 -5.177) 5.279 8.346 ( 0.123 -4.794 5.141) 7.031 9.085 ( -11.624 10.280 9.899) 18.406 9.943 ( 4.455 2.735 -20.957) 21.599 11.177 ( 4.615 0.669 14.518) 15.248 14.263 ( 0.379 -0.356 4.378) 4.409 15.131 ( -9.057 14.447 4.705) 17.689 15.308 ( 6.985 -9.807 -2.240) 12.246 15.588 ( -1.418 -3.836 -1.285) 4.287 17.091 ( -5.553 4.599 -0.061) 7.210 17.341 ( -3.721 6.102 -5.825) 9.220 17.996 ( 4.877 -9.572 -2.806) 11.103 18.116 ( 4.243 -0.737 2.205) 4.838 ======================= Grid point 112 (39/306) ======================= q-point: (-0.30 0.00 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.741 ( -6.165 9.441 -2.850) 11.630 0.886 ( -10.031 9.881 2.631) 14.324 1.216 ( -1.349 6.454 0.009) 6.593 1.676 ( -13.056 5.614 -11.492) 18.277 1.779 ( 2.599 1.431 -4.362) 5.275 2.139 ( -9.430 8.452 3.332) 13.094 2.485 ( -0.648 -0.702 -0.855) 1.282 2.520 ( -0.978 -1.906 0.041) 2.143 2.750 ( 3.211 -1.422 0.474) 3.544 2.879 ( 0.625 0.828 0.471) 1.139 3.108 ( 1.675 0.617 -1.768) 2.513 3.225 ( 1.758 2.489 6.486) 7.167 3.327 ( -0.065 -3.541 -0.661) 3.603 3.496 ( 1.020 -3.018 1.056) 3.356 3.964 ( -0.006 -0.863 0.910) 1.254 4.276 ( -6.729 3.922 3.566) 8.565 5.179 ( 13.904 -14.546 0.595) 20.132 6.019 ( -0.386 -1.007 -7.524) 7.601 8.367 ( -2.286 0.884 -2.865) 3.770 9.025 ( -8.101 7.209 19.634) 22.429 9.758 ( -0.258 -2.051 -13.899) 14.052 11.353 ( 7.263 7.581 13.735) 17.288 14.303 ( -2.000 0.841 4.590) 5.077 14.902 ( -8.298 11.898 3.879) 15.015 15.467 ( 4.567 -7.416 -1.767) 8.887 15.595 ( -1.637 -2.586 -1.101) 3.253 16.943 ( -6.495 6.363 0.170) 9.094 17.176 ( -1.082 2.882 -9.297) 9.793 18.005 ( -5.530 -6.070 -4.283) 9.261 18.316 ( 12.980 -2.699 2.379) 13.470 ======================= Grid point 113 (40/306) ======================= q-point: (-0.20 0.00 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 552 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.505 ( -8.069 10.734 -0.417) 13.435 0.637 ( -13.565 10.669 2.344) 17.416 1.038 ( -9.968 12.360 -5.480) 16.797 1.192 ( -20.023 9.903 -3.708) 22.644 1.801 ( 4.192 0.308 -3.470) 5.451 2.028 ( -4.143 3.225 4.341) 6.812 2.479 ( 0.476 -0.677 -1.833) 2.011 2.550 ( -2.313 -3.142 5.094) 6.416 2.831 ( 5.029 -1.256 -0.771) 5.240 2.878 ( -0.415 -0.650 0.471) 0.904 3.104 ( 1.759 0.865 -1.151) 2.273 3.286 ( 1.471 1.416 5.103) 5.496 3.341 ( -1.796 -2.657 -1.573) 3.572 3.549 ( 1.171 -1.697 0.462) 2.113 3.979 ( 0.237 -0.240 0.233) 0.410 4.195 ( -5.243 1.984 1.554) 5.818 5.516 ( 11.983 -10.516 2.946) 16.213 5.922 ( -1.107 0.228 -9.303) 9.372 8.277 ( -1.998 3.482 -0.816) 4.097 9.011 ( -3.489 6.805 2.670) 8.100 9.781 ( -10.845 -15.381 14.717) 23.891 11.500 ( 14.632 15.017 15.731) 26.212 14.284 ( -4.696 2.243 3.221) 6.120 14.731 ( -5.740 7.400 2.587) 9.716 15.537 ( -1.972 -6.062 -3.922) 7.484 15.620 ( 3.846 0.755 2.075) 4.434 16.777 ( -7.650 3.824 -4.457) 9.644 17.029 ( 1.489 3.592 -10.585) 11.277 17.960 ( -7.152 -6.856 -3.985) 10.679 18.496 ( 13.215 1.970 -1.422) 13.436 ======================= Grid point 114 (41/306) ======================= q-point: (-0.10 0.00 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.301 ( -13.115 7.025 4.748) 15.617 0.326 ( -15.079 9.188 2.245) 17.800 0.617 ( -16.022 18.606 15.326) 28.944 0.981 ( -7.701 2.854 0.285) 8.217 1.794 ( 2.395 0.741 -3.594) 4.382 2.022 ( -2.652 -0.223 3.941) 4.755 2.478 ( 0.872 -0.450 -1.155) 1.516 2.705 ( -2.476 -14.701 10.434) 18.197 2.846 ( 2.505 0.450 -3.392) 4.241 2.922 ( 1.618 -1.066 1.353) 2.363 3.102 ( 0.712 0.253 -1.221) 1.436 3.307 ( -2.182 -0.523 -2.298) 3.212 3.337 ( -0.704 -0.547 2.385) 2.546 3.563 ( 0.975 1.554 -1.501) 2.370 3.984 ( 0.236 -0.321 -0.226) 0.458 4.123 ( -3.009 1.905 -1.425) 3.836 5.771 ( 4.659 0.417 -1.417) 4.888 5.895 ( 10.860 -6.620 14.086) 18.979 8.245 ( -0.368 2.745 5.110) 5.812 8.867 ( -2.101 2.207 -8.533) 9.061 10.198 ( -23.180 -45.498 28.113) 58.290 11.700 ( 16.186 13.846 0.962) 21.322 14.219 ( -4.816 1.999 1.635) 5.465 14.620 ( -4.197 3.147 -0.815) 5.308 15.543 ( -0.119 -2.454 -0.634) 2.537 15.677 ( 3.156 1.910 1.947) 4.171 16.563 ( -2.272 3.273 0.752) 4.055 16.919 ( 8.197 10.110 -2.553) 13.264 17.899 ( -8.911 -5.842 -4.325) 11.499 18.514 ( 11.482 13.873 -9.228) 20.235 ======================= Grid point 116 (42/306) ======================= q-point: ( 0.10 0.10 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 305 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.671 ( 6.151 -0.000 9.519) 11.333 0.690 ( 3.162 -0.000 11.160) 11.599 1.111 ( 8.651 -0.000 7.015) 11.138 1.723 ( 1.224 -0.000 -1.813) 2.188 1.772 ( 20.805 -0.000 19.132) 28.265 1.837 ( -7.454 0.000 -1.684) 7.642 2.470 ( 3.110 -0.000 -4.780) 5.703 2.581 ( -2.408 0.000 0.388) 2.439 2.777 ( -0.561 0.000 -1.292) 1.409 2.926 ( -0.551 0.000 1.581) 1.674 2.957 ( -6.534 0.000 -4.795) 8.105 3.187 ( -1.149 0.000 -0.445) 1.232 3.407 ( -0.621 0.000 -0.183) 0.647 3.515 ( -0.733 0.000 -1.453) 1.628 3.971 ( 0.529 -0.000 -0.327) 0.622 3.979 ( 1.876 -0.000 -5.007) 5.347 5.769 ( -6.421 0.000 3.293) 7.217 6.361 ( -10.255 0.000 -1.254) 10.331 8.133 ( -4.423 0.000 -14.713) 15.364 8.770 ( 5.015 -0.000 22.142) 22.702 10.285 ( -7.719 0.000 18.338) 19.896 10.543 ( 5.779 -0.000 -14.605) 15.706 14.156 ( 3.967 -0.000 -2.493) 4.686 14.349 ( 1.876 -0.000 -9.257) 9.445 15.542 ( 0.099 -0.000 -3.349) 3.350 15.739 ( 8.684 -0.000 2.561) 9.054 16.876 ( 2.179 -0.000 1.912) 2.899 17.398 ( -4.590 0.000 2.822) 5.388 18.210 ( -6.008 0.000 -2.933) 6.685 18.252 ( 7.096 -0.000 -2.964) 7.690 ======================= Grid point 117 (43/306) ======================= q-point: ( 0.20 0.10 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.831 ( 6.432 -0.031 6.487) 9.135 0.887 ( 5.296 -3.930 8.790) 10.989 1.270 ( 7.404 4.286 5.441) 10.139 1.693 ( -7.714 -2.872 -3.146) 8.812 1.846 ( 5.661 -6.164 3.493) 9.069 2.183 ( 13.311 -3.580 11.450) 17.920 2.442 ( 4.236 2.105 -5.664) 7.379 2.587 ( 2.444 -1.518 -0.913) 3.018 2.750 ( -2.411 1.862 -0.755) 3.138 2.813 ( -5.598 -0.746 -4.053) 6.951 2.942 ( -1.267 -0.735 1.022) 1.786 3.176 ( -0.838 -0.084 0.299) 0.893 3.381 ( -2.275 0.719 -0.178) 2.393 3.474 ( -1.763 0.545 -2.183) 2.859 3.953 ( 2.337 -0.057 -4.426) 5.005 3.989 ( 2.539 -0.479 -0.159) 2.589 5.649 ( -9.925 9.790 3.721) 14.428 6.208 ( -10.486 -1.121 -1.715) 10.684 7.980 ( 1.028 -1.381 -10.731) 10.868 9.109 ( 6.646 -0.091 24.893) 25.765 10.389 ( -0.967 -1.055 8.340) 8.462 10.478 ( 2.588 -5.346 -14.474) 15.646 14.166 ( 5.178 3.129 -3.408) 6.944 14.358 ( 6.232 -8.928 -7.100) 12.999 15.511 ( 1.565 1.848 -1.719) 2.970 15.869 ( 7.313 1.628 2.577) 7.923 16.934 ( 4.400 0.074 2.665) 5.144 17.375 ( -3.547 -0.162 2.398) 4.285 18.097 ( -6.898 -0.590 -2.975) 7.535 18.255 ( 0.747 2.212 -3.152) 3.923 ======================= Grid point 118 (44/306) ======================= q-point: ( 0.30 0.10 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.970 ( 5.426 -0.595 4.256) 6.921 1.087 ( 6.151 -1.953 7.021) 9.537 1.320 ( 5.375 7.673 4.955) 10.598 1.608 ( -4.207 -2.521 -3.469) 6.007 2.094 ( 7.762 -7.877 5.843) 12.508 2.379 ( 0.641 -0.067 0.081) 0.650 2.455 ( 7.977 -2.352 -2.514) 8.688 2.614 ( -2.365 -1.268 -0.541) 2.738 2.669 ( -0.140 -2.147 -4.338) 4.842 2.789 ( 1.275 -2.137 -0.541) 2.546 2.937 ( -1.385 1.263 1.709) 2.537 3.170 ( -1.001 -0.196 0.251) 1.050 3.337 ( -2.810 0.631 0.301) 2.896 3.417 ( -2.834 0.732 -1.799) 3.435 3.936 ( 1.907 0.446 -3.247) 3.792 4.055 ( 5.863 -1.914 0.481) 6.186 5.377 ( -13.015 16.228 3.594) 21.110 6.105 ( -8.404 -4.652 -2.709) 9.980 7.959 ( 4.436 -2.881 -4.102) 6.694 9.423 ( 3.090 3.832 21.607) 22.160 10.349 ( 6.795 -1.387 -20.746) 21.875 10.539 ( -2.522 -6.668 9.862) 12.169 14.164 ( 5.866 2.496 -2.044) 6.695 14.533 ( 9.625 -12.298 -4.568) 16.271 15.503 ( 2.676 2.659 0.611) 3.821 15.894 ( 1.193 7.132 1.317) 7.350 17.063 ( 8.123 -2.547 3.444) 9.183 17.371 ( -1.934 -2.152 1.143) 3.111 17.968 ( -8.412 0.701 -3.807) 9.260 18.179 ( -1.987 2.402 -2.757) 4.161 ======================= Grid point 119 (45/306) ======================= q-point: ( 0.40 0.10 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.064 ( 3.004 0.003 2.178) 3.710 1.201 ( 3.301 3.968 3.669) 6.333 1.368 ( 5.931 6.459 7.693) 11.665 1.585 ( 1.396 -2.054 -2.633) 3.620 2.258 ( 4.385 1.769 -1.097) 4.854 2.361 ( 0.329 -2.042 -3.474) 4.043 2.463 ( -1.507 -0.951 -1.526) 2.346 2.622 ( -1.217 -0.297 -4.562) 4.731 2.726 ( 4.476 -8.793 1.800) 10.030 2.863 ( 2.465 -4.088 1.171) 4.915 2.918 ( -1.078 2.717 2.294) 3.716 3.161 ( -1.982 -1.218 0.331) 2.350 3.319 ( -1.702 -1.378 0.890) 2.364 3.338 ( -3.995 2.101 -1.380) 4.720 3.921 ( 1.244 0.821 -1.364) 2.021 4.196 ( 9.137 -4.826 0.389) 10.341 5.044 ( -12.609 16.500 3.302) 21.027 6.041 ( -7.328 -5.937 -3.596) 10.094 8.063 ( 5.870 -3.923 3.066) 7.697 9.498 ( -6.187 8.955 9.997) 14.779 10.213 ( 7.800 2.219 -19.684) 21.289 10.766 ( 2.599 -9.506 13.068) 16.368 14.209 ( 6.204 1.799 1.020) 6.539 14.776 ( 10.395 -12.827 -2.928) 16.768 15.523 ( 3.041 3.490 2.967) 5.499 15.759 ( -4.569 11.002 -0.472) 11.922 17.197 ( 2.604 0.402 1.782) 3.181 17.455 ( 5.796 -7.335 1.228) 9.428 17.787 ( -7.854 3.816 -4.442) 9.797 18.103 ( -3.771 -0.622 -2.150) 4.385 ======================= Grid point 120 (46/306) ======================= q-point: (-0.50 0.10 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.077 ( -0.892 3.262 0.551) 3.427 1.182 ( 0.702 5.966 1.164) 6.119 1.434 ( 3.751 7.964 7.597) 11.628 1.629 ( 5.884 -1.528 -2.275) 6.491 2.151 ( -0.172 3.961 -12.035) 12.671 2.383 ( -0.404 -1.399 1.426) 2.038 2.451 ( -0.940 -0.668 -1.444) 1.848 2.549 ( -2.312 2.239 -1.610) 3.599 2.829 ( -0.177 -0.998 -1.907) 2.159 2.891 ( -1.141 3.081 3.072) 4.498 2.999 ( 2.325 -6.716 3.303) 7.837 3.170 ( -1.526 -3.642 0.260) 3.957 3.261 ( -0.570 2.335 0.195) 2.411 3.347 ( -1.293 -3.434 1.581) 3.996 3.921 ( 0.820 0.330 0.526) 1.029 4.387 ( 7.450 -6.215 -0.399) 9.711 4.780 ( -5.609 10.232 3.497) 12.181 5.985 ( -6.988 -6.435 -4.458) 10.494 8.242 ( 5.120 -3.517 6.906) 9.288 9.344 ( -9.481 10.224 5.919) 15.148 10.036 ( 5.061 4.722 -20.024) 21.187 11.087 ( 5.978 -7.488 14.473) 17.357 14.285 ( 5.250 2.077 3.606) 6.699 15.025 ( 8.813 -11.676 -1.799) 14.739 15.493 ( -6.917 13.244 3.801) 15.417 15.586 ( 2.697 3.213 -0.931) 4.297 17.178 ( -2.222 2.654 0.144) 3.464 17.505 ( -5.851 6.104 -4.026) 9.365 17.744 ( 5.844 -9.788 -2.357) 11.641 18.071 ( -1.616 -2.795 0.515) 3.269 ======================= Grid point 121 (47/306) ======================= q-point: (-0.40 0.10 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.974 ( -3.332 8.385 -0.584) 9.042 1.089 ( -4.966 6.817 -0.121) 8.435 1.427 ( 2.363 9.240 3.827) 10.277 1.696 ( 6.521 -0.574 -3.866) 7.603 1.926 ( -3.363 7.274 -11.503) 14.019 2.331 ( -8.744 6.091 2.941) 11.054 2.448 ( 2.228 -2.379 -3.967) 5.134 2.499 ( -2.358 0.911 2.348) 3.450 2.764 ( -0.997 2.472 -0.912) 2.817 2.896 ( 0.274 0.514 0.988) 1.147 3.083 ( 1.046 -2.903 -1.093) 3.273 3.209 ( -2.791 -4.187 1.808) 5.347 3.299 ( 4.571 1.282 3.784) 6.071 3.400 ( -0.504 -4.431 1.018) 4.574 3.943 ( 0.573 -0.368 1.522) 1.667 4.385 ( -6.637 3.924 0.020) 7.710 4.872 ( 12.897 -8.413 2.994) 15.687 5.924 ( -7.067 -6.481 -5.343) 10.977 8.376 ( 1.598 0.048 3.815) 4.136 9.230 ( -6.595 8.462 15.053) 18.485 9.788 ( 1.687 4.130 -21.862) 22.313 11.386 ( 6.782 -3.822 12.323) 14.575 14.353 ( 2.921 3.131 4.691) 6.351 15.186 ( -3.027 3.124 -0.484) 4.377 15.276 ( -1.069 0.260 -0.367) 1.160 15.622 ( 6.028 3.897 2.832) 7.717 17.102 ( -3.463 5.058 1.184) 6.243 17.270 ( -7.022 5.485 -8.315) 12.187 17.840 ( -2.652 -7.394 -4.529) 9.067 18.199 ( 8.220 -6.301 3.375) 10.893 ======================= Grid point 122 (48/306) ======================= q-point: (-0.30 0.10 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.792 ( -5.337 11.232 -0.411) 12.442 0.881 ( -9.974 9.010 -2.143) 13.611 1.342 ( 2.017 12.094 -1.378) 12.338 1.551 ( -7.830 14.364 -4.851) 17.063 1.801 ( 5.022 1.118 -2.493) 5.717 2.153 ( -9.098 6.879 2.731) 11.728 2.451 ( 1.184 -1.684 -3.340) 3.923 2.503 ( -2.016 -0.471 3.011) 3.654 2.778 ( 3.714 -1.646 0.321) 4.075 2.891 ( -0.131 0.672 -0.749) 1.015 3.108 ( 2.021 -0.931 -1.728) 2.817 3.244 ( -3.258 -4.119 2.240) 5.709 3.358 ( 2.381 2.859 2.728) 4.613 3.464 ( 0.359 -4.649 0.411) 4.681 3.969 ( 0.208 -0.355 1.049) 1.127 4.251 ( -6.507 2.843 -0.292) 7.107 5.225 ( 15.210 -12.109 3.959) 19.840 5.849 ( -7.447 -5.876 -5.789) 11.113 8.370 ( -1.470 4.040 2.129) 4.797 9.242 ( -2.799 11.130 8.956) 14.557 9.574 ( -2.127 -4.011 -7.384) 8.668 11.619 ( 7.039 -1.888 8.068) 10.873 14.370 ( -0.513 4.618 3.942) 6.093 14.967 ( -6.908 11.084 0.018) 13.060 15.365 ( 0.128 -7.317 -1.371) 7.445 15.699 ( 8.769 5.061 4.018) 10.893 16.949 ( -8.736 8.808 -2.054) 12.574 17.079 ( -0.958 1.147 -6.853) 7.014 17.821 ( -4.727 -5.191 -2.895) 7.595 18.423 ( 9.434 -6.513 0.880) 11.497 ======================= Grid point 123 (49/306) ======================= q-point: (-0.20 0.10 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.553 ( -8.819 11.236 0.209) 14.286 0.635 ( -4.466 13.250 1.785) 14.096 1.121 ( -1.728 18.684 -1.323) 18.810 1.272 ( -4.997 18.299 7.179) 20.282 1.822 ( 4.579 1.444 -2.988) 5.655 2.035 ( -6.012 2.106 3.471) 7.255 2.452 ( 1.088 -1.593 -2.541) 3.190 2.529 ( -2.327 -2.265 3.812) 5.008 2.859 ( 3.619 -0.402 -2.845) 4.621 2.868 ( -0.117 -1.648 1.183) 2.032 3.118 ( 1.832 0.336 -1.661) 2.496 3.273 ( -2.381 -3.235 0.488) 4.047 3.354 ( -0.569 2.579 1.599) 3.087 3.522 ( 0.096 -3.834 -0.369) 3.853 3.977 ( -0.213 -0.303 -0.183) 0.413 4.156 ( -3.539 1.380 -1.073) 3.947 5.609 ( 13.692 -11.083 5.690) 18.512 5.769 ( -6.908 -5.381 -2.514) 9.110 8.338 ( -1.470 4.715 6.535) 8.191 9.006 ( -3.246 8.695 -15.317) 17.910 9.710 ( -5.390 -6.990 19.726) 21.611 11.760 ( 2.603 -2.890 -2.531) 4.640 14.313 ( -3.249 5.447 1.995) 6.649 14.773 ( -3.737 8.765 -1.407) 9.631 15.433 ( -0.093 -5.678 0.798) 5.735 15.769 ( 4.781 5.192 2.055) 7.351 16.707 ( -4.565 7.424 -3.263) 9.306 17.032 ( 3.167 2.061 -0.633) 3.831 17.803 ( -3.089 -3.384 -0.708) 4.636 18.583 ( 7.168 -4.289 -3.971) 9.249 ======================= Grid point 124 (50/306) ======================= q-point: (-0.10 0.10 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.443 ( 4.694 9.885 9.063) 14.209 0.501 ( -0.805 11.942 9.266) 15.137 0.969 ( 6.413 13.666 9.878) 18.041 1.104 ( -0.791 18.394 11.981) 21.966 1.806 ( 2.941 2.939 -3.264) 5.286 2.009 ( -4.169 -0.504 2.492) 4.883 2.464 ( 1.191 -1.766 -1.891) 2.849 2.583 ( -4.400 -5.352 4.301) 8.155 2.831 ( 0.356 -0.083 -2.864) 2.887 2.919 ( 0.452 -1.220 -0.571) 1.421 3.109 ( 0.566 0.831 -1.438) 1.755 3.263 ( -1.954 -0.977 -1.916) 2.905 3.347 ( -0.631 -0.281 2.187) 2.293 3.545 ( -0.337 -1.608 -1.505) 2.228 3.974 ( -0.195 -0.673 -0.803) 1.065 4.091 ( -1.038 1.838 -2.770) 3.482 5.714 ( -4.980 -6.200 0.550) 7.972 6.056 ( 11.341 -15.519 10.278) 21.797 8.376 ( -0.097 3.741 12.103) 12.668 8.691 ( -6.183 2.889 -17.457) 18.744 9.956 ( -8.834 -8.070 22.705) 25.665 11.513 ( -17.733 12.024 -22.372) 30.976 14.223 ( -2.641 4.111 -0.090) 4.887 14.613 ( -1.491 6.961 -4.596) 8.474 15.535 ( 3.009 -4.027 2.175) 5.477 15.685 ( -5.486 3.950 -3.178) 7.469 16.700 ( 5.980 -0.993 5.107) 7.927 17.147 ( 11.351 -3.220 7.026) 13.732 17.835 ( 3.611 -2.186 2.181) 4.752 18.583 ( 2.146 2.316 -9.961) 10.449 ======================= Grid point 127 (51/306) ======================= q-point: ( 0.20 0.20 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.965 ( 2.948 -0.000 6.621) 7.247 1.059 ( 12.495 -0.000 6.407) 14.042 1.484 ( 8.971 -0.000 5.334) 10.437 1.550 ( -5.340 0.000 -3.065) 6.158 1.941 ( 7.139 -0.000 8.292) 10.942 2.351 ( 3.172 -0.000 4.626) 5.609 2.453 ( 5.761 -0.000 -6.326) 8.556 2.612 ( 3.087 -0.000 -2.475) 3.957 2.637 ( -5.337 0.000 -6.398) 8.332 2.759 ( -1.104 0.000 0.700) 1.308 2.952 ( -1.003 0.000 2.889) 3.059 3.168 ( -0.968 0.000 0.085) 0.971 3.352 ( -3.406 0.000 0.678) 3.473 3.417 ( -2.541 0.000 -3.329) 4.189 3.931 ( 2.870 -0.000 -4.800) 5.593 4.052 ( 5.181 -0.000 2.467) 5.738 5.634 ( -10.290 0.000 3.449) 10.853 5.998 ( -14.433 0.000 -3.609) 14.878 7.924 ( 5.384 -0.000 -5.024) 7.364 9.478 ( 5.862 -0.000 24.984) 25.662 10.328 ( 8.855 -0.000 -18.629) 20.626 10.441 ( -4.318 0.000 7.357) 8.530 14.285 ( 9.458 -0.000 -0.692) 9.483 14.288 ( 7.704 -0.000 -5.935) 9.725 15.547 ( 4.164 -0.000 -0.442) 4.188 15.977 ( 4.262 -0.000 0.523) 4.294 17.034 ( 6.937 -0.000 3.515) 7.777 17.348 ( -3.663 0.000 1.496) 3.957 17.965 ( -7.776 0.000 -2.524) 8.175 18.215 ( -3.313 0.000 -4.235) 5.377 ======================= Grid point 128 (52/306) ======================= q-point: ( 0.30 0.20 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.059 ( 2.302 -0.185 4.228) 4.818 1.258 ( 7.196 0.696 3.345) 7.966 1.515 ( 6.140 2.250 3.253) 7.304 1.598 ( 6.954 4.422 1.899) 8.456 2.189 ( 7.832 -5.423 9.747) 13.629 2.365 ( -2.519 0.761 -3.931) 4.731 2.455 ( -0.391 0.267 -4.316) 4.342 2.489 ( -0.340 -4.482 -3.313) 5.583 2.660 ( 4.071 0.227 -3.215) 5.193 2.768 ( 0.367 -2.780 -0.287) 2.819 2.970 ( -1.091 1.154 3.961) 4.267 3.148 ( -1.709 -0.122 -0.826) 1.902 3.311 ( -3.548 0.540 0.776) 3.672 3.352 ( -3.132 -0.618 -2.695) 4.177 3.920 ( 2.429 -0.401 -3.615) 4.374 4.164 ( 7.992 0.494 3.189) 8.619 5.430 ( -13.034 13.211 2.003) 18.667 5.842 ( -13.076 -9.146 -3.936) 16.435 8.000 ( 8.139 -1.256 1.635) 8.396 9.679 ( -2.710 4.566 8.611) 10.117 10.290 ( 10.644 4.645 -8.834) 14.592 10.516 ( 0.188 -9.543 6.797) 11.717 14.296 ( 9.471 5.241 -0.724) 10.848 14.497 ( 11.022 -9.372 -0.870) 14.494 15.603 ( 6.027 2.329 1.548) 6.644 15.957 ( -2.279 4.149 -2.137) 5.194 17.190 ( 9.117 -0.659 3.808) 9.903 17.327 ( -1.615 -2.349 0.168) 2.856 17.846 ( -7.382 0.862 -1.900) 7.671 18.096 ( -6.765 -0.005 -4.692) 8.233 ======================= Grid point 129 (53/306) ======================= q-point: (-0.60 0.20 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 552 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.115 ( 1.215 0.488 2.094) 2.470 1.286 ( -0.177 1.282 -0.361) 1.344 1.610 ( 4.240 6.591 1.537) 7.986 1.678 ( 13.617 5.209 5.435) 15.559 2.216 ( -3.738 1.075 -9.679) 10.431 2.369 ( 4.081 -0.115 1.893) 4.500 2.424 ( -2.158 -0.499 1.576) 2.719 2.572 ( 3.530 -2.521 -3.487) 5.566 2.699 ( 3.601 -5.866 0.780) 6.927 2.830 ( 0.661 -5.605 0.925) 5.719 2.979 ( -1.161 2.824 4.452) 5.399 3.116 ( -2.381 -0.779 -0.661) 2.591 3.284 ( -2.745 -1.436 0.894) 3.224 3.292 ( -2.134 0.192 -1.804) 2.801 3.924 ( 2.015 -0.444 -1.468) 2.532 4.300 ( 9.056 -0.430 2.138) 9.315 5.102 ( -12.516 14.222 0.831) 18.963 5.772 ( -11.897 -10.568 -3.893) 16.382 8.177 ( 8.589 -1.744 7.205) 11.345 9.554 ( -6.197 6.079 -3.441) 9.338 10.191 ( 2.633 8.196 -9.375) 12.728 10.841 ( 8.135 -11.637 13.262) 19.429 14.365 ( 9.184 4.429 2.396) 10.474 14.753 ( 10.753 -10.001 0.322) 14.688 15.672 ( 7.397 4.270 3.075) 9.078 15.785 ( -7.314 8.184 -3.297) 11.460 17.232 ( -1.072 1.867 -0.515) 2.213 17.472 ( 9.289 -7.094 0.988) 11.729 17.693 ( -7.980 4.439 -3.221) 9.683 17.988 ( -6.452 -3.641 -1.835) 7.632 ======================= Grid point 130 (54/306) ======================= q-point: (-0.50 0.20 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.114 ( -0.808 3.035 0.651) 3.208 1.234 ( -2.690 4.047 -1.116) 4.986 1.568 ( -0.118 3.102 -1.660) 3.520 1.799 ( 11.451 8.635 3.047) 14.662 2.067 ( 1.314 3.975 -8.913) 9.848 2.397 ( 2.739 -0.418 -3.215) 4.244 2.423 ( -3.160 0.879 3.281) 4.639 2.550 ( -1.084 2.661 0.028) 2.873 2.786 ( 0.662 -2.420 -2.489) 3.535 2.933 ( -0.364 -1.942 2.165) 2.931 2.966 ( -3.599 -1.293 4.132) 5.630 3.114 ( -0.738 -2.977 -0.239) 3.077 3.291 ( -1.828 -3.270 2.132) 4.310 3.309 ( 4.337 -1.127 0.678) 4.532 3.950 ( 2.242 0.303 0.963) 2.458 4.416 ( 3.563 -0.357 -0.211) 3.587 4.858 ( -3.172 6.696 1.572) 7.574 5.712 ( -11.613 -10.472 -4.191) 16.189 8.376 ( 5.979 0.031 8.449) 10.350 9.394 ( -3.989 4.309 0.756) 5.920 9.962 ( -0.684 9.756 -13.924) 17.015 11.213 ( 7.229 -9.333 11.877) 16.746 14.451 ( 7.197 4.730 4.227) 9.594 14.997 ( 7.836 -8.936 0.951) 11.924 15.527 ( -8.791 10.165 -3.558) 13.902 15.750 ( 8.774 5.746 4.230) 11.309 17.177 ( -1.367 1.552 -2.340) 3.123 17.443 ( -9.763 7.807 -4.039) 13.137 17.655 ( 2.836 -7.019 -3.289) 8.254 18.026 ( 1.240 -7.476 2.876) 8.105 ======================= Grid point 131 (55/306) ======================= q-point: (-0.40 0.20 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 552 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.031 ( -3.550 7.546 0.188) 8.342 1.075 ( -6.394 6.875 -3.226) 9.928 1.526 ( 0.067 1.261 -1.006) 1.614 1.804 ( 8.912 9.948 -5.905) 14.604 1.962 ( 3.647 9.140 0.242) 9.844 2.334 ( -8.124 6.779 2.198) 10.807 2.403 ( 1.803 -1.899 -3.903) 4.700 2.523 ( -1.775 1.881 3.452) 4.313 2.767 ( 1.327 0.140 -1.996) 2.401 2.910 ( -1.558 1.497 0.838) 2.318 3.035 ( -0.842 -5.319 1.135) 5.504 3.142 ( -2.047 -3.573 0.805) 4.196 3.338 ( -1.040 -5.028 0.468) 5.156 3.413 ( 5.213 0.610 2.802) 5.950 3.984 ( 2.180 1.775 1.849) 3.365 4.334 ( -6.832 3.845 -2.264) 8.160 4.972 ( 12.300 -7.363 3.480) 14.752 5.648 ( -11.669 -10.108 -4.193) 15.997 8.473 ( 1.095 4.152 5.990) 7.371 9.413 ( 0.683 -0.719 10.269) 10.317 9.639 ( -2.626 11.674 -16.489) 20.373 11.492 ( 4.392 -7.483 6.559) 10.876 14.503 ( 3.594 5.971 4.314) 8.196 15.169 ( 2.516 -4.670 1.055) 5.408 15.264 ( -6.686 8.582 -2.773) 11.226 15.843 ( 10.415 6.150 4.022) 12.746 17.098 ( -2.943 0.781 -8.241) 8.786 17.180 ( -8.298 9.378 1.119) 12.572 17.693 ( -1.464 -5.122 -2.852) 6.043 18.217 ( 5.512 -9.602 2.075) 11.265 ======================= Grid point 132 (56/306) ======================= q-point: (-0.30 0.20 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.827 ( -5.655 10.749 0.015) 12.146 0.921 ( -1.917 9.445 0.520) 9.651 1.481 ( 1.322 7.774 -1.145) 7.968 1.670 ( 3.937 12.845 -3.298) 13.833 1.934 ( 5.481 9.316 3.450) 11.346 2.148 ( -9.671 7.024 2.244) 12.161 2.409 ( 1.862 -1.844 -3.468) 4.347 2.518 ( -1.995 1.051 3.446) 4.118 2.806 ( 4.389 -2.002 -0.591) 4.860 2.876 ( -1.868 0.649 -0.871) 2.161 3.089 ( 0.517 -3.356 -0.650) 3.457 3.170 ( -3.068 -4.081 1.520) 5.327 3.395 ( 0.135 -4.794 -0.471) 4.819 3.447 ( 0.670 2.890 0.883) 3.096 3.987 ( 0.099 1.903 0.118) 1.910 4.202 ( -3.664 2.196 -1.405) 4.497 5.318 ( 14.769 -11.748 4.618) 19.429 5.581 ( -11.668 -9.634 -3.169) 15.459 8.473 ( -1.421 6.091 8.063) 10.204 9.248 ( -3.722 9.188 -22.016) 24.145 9.623 ( 2.770 -0.274 19.073) 19.275 11.640 ( 0.126 -6.488 -1.491) 6.658 14.475 ( -1.039 7.362 2.455) 7.830 15.024 ( -3.195 10.952 -1.931) 11.571 15.289 ( 0.268 -5.739 1.389) 5.911 15.913 ( 5.890 6.006 1.064) 8.479 16.887 ( -4.020 6.429 -5.379) 9.297 17.094 ( -0.216 3.836 2.249) 4.452 17.711 ( -0.821 -4.029 -0.753) 4.180 18.403 ( 3.715 -9.455 -1.172) 10.226 ======================= Grid point 133 (57/306) ======================= q-point: (-0.20 0.20 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 552 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.708 ( 3.317 11.068 5.657) 12.865 0.802 ( 0.043 11.237 4.106) 11.964 1.336 ( 2.506 14.332 -1.241) 14.603 1.562 ( 3.843 15.326 6.339) 17.025 1.928 ( 5.356 7.952 2.113) 9.817 2.013 ( -7.199 1.844 2.847) 7.958 2.416 ( 1.454 -1.604 -2.920) 3.635 2.531 ( -1.049 -0.379 3.081) 3.277 2.831 ( -2.074 0.218 -1.559) 2.604 2.877 ( 3.322 -1.968 -1.009) 3.991 3.113 ( 0.958 -1.297 -2.112) 2.657 3.196 ( -3.014 -4.039 0.677) 5.085 3.383 ( -1.474 3.154 -0.792) 3.570 3.458 ( -0.585 -4.735 -0.592) 4.807 3.959 ( -0.887 -0.068 -1.184) 1.481 4.147 ( 0.566 2.770 -1.160) 3.056 5.511 ( -10.867 -9.841 -1.016) 14.696 5.724 ( 12.351 -12.722 6.137) 18.763 8.492 ( -2.541 5.450 13.260) 14.559 8.847 ( -3.101 8.749 -22.047) 23.921 9.877 ( 2.696 -0.672 18.940) 19.143 11.586 ( -7.348 -2.448 -12.314) 14.547 14.363 ( -3.569 7.033 -0.280) 7.891 14.846 ( 0.444 11.319 -3.207) 11.773 15.394 ( 1.253 -6.365 3.226) 7.245 15.817 ( -5.870 6.143 -3.842) 9.325 16.793 ( 5.097 6.451 0.275) 8.226 17.127 ( 4.578 0.778 5.157) 6.940 17.767 ( 2.259 -3.344 1.585) 4.336 18.498 ( -0.348 -7.391 -5.025) 8.945 ======================= Grid point 134 (58/306) ======================= q-point: (-0.10 0.20 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.700 ( 3.659 8.944 5.849) 11.296 0.745 ( 2.125 10.833 7.862) 13.553 1.214 ( 1.776 10.350 1.283) 10.579 1.583 ( 14.626 13.478 12.471) 23.476 1.907 ( 3.852 8.831 3.031) 10.101 1.958 ( -5.806 -0.334 0.733) 5.861 2.423 ( 1.193 -2.111 -3.035) 3.885 2.562 ( -0.501 -0.782 2.615) 2.775 2.792 ( -1.537 -0.587 -1.816) 2.451 2.897 ( 0.006 -0.730 -1.905) 2.040 3.092 ( -0.727 0.472 -3.249) 3.363 3.202 ( -1.947 -1.670 -0.625) 2.640 3.351 ( -0.789 -0.940 1.096) 1.646 3.491 ( -0.734 -3.300 -1.313) 3.627 3.946 ( -0.349 -1.135 -1.300) 1.761 4.097 ( 1.570 4.072 -3.115) 5.362 5.516 ( -10.823 -12.284 2.423) 16.550 6.077 ( 7.548 -12.052 5.114) 15.112 8.446 ( -8.643 3.982 -12.231) 15.497 8.618 ( 5.011 6.447 10.209) 13.073 10.108 ( 1.757 0.150 16.978) 17.069 11.235 ( -12.512 8.867 -18.942) 24.372 14.234 ( -2.362 4.536 -2.499) 5.692 14.672 ( 2.559 11.654 -6.022) 13.365 15.544 ( 2.431 -6.518 3.128) 7.628 15.622 ( -5.566 3.808 -2.194) 7.092 16.808 ( 4.787 3.196 1.156) 5.871 17.276 ( 4.751 -2.064 6.115) 8.014 17.903 ( 7.506 -4.418 3.634) 9.437 18.459 ( -4.719 -3.040 -7.615) 9.460 ======================= Grid point 138 (59/306) ======================= q-point: ( 0.30 0.30 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 305 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.119 ( 1.339 -0.000 2.759) 3.067 1.287 ( 0.061 -0.000 -1.825) 1.826 1.725 ( 4.092 -0.000 -1.035) 4.221 1.762 ( 17.221 -0.000 7.888) 18.942 2.224 ( -6.224 0.000 -7.681) 9.886 2.376 ( 6.367 -0.000 11.660) 13.285 2.395 ( -4.603 0.000 1.754) 4.926 2.482 ( 9.571 -0.000 -7.727) 12.301 2.677 ( 3.356 -0.000 -3.321) 4.722 2.738 ( -1.151 0.000 0.683) 1.339 3.017 ( -0.998 0.000 5.132) 5.228 3.111 ( -2.074 0.000 -1.384) 2.493 3.273 ( -5.001 0.000 1.243) 5.153 3.285 ( -0.894 0.000 -3.084) 3.211 3.915 ( 2.517 -0.000 -2.218) 3.355 4.308 ( 8.509 -0.000 3.017) 9.028 5.395 ( -13.854 0.000 1.391) 13.924 5.526 ( -14.131 0.000 -5.318) 15.098 8.156 ( 9.763 -0.000 7.232) 12.150 9.628 ( -3.990 0.000 -10.127) 10.884 10.371 ( -6.418 0.000 -1.185) 6.526 10.617 ( 16.279 -0.000 12.208) 20.348 14.471 ( 11.024 -0.000 0.196) 11.025 14.576 ( 11.220 -0.000 2.824) 11.570 15.733 ( 8.103 -0.000 3.091) 8.673 15.888 ( -6.273 0.000 -4.993) 8.017 17.265 ( -2.628 0.000 -2.372) 3.540 17.364 ( 11.246 -0.000 3.054) 11.653 17.767 ( -5.391 0.000 0.606) 5.425 17.926 ( -10.536 0.000 -5.104) 11.707 ======================= Grid point 139 (60/306) ======================= q-point: (-0.60 0.30 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.151 ( 0.659 0.502 1.146) 1.414 1.270 ( -0.037 -0.046 -1.452) 1.454 1.659 ( -3.779 3.091 -6.099) 7.813 2.005 ( 13.249 6.461 5.344) 15.680 2.123 ( 2.248 0.596 -3.754) 4.416 2.367 ( -2.408 -1.364 0.318) 2.785 2.470 ( 3.571 2.141 -0.882) 4.256 2.585 ( 5.087 -0.670 -0.212) 5.135 2.687 ( 2.143 -2.615 -0.556) 3.426 2.782 ( -0.698 -4.875 3.526) 6.057 3.040 ( -2.526 2.212 4.188) 5.368 3.073 ( -2.055 -0.572 -0.881) 2.308 3.230 ( -4.591 -1.343 1.085) 4.905 3.284 ( 4.613 -0.794 -0.837) 4.756 3.943 ( 3.676 -0.491 0.196) 3.714 4.429 ( 7.261 0.934 1.693) 7.514 5.101 ( -12.949 11.503 -1.197) 17.362 5.426 ( -13.354 -12.101 -3.653) 18.388 8.377 ( 8.535 0.040 10.953) 13.886 9.452 ( -2.182 0.899 -11.099) 11.347 10.206 ( -5.147 7.656 -5.282) 10.631 10.985 ( 10.435 -7.117 12.551) 17.807 14.578 ( 9.711 5.045 2.964) 11.338 14.799 ( 9.922 -6.560 3.067) 12.284 15.709 ( -8.071 4.035 -5.797) 10.725 15.864 ( 8.988 2.734 4.158) 10.274 17.194 ( -1.606 0.125 -5.042) 5.293 17.520 ( 7.025 -2.750 -1.144) 7.631 17.643 ( -8.665 7.740 -1.059) 11.666 17.837 ( -4.469 -7.806 1.521) 9.122 ======================= Grid point 140 (61/306) ======================= q-point: (-0.50 0.30 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.143 ( -0.295 2.251 -0.068) 2.271 1.221 ( -3.175 4.064 -1.936) 5.509 1.513 ( -3.323 -0.577 -4.728) 5.808 2.045 ( 7.979 7.972 -1.931) 11.443 2.148 ( 6.947 6.000 0.904) 9.224 2.360 ( 1.104 -1.354 -3.950) 4.319 2.464 ( -0.780 3.643 2.019) 4.237 2.585 ( -0.719 2.784 1.915) 3.454 2.735 ( 1.134 -2.897 -2.603) 4.056 2.882 ( -2.550 -6.052 4.309) 7.855 2.987 ( -3.697 4.040 2.053) 5.848 3.067 ( -1.040 -2.480 -0.344) 2.711 3.228 ( -2.551 -3.650 0.743) 4.515 3.392 ( 7.255 -1.611 1.861) 7.661 4.023 ( 6.286 0.634 2.559) 6.817 4.450 ( -1.843 5.374 -1.383) 5.847 4.897 ( -0.814 1.382 0.549) 1.696 5.370 ( -13.125 -11.875 -3.529) 18.048 8.564 ( 3.735 2.920 10.526) 11.545 9.358 ( 1.277 -2.335 -5.531) 6.138 9.957 ( -3.674 11.758 -7.159) 14.248 11.289 ( 4.756 -8.069 7.595) 12.059 14.652 ( 6.404 5.889 3.988) 9.571 15.014 ( 6.124 -6.126 2.879) 9.128 15.483 ( -7.084 6.947 -4.696) 10.977 15.977 ( 9.182 4.195 3.241) 10.603 17.111 ( -0.913 0.278 -7.273) 7.335 17.409 ( -9.598 8.966 1.030) 13.174 17.582 ( 1.419 -3.464 -3.016) 4.807 17.972 ( 1.971 -9.779 2.946) 10.402 ======================= Grid point 141 (62/306) ======================= q-point: (-0.40 0.30 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.070 ( -3.201 8.702 -0.098) 9.273 1.092 ( -0.461 4.536 -0.473) 4.584 1.504 ( 0.757 -2.602 -0.203) 2.718 1.982 ( 8.077 11.293 -6.041) 15.142 2.154 ( 4.029 6.947 2.693) 8.470 2.332 ( -2.600 2.550 -2.338) 4.327 2.386 ( -1.465 4.172 0.724) 4.480 2.570 ( -2.236 2.734 4.012) 5.345 2.755 ( 3.029 -2.398 -2.490) 4.596 2.915 ( -3.878 2.258 1.815) 4.841 2.962 ( -2.235 -5.157 1.924) 5.941 3.091 ( -0.590 -2.940 0.120) 3.001 3.266 ( -0.849 -4.982 0.079) 5.054 3.489 ( 2.748 -0.188 1.000) 2.930 4.099 ( 5.619 6.141 1.775) 8.511 4.266 ( -7.239 4.039 -2.928) 8.792 5.060 ( 11.763 -8.951 3.184) 15.121 5.314 ( -13.196 -11.363 -2.955) 17.663 8.625 ( -1.585 5.892 9.827) 11.567 9.344 ( 0.141 -1.164 -12.270) 12.326 9.756 ( 2.197 10.011 4.941) 11.378 11.458 ( -0.519 -7.755 0.439) 7.785 14.659 ( 0.994 7.283 2.814) 7.871 15.155 ( 1.236 -5.078 2.022) 5.604 15.281 ( -2.438 9.262 -2.201) 9.827 16.040 ( 5.313 3.932 -0.746) 6.652 17.009 ( 0.881 3.795 -5.047) 6.375 17.236 ( -5.311 7.229 3.233) 9.535 17.612 ( 0.884 -3.797 -1.491) 4.174 18.145 ( 1.400 -10.974 0.205) 11.064 ======================= Grid point 142 (63/306) ======================= q-point: (-0.30 0.30 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.971 ( 2.067 9.893 3.790) 10.794 1.026 ( 1.223 6.815 1.659) 7.120 1.537 ( 0.471 1.381 0.738) 1.635 1.869 ( 9.258 11.811 -5.047) 15.833 2.107 ( -5.857 5.395 1.112) 8.040 2.201 ( -0.764 10.936 5.860) 12.431 2.385 ( 3.430 -0.646 -3.030) 4.622 2.550 ( -2.562 1.914 3.806) 4.971 2.819 ( 4.587 -2.941 -2.044) 5.819 2.857 ( -2.931 2.114 0.627) 3.668 3.009 ( -3.028 -5.914 0.071) 6.644 3.121 ( -0.233 -2.365 0.265) 2.392 3.325 ( -0.129 -5.419 -0.253) 5.427 3.472 ( -2.336 2.592 -1.567) 3.826 4.009 ( -2.389 5.005 -1.975) 5.887 4.218 ( 3.205 2.784 0.625) 4.291 5.254 ( -13.499 -10.500 -1.620) 17.179 5.408 ( 13.981 -12.773 4.035) 19.362 8.630 ( -6.023 5.394 12.728) 15.078 9.078 ( -0.096 9.167 -20.069) 22.064 9.886 ( 6.533 1.320 14.507) 15.965 11.469 ( -5.643 -6.262 -7.621) 11.364 14.554 ( -4.234 8.166 -0.191) 9.200 15.134 ( 2.026 10.566 -1.302) 10.837 15.248 ( -0.092 -4.509 2.534) 5.173 15.959 ( -4.618 4.767 -5.042) 8.336 16.965 ( 7.105 7.214 -0.642) 10.146 17.177 ( 0.129 3.248 4.821) 5.814 17.675 ( 2.436 -3.917 0.882) 4.697 18.266 ( -1.628 -10.847 -2.922) 11.352 ======================= Grid point 143 (64/306) ======================= q-point: (-0.20 0.30 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.920 ( 2.029 8.447 2.640) 9.080 1.005 ( 3.501 9.328 5.211) 11.244 1.456 ( -2.509 7.964 -1.393) 8.465 1.865 ( 14.475 8.984 -0.245) 17.038 1.960 ( -9.171 1.952 1.597) 9.512 2.170 ( 2.634 10.353 8.147) 13.435 2.397 ( 3.103 0.140 -2.940) 4.277 2.554 ( -1.216 0.182 3.479) 3.690 2.799 ( -2.143 1.511 -0.332) 2.642 2.872 ( 2.218 -1.426 -2.546) 3.665 3.040 ( -0.989 -5.351 -2.901) 6.166 3.148 ( -0.341 -1.807 0.630) 1.944 3.370 ( -2.579 1.452 -2.048) 3.599 3.386 ( -1.498 -4.203 -0.066) 4.462 3.938 ( -1.050 1.086 -0.966) 1.793 4.217 ( 4.293 5.404 -0.941) 6.966 5.207 ( -14.542 -12.038 0.372) 18.882 5.780 ( 12.323 -12.398 4.080) 17.951 8.554 ( -12.617 4.268 -0.758) 13.341 8.836 ( 7.536 10.901 -1.792) 13.372 10.120 ( 6.289 0.300 13.916) 15.275 11.299 ( -9.927 -1.976 -14.672) 17.825 14.379 ( -5.139 7.056 -2.530) 9.088 15.002 ( 4.935 14.256 -3.519) 15.491 15.354 ( -0.434 -7.949 3.518) 8.703 15.749 ( -8.278 5.746 -3.467) 10.656 16.947 ( 5.795 7.151 -0.879) 9.246 17.266 ( 5.779 0.913 6.254) 8.564 17.796 ( 5.402 -4.391 3.270) 7.691 18.300 ( -5.249 -9.042 -5.484) 11.806 ======================= Grid point 144 (65/306) ======================= q-point: (-0.10 0.30 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.883 ( 2.563 6.903 2.847) 7.895 0.975 ( 2.072 9.219 5.896) 11.138 1.298 ( -4.473 6.767 -1.163) 8.195 1.855 ( -7.109 -0.060 0.056) 7.110 1.974 ( 15.705 6.296 -1.395) 16.977 2.199 ( 4.965 9.865 12.807) 16.912 2.397 ( 2.961 0.332 -3.203) 4.375 2.584 ( -0.161 -0.346 2.965) 2.990 2.759 ( -1.045 1.167 -0.394) 1.615 2.861 ( 0.003 -0.425 -3.067) 3.096 3.026 ( -1.102 -1.443 -5.421) 5.717 3.170 ( -0.696 -1.256 0.620) 1.564 3.330 ( -1.560 -1.395 0.969) 2.306 3.425 ( -0.951 -3.809 -0.648) 3.979 3.917 ( -0.345 -0.505 -0.895) 1.084 4.164 ( 3.641 7.294 -3.291) 8.791 5.214 ( -14.304 -15.289 3.078) 21.162 6.075 ( 6.830 -9.153 2.365) 11.663 8.277 ( -6.150 5.898 -11.459) 14.280 8.908 ( 4.694 5.787 15.443) 17.146 10.322 ( 5.121 1.335 11.160) 12.351 10.976 ( -10.004 3.792 -17.357) 20.390 14.222 ( -2.695 4.451 -3.523) 6.284 14.829 ( 6.202 15.408 -6.529) 17.846 15.478 ( -3.559 -6.200 2.156) 7.467 15.612 ( -1.091 0.006 1.700) 2.020 16.937 ( 5.904 5.465 0.547) 8.064 17.370 ( 2.922 1.139 3.822) 4.944 17.978 ( 7.073 -4.967 3.622) 9.371 18.241 ( -8.122 -6.047 -6.604) 12.089 ======================= Grid point 149 (66/306) ======================= q-point: (-0.60 0.40 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.168 ( 0.398 -0.000 -0.092) 0.408 1.266 ( 0.824 -0.000 -0.609) 1.025 1.511 ( -7.186 0.000 -6.917) 9.974 2.146 ( 4.953 -0.000 -1.035) 5.060 2.246 ( 10.207 -0.000 -0.641) 10.227 2.328 ( -2.637 0.000 1.023) 2.828 2.523 ( 5.613 -0.000 -1.601) 5.837 2.642 ( 2.911 -0.000 -0.178) 2.916 2.663 ( -1.164 0.000 -0.534) 1.280 2.791 ( -2.220 0.000 5.952) 6.353 3.033 ( -1.821 0.000 -0.714) 1.956 3.053 ( -3.521 0.000 2.447) 4.288 3.173 ( -3.967 0.000 0.732) 4.034 3.367 ( 7.803 -0.000 1.227) 7.899 4.024 ( 7.695 -0.000 2.662) 8.142 4.533 ( 5.574 -0.000 0.891) 5.645 4.985 ( -17.344 0.000 -2.924) 17.589 5.147 ( -7.857 0.000 -2.706) 8.310 8.602 ( 4.885 -0.000 12.995) 13.883 9.326 ( 1.095 -0.000 -9.803) 9.864 10.123 ( -4.709 0.000 -6.579) 8.090 11.169 ( 5.797 -0.000 8.870) 10.596 14.754 ( 6.995 -0.000 2.904) 7.574 14.910 ( 7.745 -0.000 4.429) 8.922 15.573 ( -6.843 0.000 -5.395) 8.714 16.031 ( 7.951 -0.000 2.757) 8.416 17.113 ( 0.522 -0.000 -7.017) 7.037 17.536 ( 2.574 -0.000 -2.993) 3.947 17.569 ( -11.679 0.000 0.250) 11.682 17.802 ( 2.087 -0.000 4.083) 4.585 ======================= Grid point 151 (67/306) ======================= q-point: (-0.50 0.40 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.158 ( 0.259 1.153 -0.916) 1.495 1.242 ( -0.402 4.790 0.189) 4.811 1.427 ( -0.722 -2.943 -0.654) 3.099 2.173 ( 4.901 3.718 -2.018) 6.475 2.275 ( 4.094 2.487 -3.297) 5.815 2.318 ( 0.506 -0.199 -2.642) 2.697 2.546 ( 1.139 5.519 1.936) 5.958 2.629 ( -1.009 1.559 2.442) 3.068 2.688 ( 1.255 -2.856 -1.935) 3.671 2.833 ( -3.942 -3.351 4.633) 6.945 3.007 ( -2.353 2.640 0.618) 3.590 3.027 ( -1.065 -1.373 0.527) 1.815 3.163 ( -1.970 -3.021 0.507) 3.642 3.466 ( 3.753 -0.929 1.374) 4.103 4.172 ( 9.278 0.389 3.188) 9.818 4.484 ( -5.103 11.883 -2.279) 13.131 4.838 ( -3.183 -10.239 -1.064) 10.775 5.090 ( -5.806 -4.941 -1.102) 7.703 8.741 ( -2.550 2.855 11.709) 12.318 9.290 ( 4.004 -1.868 -5.746) 7.248 9.978 ( 0.419 5.859 -5.726) 8.203 11.296 ( -0.634 -4.230 2.911) 5.174 14.814 ( 2.226 4.584 2.922) 5.874 15.043 ( 1.996 -3.598 2.425) 4.776 15.449 ( -1.596 3.779 -1.982) 4.556 16.100 ( 3.417 1.045 -2.511) 4.367 17.081 ( 5.255 1.771 -2.808) 6.216 17.413 ( -8.514 5.797 2.290) 10.552 17.539 ( 1.894 -1.760 -2.621) 3.682 17.901 ( 0.082 -7.293 1.292) 7.407 ======================= Grid point 152 (68/306) ======================= q-point: (-0.40 0.40 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 552 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.132 ( 0.240 2.689 -0.429) 2.733 1.191 ( 2.482 6.947 3.207) 8.044 1.503 ( 3.066 -2.666 3.058) 5.085 2.113 ( 4.706 7.100 -6.953) 10.995 2.230 ( -3.260 3.427 -0.699) 4.781 2.303 ( 1.136 -0.380 -1.938) 2.278 2.490 ( 1.814 7.622 2.290) 8.163 2.610 ( -3.915 2.416 3.422) 5.733 2.733 ( 3.156 -3.591 -1.671) 5.064 2.870 ( -4.345 -4.103 2.667) 6.544 2.945 ( -1.611 3.477 -0.026) 3.832 3.058 ( 0.336 -2.605 0.562) 2.686 3.200 ( -0.478 -4.478 0.168) 4.507 3.494 ( -2.019 -0.353 -0.357) 2.081 4.184 ( -9.698 5.525 -2.171) 11.370 4.311 ( 9.685 7.740 1.497) 12.488 4.978 ( -6.254 -12.989 -2.103) 14.569 5.144 ( 8.002 -7.043 3.011) 11.077 8.742 ( -9.906 3.404 10.888) 15.109 9.259 ( 4.666 4.934 -9.337) 11.546 9.942 ( 7.045 2.883 2.695) 8.075 11.311 ( -6.180 -5.713 -3.774) 9.223 14.749 ( -4.100 7.317 0.577) 8.407 15.099 ( -2.854 -5.200 0.637) 5.965 15.404 ( 4.717 8.114 1.925) 9.581 16.034 ( -2.750 1.362 -6.991) 7.635 17.136 ( 10.850 6.000 1.935) 12.549 17.281 ( -5.339 5.161 2.914) 7.977 17.583 ( 3.069 -3.373 -0.510) 4.589 17.993 ( -2.821 -10.442 -1.785) 10.963 ======================= Grid point 153 (69/306) ======================= q-point: (-0.30 0.40 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.085 ( 0.145 4.505 0.167) 4.510 1.199 ( 3.760 6.431 4.444) 8.675 1.575 ( 0.809 2.323 1.557) 2.912 2.011 ( 1.949 4.436 -5.552) 7.370 2.096 ( -3.951 6.725 0.370) 7.808 2.305 ( 0.622 0.401 -0.086) 0.745 2.474 ( 5.344 6.295 1.395) 8.374 2.571 ( -4.497 0.854 3.870) 5.994 2.807 ( 3.819 -3.618 -2.098) 5.664 2.875 ( -2.206 2.307 2.047) 3.792 2.896 ( -2.245 -3.526 -2.104) 4.680 3.101 ( 0.715 -2.148 0.489) 2.316 3.258 ( -0.163 -5.022 0.110) 5.025 3.419 ( -5.510 1.027 -2.323) 6.067 4.018 ( -3.585 5.014 0.329) 6.173 4.352 ( 6.839 5.556 0.767) 8.845 4.955 ( -11.309 -7.894 -1.569) 13.880 5.467 ( 13.734 -12.587 3.462) 18.949 8.645 ( -15.526 2.957 6.186) 16.972 9.127 ( 8.375 11.951 -5.860) 15.726 10.105 ( 8.837 -1.667 7.336) 11.605 11.201 ( -10.135 -4.948 -9.551) 14.779 14.569 ( -7.126 8.053 -1.840) 10.910 15.146 ( -3.561 -7.007 2.195) 8.161 15.362 ( 6.408 12.411 -0.521) 13.978 15.871 ( -6.700 3.566 -4.783) 8.971 17.136 ( 3.709 7.961 -1.573) 8.923 17.309 ( 6.886 2.425 6.508) 9.780 17.688 ( 4.421 -4.259 2.512) 6.632 18.044 ( -5.103 -11.172 -4.290) 13.010 ======================= Grid point 154 (70/306) ======================= q-point: (-0.20 0.40 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 552 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.036 ( 0.818 5.007 0.657) 5.116 1.190 ( 0.859 7.467 3.678) 8.368 1.470 ( -5.473 6.897 -2.846) 9.253 1.867 ( -10.739 1.676 0.102) 10.869 2.101 ( 12.898 3.770 -3.349) 13.848 2.318 ( 0.454 0.321 3.251) 3.298 2.475 ( 4.711 5.195 0.031) 7.013 2.577 ( -2.359 -0.585 5.216) 5.754 2.827 ( 0.432 3.952 1.219) 4.158 2.845 ( 1.232 -0.903 -3.004) 3.370 2.922 ( -0.128 -6.257 -3.737) 7.289 3.136 ( 0.517 -1.439 0.404) 1.581 3.312 ( -1.914 -4.379 0.173) 4.783 3.333 ( -2.057 0.475 -0.222) 2.123 3.951 ( -1.205 3.439 1.015) 3.783 4.355 ( 5.970 7.177 -0.863) 9.375 4.892 ( -13.716 -9.427 0.189) 16.644 5.817 ( 11.830 -11.666 2.537) 16.807 8.429 ( -12.040 5.894 -2.190) 13.583 9.091 ( 5.970 8.942 5.998) 12.312 10.316 ( 8.522 -2.318 5.525) 10.418 10.985 ( -11.687 -1.998 -11.966) 16.845 14.364 ( -6.078 6.869 -2.600) 9.533 15.214 ( 4.173 8.507 -0.967) 9.525 15.256 ( -1.897 -2.874 -0.680) 3.510 15.708 ( -5.686 5.301 0.115) 7.774 17.083 ( 4.086 5.857 -0.524) 7.161 17.424 ( 6.702 3.136 3.754) 8.297 17.843 ( 3.684 -6.086 3.503) 7.930 18.050 ( -4.983 -8.783 -5.008) 11.272 ======================= Grid point 155 (71/306) ======================= q-point: (-0.10 0.40 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.999 ( 1.648 4.581 0.768) 4.928 1.140 ( -0.779 6.192 4.818) 7.884 1.273 ( -7.123 4.909 -2.409) 8.980 1.747 ( -7.110 -0.444 -1.000) 7.194 2.159 ( 8.880 2.459 -3.872) 9.995 2.380 ( 2.654 -0.089 2.341) 3.540 2.472 ( 3.870 3.338 -0.122) 5.113 2.630 ( -0.274 -0.163 5.945) 5.953 2.803 ( 0.840 4.017 1.902) 4.524 2.839 ( 2.283 0.501 -2.261) 3.252 2.923 ( -0.106 -2.801 -5.928) 6.558 3.160 ( 0.311 -0.814 0.609) 1.063 3.317 ( -1.491 -0.758 2.702) 3.178 3.357 ( -0.996 -3.647 -0.802) 3.865 3.914 ( -0.741 1.722 0.258) 1.893 4.297 ( 5.784 10.351 -3.064) 12.247 4.879 ( -14.442 -14.400 3.256) 20.653 6.073 ( 6.662 -7.404 0.495) 9.972 8.201 ( -5.223 7.026 -3.608) 9.469 9.169 ( 1.794 2.981 12.355) 12.835 10.457 ( 7.729 -2.257 -6.857) 10.576 10.745 ( -9.383 2.744 -2.492) 10.088 14.211 ( -2.647 4.453 -2.079) 5.583 15.040 ( 7.385 16.257 -7.111) 19.220 15.364 ( -5.145 -10.047 4.917) 12.312 15.618 ( -2.061 1.870 1.383) 3.108 17.085 ( 5.569 4.225 1.153) 7.085 17.474 ( 4.013 4.332 1.929) 6.213 17.938 ( -6.919 -9.848 -3.674) 12.584 18.070 ( 3.213 -2.313 0.380) 3.977 ======================= Grid point 161 (72/306) ======================= q-point: ( 0.50 -0.50 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 305 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.162 ( 0.496 0.000 -0.727) 0.880 1.293 ( 0.380 0.000 1.534) 1.580 1.455 ( 5.541 0.000 5.052) 7.498 2.219 ( 1.307 -0.000 -0.729) 1.497 2.227 ( 2.336 0.000 -11.462) 11.698 2.323 ( -1.711 0.000 1.858) 2.526 2.636 ( 0.819 -0.000 0.930) 1.239 2.639 ( -2.313 0.000 3.498) 4.194 2.659 ( 1.499 0.000 -1.943) 2.454 2.802 ( -3.799 0.000 2.557) 4.579 3.012 ( -1.917 0.000 0.452) 1.970 3.014 ( 0.559 -0.000 0.649) 0.857 3.129 ( -0.761 0.000 0.533) 0.929 3.485 ( -1.755 0.000 0.394) 1.799 4.225 ( -6.383 0.000 0.916) 6.448 4.594 ( -1.001 0.000 -1.427) 1.743 4.654 ( 6.864 -0.000 -1.245) 6.976 5.064 ( 2.351 0.000 1.907) 3.028 8.786 ( -11.825 0.000 9.732) 15.315 9.317 ( 7.668 0.000 -1.676) 7.849 9.988 ( 6.509 0.000 -5.812) 8.727 11.232 ( -6.742 0.000 -1.452) 6.897 14.874 ( -2.789 -0.000 2.606) 3.817 15.001 ( -4.770 0.000 -1.522) 5.007 15.512 ( 5.481 0.000 3.602) 6.559 16.045 ( -1.878 0.000 -8.399) 8.607 17.215 ( 10.296 0.000 4.961) 11.428 17.385 ( -4.812 0.000 1.424) 5.018 17.527 ( 3.005 0.000 -2.688) 4.032 17.833 ( -3.707 -0.000 -1.024) 3.846 ======================= Grid point 163 (73/306) ======================= q-point: (-0.40 0.50 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.148 ( -0.527 0.990 -0.714) 1.329 1.306 ( 0.664 2.057 2.958) 3.663 1.616 ( 7.648 1.172 6.328) 9.995 2.089 ( -1.339 1.621 -11.089) 11.286 2.209 ( -2.758 1.437 0.482) 3.147 2.307 ( -0.218 1.102 -0.019) 1.123 2.582 ( -7.872 0.116 0.837) 7.917 2.626 ( 3.084 5.030 1.257) 6.033 2.711 ( 1.912 -2.992 -0.264) 3.560 2.797 ( -2.058 -2.926 -0.417) 3.602 2.972 ( -1.371 2.945 0.349) 3.267 3.051 ( 1.358 -1.642 1.089) 2.393 3.153 ( 0.416 -2.873 0.223) 2.912 3.426 ( -6.023 -0.103 -1.383) 6.180 4.122 ( -8.239 2.292 3.575) 9.269 4.497 ( 0.891 5.371 -1.681) 5.698 4.824 ( 6.935 -3.068 -1.998) 7.842 5.202 ( 9.450 -7.251 3.578) 12.437 8.695 ( -17.076 1.048 8.918) 19.293 9.372 ( 9.030 6.386 -2.512) 11.342 10.048 ( 9.838 -2.166 -3.098) 10.539 11.101 ( -11.248 -2.461 -4.539) 12.377 14.765 ( -7.664 7.648 -0.122) 10.828 14.966 ( -6.552 -7.253 -0.132) 9.775 15.612 ( 7.608 6.382 4.267) 10.809 15.911 ( -3.645 -0.014 -7.998) 8.789 17.298 ( -4.579 3.286 2.127) 6.024 17.406 ( 13.046 6.413 3.829) 15.033 17.589 ( 5.423 -4.123 0.527) 6.833 17.791 ( -6.458 -7.697 -3.476) 10.632 ======================= Grid point 164 (74/306) ======================= q-point: (-0.30 0.50 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.113 ( -1.259 1.412 -0.521) 1.963 1.320 ( 0.281 2.940 3.414) 4.514 1.643 ( -1.763 7.363 -1.207) 7.667 1.926 ( -9.238 1.595 -4.390) 10.352 2.173 ( 4.477 2.706 -0.046) 5.231 2.303 ( 1.363 -0.532 -1.360) 1.998 2.508 ( -6.903 -3.269 0.619) 7.663 2.616 ( 2.847 3.950 0.268) 4.876 2.769 ( -0.505 -4.818 -0.225) 4.849 2.810 ( 1.344 -2.056 -1.659) 2.964 2.926 ( -0.925 3.223 1.150) 3.544 3.100 ( 1.421 -1.385 0.947) 2.199 3.201 ( 0.309 -3.665 -0.077) 3.679 3.352 ( -3.164 0.455 0.248) 3.206 4.060 ( -3.678 4.258 4.738) 7.356 4.440 ( -2.972 -0.473 -0.889) 3.138 4.840 ( 3.649 5.339 -2.488) 6.929 5.516 ( 13.210 -12.217 2.795) 18.209 8.546 ( -17.117 3.378 8.057) 19.217 9.332 ( 7.121 9.786 -3.253) 12.532 10.202 ( 10.069 -6.343 -3.090) 12.295 10.927 ( -12.685 -1.997 -4.016) 13.455 14.551 ( -8.511 8.185 -1.218) 11.871 14.995 ( -7.526 -9.723 2.228) 12.496 15.583 ( 5.491 12.110 -3.945) 13.870 15.817 ( -2.546 2.607 0.610) 3.695 17.216 ( -0.492 4.829 -0.445) 4.875 17.514 ( 9.272 3.996 2.459) 10.391 17.684 ( -5.410 -6.345 0.327) 8.344 17.840 ( 5.026 -7.678 -0.807) 9.213 ======================= Grid point 165 (75/306) ======================= q-point: (-0.20 0.50 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.076 ( -1.435 1.227 -0.020) 1.888 1.291 ( -2.756 5.603 2.789) 6.838 1.430 ( -8.443 7.511 -5.242) 12.457 1.746 ( -9.864 0.775 -0.616) 9.913 2.196 ( 5.380 0.741 -5.671) 7.852 2.356 ( 3.748 -1.290 2.287) 4.577 2.503 ( -2.537 -2.788 0.741) 3.841 2.615 ( 1.596 0.791 0.471) 1.842 2.793 ( -1.969 -4.686 -2.454) 5.644 2.847 ( 1.429 -0.951 0.342) 1.750 2.908 ( 1.729 2.638 1.958) 3.713 3.141 ( 1.479 -0.871 0.794) 1.892 3.243 ( -0.473 -3.537 -0.325) 3.584 3.344 ( 0.538 1.080 2.059) 2.386 4.007 ( -2.252 5.150 2.553) 6.173 4.423 ( -4.952 -4.269 1.603) 6.732 4.755 ( 1.947 8.438 -2.792) 9.099 5.843 ( 11.589 -10.976 1.125) 16.001 8.377 ( -12.071 6.646 6.256) 15.133 9.268 ( 0.958 4.943 -0.030) 5.035 10.328 ( 8.052 -7.485 -13.028) 17.046 10.788 ( -9.233 0.873 5.170) 10.618 14.351 ( -6.460 6.797 -0.645) 9.399 15.071 ( -7.674 -12.136 4.329) 14.997 15.418 ( 4.301 13.248 -6.491) 15.367 15.751 ( -1.729 7.218 2.228) 7.750 17.172 ( 1.676 2.995 -0.143) 3.435 17.576 ( 2.434 2.160 0.896) 3.376 17.688 ( -3.817 -8.666 -2.615) 9.823 18.003 ( 7.260 -2.887 1.865) 8.033 ======================= Grid point 166 (76/306) ======================= q-point: (-0.10 -0.50 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.051 ( -0.722 0.940 0.526) 1.297 1.177 ( -8.670 2.805 -0.555) 9.129 1.235 ( -3.437 4.028 1.227) 5.435 1.666 ( -3.086 -0.492 -0.507) 3.165 2.188 ( 3.331 -1.208 -5.382) 6.444 2.420 ( 2.025 -0.181 0.300) 2.055 2.500 ( 0.263 0.151 -1.607) 1.636 2.635 ( -1.774 -1.674 -0.040) 2.440 2.799 ( -1.159 -3.560 -1.416) 4.003 2.868 ( 0.662 0.221 0.421) 0.815 2.941 ( 3.665 2.584 3.253) 5.540 3.177 ( 1.202 -0.691 1.017) 1.719 3.266 ( -1.484 -3.045 -1.029) 3.540 3.366 ( 1.095 1.617 2.450) 3.133 3.942 ( -1.646 3.714 0.981) 4.180 4.441 ( -0.599 0.124 1.283) 1.421 4.656 ( -2.065 2.455 -0.016) 3.208 6.068 ( 6.654 -6.235 -1.215) 9.199 8.241 ( -4.954 7.814 5.420) 10.723 9.244 ( -5.766 -2.640 3.856) 7.422 10.279 ( 4.926 -4.884 -21.877) 22.951 10.817 ( -1.698 2.281 13.757) 14.048 14.224 ( -2.668 4.247 0.753) 5.071 15.184 ( -4.330 -8.151 3.261) 9.789 15.256 ( 3.097 8.180 -3.167) 9.302 15.653 ( -1.896 6.380 0.369) 6.666 17.170 ( 1.013 0.787 0.275) 1.312 17.558 ( -4.397 -3.288 -1.441) 5.676 17.741 ( 4.677 -0.681 -1.038) 4.839 18.107 ( 3.317 -0.897 0.392) 3.459 ======================= Grid point 173 (77/306) ======================= q-point: (-0.40 -0.40 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.127 ( -2.131 0.000 -1.067) 2.383 1.351 ( -0.371 0.000 3.827) 3.845 1.779 ( 3.578 -0.000 3.894) 5.288 1.909 ( -7.428 0.000 -11.805) 13.947 2.221 ( 1.412 -0.000 3.041) 3.353 2.321 ( 0.622 -0.000 0.405) 0.742 2.426 ( -12.635 0.000 -3.896) 13.222 2.662 ( 0.169 -0.000 -2.119) 2.126 2.739 ( -1.159 0.000 -2.065) 2.367 2.755 ( 2.921 -0.000 3.311) 4.415 2.970 ( -2.585 0.000 0.503) 2.634 3.077 ( 2.189 -0.000 1.100) 2.449 3.156 ( 2.374 -0.000 0.136) 2.378 3.357 ( -3.169 0.000 0.765) 3.260 4.116 ( -5.968 0.000 8.102) 10.062 4.423 ( -6.775 0.000 -4.630) 8.206 4.979 ( 15.869 -0.000 -2.927) 16.137 5.306 ( 10.250 -0.000 3.980) 10.996 8.588 ( -18.872 0.000 12.161) 22.450 9.484 ( 7.236 -0.000 -6.516) 9.738 10.091 ( 10.297 -0.000 -7.378) 12.667 10.901 ( -12.808 0.000 -0.452) 12.816 14.760 ( -9.781 0.000 3.249) 10.307 14.767 ( -8.414 0.000 -2.410) 8.752 15.778 ( -2.779 0.000 -7.488) 7.987 15.813 ( 7.520 -0.000 5.246) 9.168 17.291 ( -3.031 0.000 1.103) 3.225 17.582 ( -7.926 0.000 -5.428) 9.607 17.596 ( 3.519 -0.000 -0.047) 3.520 17.715 ( 14.561 -0.000 5.626) 15.610 ======================= Grid point 174 (78/306) ======================= q-point: (-0.30 -0.40 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.078 ( -3.696 -0.369 -1.202) 3.904 1.380 ( -1.462 1.518 3.996) 4.517 1.618 ( -9.659 6.491 -8.108) 14.183 1.773 ( -9.107 0.271 -2.044) 9.338 2.205 ( -5.704 0.525 -5.430) 7.893 2.331 ( 4.757 -0.601 2.265) 5.303 2.381 ( 0.022 -4.915 3.106) 5.815 2.637 ( 0.050 -0.092 -2.674) 2.676 2.709 ( -0.917 -0.925 -1.323) 1.856 2.822 ( 0.841 -1.005 2.421) 2.753 2.945 ( -1.768 0.496 1.330) 2.267 3.113 ( 1.093 -0.966 0.183) 1.470 3.200 ( 3.536 -0.272 0.336) 3.562 3.363 ( 0.841 0.343 2.493) 2.654 4.123 ( -4.589 3.411 6.991) 9.031 4.297 ( -8.333 -3.553 -2.847) 9.495 5.048 ( 12.941 11.111 -3.400) 17.392 5.562 ( 12.907 -10.234 2.007) 16.594 8.499 ( -17.603 2.771 15.891) 23.876 9.387 ( 0.812 3.608 -13.698) 14.188 10.151 ( 8.967 -5.143 -11.350) 15.352 10.796 ( -9.335 0.002 7.120) 11.741 14.543 ( -8.921 8.713 0.673) 12.488 14.788 ( -9.484 -10.620 3.257) 14.606 15.649 ( -1.173 4.925 -5.220) 7.272 15.912 ( 4.176 4.382 2.680) 6.620 17.244 ( -1.317 2.866 -0.935) 3.290 17.439 ( -11.447 -6.554 -3.893) 13.753 17.669 ( 8.450 1.220 0.526) 8.554 17.946 ( 11.473 -1.323 3.796) 12.157 ======================= Grid point 175 (79/306) ======================= q-point: (-0.20 -0.40 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 552 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.026 ( -5.033 -1.997 -0.821) 5.476 1.268 ( -12.562 3.474 -3.898) 13.604 1.391 ( -4.294 7.865 -0.097) 8.961 1.646 ( -5.214 -0.797 -0.053) 5.275 2.120 ( -2.913 -4.621 -5.662) 7.868 2.373 ( -1.124 -3.065 -0.538) 3.309 2.510 ( 5.281 1.123 3.569) 6.472 2.610 ( -0.480 -0.597 -1.939) 2.085 2.712 ( -0.448 -2.619 -0.463) 2.697 2.847 ( -1.822 -1.456 0.678) 2.429 2.956 ( -0.089 -0.991 2.748) 2.923 3.128 ( -0.340 -1.900 -1.269) 2.310 3.251 ( 3.952 0.821 0.863) 4.127 3.404 ( 2.137 1.125 2.512) 3.485 4.051 ( -3.878 4.308 0.241) 5.802 4.275 ( -8.272 -6.257 5.268) 11.633 4.988 ( 11.468 15.947 -3.730) 19.994 5.860 ( 11.653 -10.212 -0.585) 15.505 8.428 ( -12.494 6.597 15.624) 21.065 9.188 ( -6.679 -1.976 -11.288) 13.264 10.153 ( 6.562 -4.471 -16.903) 18.675 10.829 ( -4.026 -0.733 12.529) 13.180 14.361 ( -6.645 6.863 1.988) 9.758 14.865 ( -9.014 -12.614 5.666) 16.507 15.516 ( 0.611 7.966 -3.769) 8.834 15.866 ( 0.475 8.968 -0.520) 8.995 17.182 ( -2.962 0.434 -1.633) 3.410 17.370 ( -7.875 -8.113 -3.455) 11.822 17.786 ( 10.446 1.216 1.841) 10.677 18.099 ( 7.087 0.359 1.293) 7.213 ======================= Grid point 176 (80/306) ======================= q-point: (-0.10 -0.40 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.982 ( -6.537 -3.777 -1.681) 7.735 1.069 ( -8.591 -0.992 -1.249) 8.738 1.257 ( -4.612 4.158 2.051) 6.540 1.654 ( 2.145 -0.607 0.359) 2.257 2.095 ( -1.396 -5.048 -6.252) 8.156 2.375 ( -4.563 -4.385 -1.184) 6.439 2.527 ( 3.278 3.558 -2.202) 5.316 2.577 ( -4.496 0.256 -0.357) 4.517 2.742 ( -1.317 -3.109 0.135) 3.379 2.846 ( -1.144 -1.877 0.019) 2.198 3.034 ( 2.217 -1.913 5.137) 5.913 3.130 ( -0.893 -2.597 -1.641) 3.200 3.287 ( 3.178 2.391 0.659) 4.032 3.433 ( 1.582 2.051 1.967) 3.252 3.970 ( -1.990 2.828 0.316) 3.472 4.329 ( -7.699 -7.310 6.598) 12.500 4.884 ( 11.749 17.135 -3.019) 20.994 6.056 ( 6.827 -5.444 -3.228) 9.309 8.371 ( -4.977 7.874 10.389) 13.954 9.065 ( -11.887 -8.275 -0.698) 14.500 10.069 ( 5.501 -2.839 -19.397) 20.361 10.970 ( 0.246 -1.939 13.892) 14.029 14.262 ( -3.145 3.856 3.408) 6.031 14.992 ( -8.575 -14.250 6.703) 17.930 15.393 ( 3.479 9.484 -3.143) 10.580 15.722 ( -1.832 9.102 -2.299) 9.565 17.125 ( -5.708 -2.747 -1.275) 6.462 17.355 ( -3.861 -7.165 -3.996) 9.067 17.928 ( 12.411 3.447 2.704) 13.161 18.135 ( 1.330 2.013 -1.440) 2.810 ======================= Grid point 184 (81/306) ======================= q-point: (-0.30 -0.30 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 305 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.995 ( -6.185 0.000 -1.797) 6.440 1.315 ( -14.094 0.000 -4.648) 14.840 1.520 ( 0.156 -0.000 1.389) 1.397 1.641 ( -10.117 0.000 -3.048) 10.566 2.025 ( -9.271 0.000 -3.185) 9.803 2.328 ( -0.551 0.000 -1.510) 1.607 2.528 ( 9.154 -0.000 7.042) 11.550 2.601 ( -1.157 0.000 -1.795) 2.135 2.687 ( 1.508 -0.000 -2.377) 2.815 2.818 ( -4.635 0.000 1.221) 4.793 2.937 ( -1.565 0.000 1.321) 2.048 3.107 ( 1.035 -0.000 -1.969) 2.225 3.265 ( 4.408 -0.000 1.649) 4.707 3.417 ( 2.263 -0.000 2.704) 3.526 4.123 ( -6.417 0.000 -4.768) 7.995 4.184 ( -5.752 0.000 9.581) 11.175 5.259 ( 13.445 -0.000 -4.204) 14.087 5.664 ( 13.318 -0.000 0.238) 13.320 8.520 ( -17.099 0.000 23.427) 29.003 9.158 ( -5.510 0.000 -22.289) 22.960 10.093 ( 7.667 -0.000 -13.147) 15.219 10.814 ( -5.665 0.000 11.468) 12.791 14.528 ( -8.793 0.000 0.777) 8.828 14.625 ( -9.115 0.000 7.165) 11.594 15.619 ( -1.239 0.000 -2.406) 2.706 15.994 ( 1.509 -0.000 -0.896) 1.755 17.201 ( -11.218 0.000 -3.569) 11.772 17.243 ( 0.125 -0.000 -2.551) 2.554 17.793 ( 9.140 -0.000 1.683) 9.294 18.108 ( 9.437 -0.000 2.003) 9.648 ======================= Grid point 185 (82/306) ======================= q-point: (-0.20 -0.30 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.896 ( -8.490 -2.292 -1.829) 8.982 1.059 ( -14.841 0.051 -5.234) 15.737 1.415 ( -9.251 6.844 -1.293) 11.579 1.611 ( 2.557 -2.669 2.148) 4.275 1.951 ( -5.914 -5.069 -0.446) 7.802 2.276 ( -6.498 -2.614 -4.014) 8.073 2.565 ( -0.876 0.334 -2.343) 2.523 2.655 ( 1.141 4.526 0.756) 4.728 2.689 ( 0.939 -1.161 -0.505) 1.576 2.781 ( -1.033 -3.239 2.492) 4.215 2.952 ( -0.818 -2.634 2.281) 3.579 3.107 ( 2.215 -0.220 -1.707) 2.805 3.331 ( 3.692 0.969 1.855) 4.244 3.467 ( 2.158 0.678 1.923) 2.969 4.017 ( -3.099 0.876 -2.089) 3.838 4.220 ( -6.576 -1.774 8.438) 10.844 5.286 ( 12.573 12.790 -3.620) 18.297 5.873 ( 12.178 -7.823 -3.229) 14.830 8.558 ( -12.444 6.295 20.838) 25.073 8.874 ( -9.556 -6.364 -13.769) 17.928 10.028 ( 5.418 -0.537 -14.591) 15.573 10.893 ( -3.974 -2.795 11.149) 12.162 14.390 ( -7.206 5.938 3.479) 9.965 14.683 ( -8.342 -9.867 7.556) 14.968 15.569 ( 0.113 4.216 -0.750) 4.284 15.925 ( -2.377 5.254 -3.845) 6.931 17.056 ( -8.703 -1.928 -2.415) 9.235 17.229 ( 0.774 -2.795 -4.580) 5.421 17.941 ( 9.907 -0.791 2.753) 10.313 18.203 ( 5.906 2.093 -0.561) 6.291 ======================= Grid point 186 (83/306) ======================= q-point: (-0.10 -0.30 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.795 ( -9.516 -4.474 -3.720) 11.154 0.892 ( -11.589 -6.021 0.031) 13.060 1.241 ( -6.850 1.866 -0.265) 7.105 1.701 ( 5.521 -0.620 0.205) 5.560 1.919 ( -7.259 -3.615 -6.201) 10.209 2.153 ( -14.256 -8.718 -2.468) 16.891 2.519 ( -1.820 0.761 -1.189) 2.303 2.569 ( -2.069 2.083 -1.675) 3.380 2.721 ( 2.807 0.461 0.185) 2.851 2.848 ( 1.438 -0.188 2.080) 2.535 3.050 ( 1.008 -5.447 4.050) 6.862 3.128 ( 3.130 0.258 0.054) 3.141 3.361 ( 1.777 2.603 0.726) 3.234 3.493 ( 1.537 1.582 1.325) 2.573 3.973 ( -0.828 0.842 -0.038) 1.181 4.253 ( -6.735 -3.449 6.794) 10.169 5.221 ( 12.737 16.333 -2.513) 20.864 6.029 ( 7.279 -4.883 -6.289) 10.788 8.464 ( -4.346 4.312 -2.555) 6.634 8.858 ( -12.610 -7.690 16.231) 21.946 9.918 ( 2.648 0.907 -14.299) 14.570 11.055 ( 0.070 -8.246 11.729) 14.338 14.305 ( -4.504 2.991 4.549) 7.065 14.797 ( -8.237 -11.722 6.892) 15.898 15.508 ( 2.309 6.496 -0.355) 6.903 15.753 ( -3.767 7.350 -4.833) 9.569 16.972 ( -7.309 -3.864 -1.268) 8.364 17.222 ( 0.807 -3.784 -6.740) 7.771 18.103 ( 5.893 -1.169 2.094) 6.362 18.192 ( 6.040 5.644 -2.129) 8.536 ======================= Grid point 195 (84/306) ======================= q-point: (-0.20 -0.20 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.737 ( -11.636 0.000 -1.187) 11.697 0.811 ( -15.005 0.000 -4.727) 15.732 1.285 ( -12.276 0.000 -2.668) 12.563 1.681 ( 5.945 -0.000 1.723) 6.190 1.886 ( -4.348 0.000 5.198) 6.776 2.009 ( -19.946 0.000 -11.275) 22.912 2.534 ( -0.554 0.000 -2.207) 2.276 2.590 ( -4.630 0.000 -1.239) 4.793 2.729 ( 4.243 -0.000 -0.462) 4.268 2.895 ( 6.070 -0.000 6.775) 9.097 2.931 ( -1.435 0.000 1.072) 1.791 3.131 ( 3.101 -0.000 -0.206) 3.107 3.395 ( 2.323 -0.000 1.470) 2.749 3.512 ( 1.577 -0.000 0.990) 1.862 3.982 ( -0.783 0.000 -0.724) 1.067 4.213 ( -6.811 0.000 6.880) 9.681 5.487 ( 11.071 -0.000 -2.523) 11.355 5.914 ( 12.246 -0.000 -7.808) 14.524 8.528 ( -6.195 0.000 -16.806) 17.911 8.749 ( -12.684 0.000 29.032) 31.682 9.950 ( 2.157 -0.000 -7.255) 7.569 10.909 ( -5.526 0.000 7.217) 9.089 14.371 ( -8.138 0.000 3.608) 8.901 14.619 ( -6.219 0.000 8.542) 10.566 15.603 ( 1.044 -0.000 0.616) 1.212 15.852 ( -5.617 0.000 -5.104) 7.589 16.932 ( -5.460 0.000 -1.971) 5.805 17.164 ( 2.209 -0.000 -8.095) 8.391 18.081 ( 8.762 -0.000 2.862) 9.217 18.264 ( 4.110 -0.000 -2.706) 4.921 ======================= Grid point 196 (85/306) ======================= q-point: (-0.10 -0.20 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.573 ( -12.698 -2.581 -2.520) 13.201 0.649 ( -14.360 -7.777 1.511) 16.400 1.117 ( -10.622 -1.790 -2.007) 10.957 1.561 ( -26.810 -1.691 -13.792) 30.197 1.764 ( 5.596 -0.747 -1.643) 5.880 1.954 ( -3.809 -5.503 6.680) 9.456 2.503 ( -0.265 0.500 -1.637) 1.732 2.554 ( -2.252 0.778 2.478) 3.437 2.783 ( 5.106 0.223 -0.495) 5.135 2.896 ( -0.635 2.799 1.379) 3.184 3.051 ( 2.847 -3.539 2.528) 5.198 3.184 ( 3.468 -0.532 2.922) 4.566 3.406 ( 0.031 2.476 -0.220) 2.486 3.534 ( 1.192 0.080 0.654) 1.362 3.976 ( 0.189 0.182 0.064) 0.270 4.204 ( -6.360 -1.857 4.638) 8.087 5.517 ( 10.376 10.891 -1.545) 15.122 5.972 ( 7.691 -4.065 -11.533) 14.446 8.329 ( -3.589 -1.649 -8.929) 9.764 8.907 ( -8.400 -2.222 19.443) 21.296 9.908 ( -4.021 8.838 8.834) 13.127 11.014 ( -0.676 -16.082 8.428) 18.169 14.307 ( -6.700 0.751 3.918) 7.798 14.671 ( -5.964 -5.740 6.371) 10.445 15.601 ( 2.025 3.977 0.258) 4.471 15.704 ( -5.205 3.219 -5.018) 7.914 16.857 ( -4.173 -0.144 -1.790) 4.543 17.101 ( 2.350 -3.050 -12.409) 12.992 18.151 ( -0.198 6.009 -1.921) 6.312 18.304 ( 9.663 -3.743 -1.237) 10.436 ======================= Grid point 206 (86/306) ======================= q-point: (-0.10 -0.10 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 305 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.383 ( -15.521 0.000 1.717) 15.616 0.427 ( -16.934 0.000 8.152) 18.794 0.844 ( -25.056 0.000 -10.839) 27.300 1.120 ( -18.163 0.000 -1.851) 18.257 1.790 ( 3.452 -0.000 -2.739) 4.407 1.981 ( -0.899 0.000 6.639) 6.700 2.487 ( 0.338 -0.000 -1.551) 1.588 2.618 ( -0.363 0.000 13.087) 13.092 2.830 ( 4.642 -0.000 -2.329) 5.194 2.913 ( -1.464 0.000 1.321) 1.972 3.087 ( 2.651 -0.000 0.679) 2.737 3.264 ( 3.275 -0.000 4.370) 5.461 3.411 ( -1.014 0.000 -2.417) 2.621 3.537 ( 0.049 -0.000 -0.118) 0.128 3.982 ( 0.486 -0.000 0.039) 0.487 4.152 ( -5.405 0.000 1.963) 5.751 5.687 ( 6.732 -0.000 -0.003) 6.732 5.868 ( 3.890 -0.000 -13.335) 13.890 8.219 ( -1.650 0.000 -2.151) 2.711 8.926 ( -3.626 0.000 0.507) 3.662 10.396 ( 0.890 -0.000 69.678) 69.683 10.844 ( -4.575 0.000 -0.735) 4.634 14.257 ( -6.898 0.000 2.881) 7.476 14.634 ( -4.582 0.000 4.030) 6.102 15.616 ( -3.893 0.000 -3.462) 5.210 15.648 ( 2.148 -0.000 -1.467) 2.601 16.820 ( -1.153 0.000 -1.183) 1.652 16.885 ( -0.929 0.000 -26.741) 26.757 18.189 ( 0.744 -0.000 -12.579) 12.601 18.302 ( 4.650 -0.000 1.307) 4.831 ======================= Grid point 207 (87/306) ======================= q-point: ( 0.00 0.00 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.601 ( 5.168 -0.000 13.451) 14.409 0.616 ( -2.862 0.000 12.708) 13.026 0.931 ( 3.997 -0.000 3.761) 5.488 1.343 ( 6.570 -0.000 26.436) 27.240 1.698 ( 0.741 -0.000 -1.795) 1.942 2.026 ( -6.225 0.000 -0.355) 6.235 2.402 ( 2.940 -0.000 -7.159) 7.739 2.698 ( -4.897 0.000 -4.628) 6.738 2.775 ( 0.762 -0.000 -0.686) 1.025 2.935 ( -0.363 0.000 1.227) 1.280 3.066 ( -1.304 0.000 -2.241) 2.593 3.215 ( -1.031 0.000 -3.032) 3.202 3.406 ( -0.170 0.000 1.980) 1.987 3.522 ( 0.122 -0.000 -0.837) 0.846 3.968 ( 0.029 -0.000 -0.945) 0.946 3.992 ( -2.500 0.000 -3.591) 4.375 5.848 ( 0.053 -0.000 2.897) 2.897 6.366 ( 10.687 -0.000 -3.587) 11.273 8.387 ( -8.741 0.000 -14.286) 16.747 8.658 ( 1.870 -0.000 20.010) 20.097 10.459 ( 2.028 -0.000 -14.625) 14.765 10.807 ( -36.056 0.000 7.913) 36.914 14.153 ( -3.874 0.000 -1.820) 4.281 14.378 ( -3.594 0.000 -8.729) 9.440 15.552 ( 5.568 -0.000 0.080) 5.569 15.597 ( -4.309 0.000 -1.894) 4.707 16.834 ( 1.282 -0.000 1.890) 2.284 17.363 ( 14.318 -0.000 1.003) 14.353 17.942 ( 10.798 -0.000 2.897) 11.180 18.314 ( -1.848 0.000 -2.271) 2.928 ======================= Grid point 208 (88/306) ======================= q-point: ( 0.10 0.00 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.712 ( 1.317 0.007 8.762) 8.861 0.825 ( 0.429 -5.770 12.507) 13.780 1.094 ( 6.516 -2.849 5.575) 9.036 1.667 ( 9.429 2.230 6.805) 11.840 1.822 ( 7.907 -9.351 13.102) 17.934 1.925 ( -8.504 -1.012 -2.190) 8.839 2.351 ( 4.007 0.845 -8.439) 9.380 2.601 ( -2.496 0.693 -2.343) 3.492 2.775 ( -0.392 0.626 0.541) 0.916 2.925 ( -1.591 2.572 0.016) 3.024 3.003 ( -3.822 -1.951 -3.019) 5.247 3.184 ( 0.077 -0.067 -1.674) 1.677 3.414 ( -0.610 0.888 0.969) 1.449 3.506 ( -0.639 0.355 -1.281) 1.474 3.934 ( -0.501 -0.273 -3.223) 3.273 3.961 ( 0.083 -0.589 -1.380) 1.502 5.826 ( -4.278 5.502 3.218) 7.676 6.342 ( 1.544 5.810 -4.364) 7.429 8.123 ( -9.594 0.699 -8.695) 12.967 8.945 ( 3.574 -1.846 23.343) 23.687 10.301 ( 4.674 2.736 -11.529) 12.737 10.673 ( -17.141 -10.265 4.069) 20.390 14.106 ( -0.553 -0.701 -3.474) 3.587 14.286 ( 0.156 -5.724 -8.987) 10.656 15.531 ( -3.312 -0.172 -1.461) 3.624 15.658 ( 8.205 -0.873 1.517) 8.390 16.865 ( 1.577 1.716 3.004) 3.802 17.421 ( 1.558 2.347 0.556) 2.871 18.076 ( 9.558 4.060 0.807) 10.416 18.275 ( -3.253 -3.487 -4.874) 6.819 ======================= Grid point 209 (89/306) ======================= q-point: ( 0.20 0.00 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 552 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.837 ( 2.990 -2.205 6.048) 7.098 1.027 ( -0.407 -5.775 11.113) 12.530 1.212 ( 2.678 1.116 3.453) 4.510 1.794 ( -9.084 -1.899 -4.108) 10.149 1.861 ( 10.811 -4.325 5.089) 12.707 2.184 ( 11.657 -6.317 4.442) 13.983 2.319 ( 4.135 -0.696 -3.177) 5.261 2.573 ( 0.818 -1.673 -2.161) 2.853 2.752 ( -2.101 1.705 0.518) 2.755 2.837 ( -3.904 0.880 -2.753) 4.858 2.975 ( -1.951 -0.121 0.167) 1.962 3.176 ( 0.483 -0.135 -0.796) 0.941 3.389 ( -1.276 1.595 -0.137) 2.047 3.476 ( -1.809 0.538 -0.206) 1.898 3.909 ( 0.387 -0.544 -2.319) 2.413 3.967 ( 1.517 -1.775 -1.290) 2.667 5.663 ( -9.727 12.651 3.477) 16.332 6.232 ( -0.832 3.954 -3.778) 5.532 7.980 ( -5.331 -2.614 -2.229) 6.342 9.284 ( 4.436 -0.866 24.789) 25.197 10.217 ( 6.600 -2.160 -19.381) 20.587 10.654 ( -8.982 -6.569 4.086) 11.855 14.075 ( 1.208 -0.908 -3.825) 4.113 14.343 ( 5.556 -11.293 -6.867) 14.337 15.492 ( -2.147 -0.516 -0.178) 2.215 15.778 ( 7.218 2.095 2.266) 7.850 16.915 ( 3.310 -0.010 3.726) 4.984 17.413 ( -0.476 0.651 0.655) 1.039 18.114 ( 2.608 2.260 -0.023) 3.451 18.184 ( -3.413 1.442 -6.100) 7.137 ======================= Grid point 210 (90/306) ======================= q-point: ( 0.30 0.00 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.959 ( 3.185 -1.526 4.559) 5.767 1.186 ( -2.535 -4.425 6.579) 8.324 1.246 ( 3.031 3.500 5.410) 7.121 1.668 ( -6.747 -2.223 -4.586) 8.456 2.088 ( 9.362 -0.758 2.430) 9.702 2.281 ( 6.949 -3.466 -6.647) 10.222 2.436 ( 3.017 -2.238 0.634) 3.810 2.611 ( 4.239 -3.913 -3.463) 6.729 2.715 ( -4.206 -2.623 -1.073) 5.072 2.798 ( 0.839 -0.892 2.310) 2.615 2.946 ( -1.354 2.632 1.240) 3.210 3.182 ( 0.466 -0.448 0.349) 0.734 3.360 ( -1.582 0.079 0.436) 1.643 3.435 ( -3.105 1.732 0.430) 3.581 3.900 ( 0.434 -0.004 -0.809) 0.918 4.028 ( 4.042 -4.978 -1.115) 6.508 5.371 ( -13.226 16.539 3.474) 21.460 6.149 ( -0.745 1.445 -3.791) 4.125 8.005 ( -1.493 -5.679 4.688) 7.514 9.566 ( -0.125 3.582 21.343) 21.642 10.059 ( 5.329 -0.720 -25.283) 25.848 10.729 ( -0.908 -7.254 6.076) 9.506 14.090 ( 2.917 -2.156 -1.280) 3.847 14.528 ( 9.233 -13.639 -5.087) 17.238 15.488 ( -0.964 -0.939 1.265) 1.847 15.802 ( 1.608 7.470 2.123) 7.931 17.042 ( 6.578 -3.085 3.932) 8.261 17.414 ( -0.129 -1.723 -0.363) 1.766 17.993 ( -7.670 4.014 -6.069) 10.572 18.130 ( 2.006 2.021 -0.816) 2.962 ======================= Grid point 211 (91/306) ======================= q-point: (-0.60 0.00 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 552 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.049 ( 2.169 -0.539 2.992) 3.735 1.180 ( -2.264 3.344 1.225) 4.220 1.352 ( 1.552 1.277 8.843) 9.069 1.593 ( -2.352 -2.644 -3.887) 5.257 2.117 ( 4.363 3.735 -6.989) 9.046 2.343 ( 2.652 -2.760 -2.682) 4.674 2.462 ( 1.105 -1.186 -1.208) 2.021 2.619 ( -2.613 -0.460 -2.912) 3.939 2.753 ( 5.126 -5.926 -1.870) 8.055 2.905 ( 1.798 0.371 3.545) 3.992 2.919 ( 0.927 -1.582 2.492) 3.094 3.209 ( 0.339 -0.977 1.987) 2.240 3.324 ( -3.911 2.065 -1.645) 4.719 3.393 ( -2.316 -0.336 2.759) 3.617 3.907 ( 0.214 -0.727 0.560) 0.942 4.169 ( 7.247 -8.299 -0.840) 11.050 5.038 ( -13.144 15.846 3.675) 20.914 6.088 ( -0.717 0.206 -4.120) 4.187 8.164 ( 0.321 -6.957 9.839) 12.055 9.598 ( -11.194 7.101 9.601) 16.367 9.869 ( 9.299 2.842 -21.652) 23.735 10.938 ( 4.892 -7.687 9.344) 13.051 14.167 ( 3.562 -2.602 2.163) 4.913 14.778 ( 10.602 -13.728 -3.519) 17.698 15.513 ( -0.314 -0.767 2.375) 2.516 15.685 ( -4.542 10.737 1.309) 11.731 17.177 ( 3.199 -0.550 1.556) 3.600 17.483 ( 4.840 -6.454 0.043) 8.068 17.762 ( -6.821 6.380 -6.125) 11.169 18.117 ( -0.373 0.254 -0.843) 0.956 ======================= Grid point 212 (92/306) ======================= q-point: (-0.50 0.00 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.047 ( -2.717 4.845 -0.288) 5.563 1.136 ( -0.426 2.044 1.862) 2.798 1.403 ( -1.031 5.979 6.934) 9.214 1.588 ( 1.965 -3.065 -3.412) 4.989 1.996 ( -0.671 2.606 -10.352) 10.696 2.378 ( 2.973 -2.887 -3.172) 5.219 2.452 ( -1.147 1.938 -0.687) 2.355 2.568 ( -3.040 -0.286 0.616) 3.115 2.826 ( -0.267 -0.696 -1.357) 1.548 2.893 ( -0.328 2.878 3.101) 4.243 3.046 ( 2.953 -3.491 1.518) 4.818 3.213 ( -2.522 0.748 -1.764) 3.167 3.259 ( 1.023 -0.013 2.671) 2.860 3.421 ( -1.109 -1.962 2.334) 3.244 3.934 ( -0.114 -1.570 1.425) 2.124 4.381 ( 8.006 -9.720 -0.892) 12.624 4.778 ( -7.628 9.337 4.357) 12.820 6.031 ( -0.934 -0.287 -4.620) 4.722 8.350 ( -0.311 -4.367 8.447) 9.514 9.448 ( -11.846 5.414 9.363) 16.041 9.706 ( 6.611 4.448 -19.266) 20.849 11.203 ( 6.937 -4.122 10.409) 13.171 14.276 ( 2.523 -1.997 4.916) 5.875 15.036 ( 9.824 -12.106 -2.177) 15.742 15.459 ( -8.393 13.205 3.502) 16.034 15.558 ( -0.307 -2.012 -0.445) 2.084 17.166 ( -1.468 2.173 -1.553) 3.048 17.457 ( -7.446 8.039 -4.450) 11.827 17.749 ( 9.369 -9.665 -2.186) 13.637 18.105 ( -0.311 -0.393 0.288) 0.578 ======================= Grid point 213 (93/306) ======================= q-point: (-0.40 0.00 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 552 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.906 ( -4.777 8.535 -0.220) 9.784 1.096 ( -5.664 3.364 1.326) 6.720 1.331 ( -2.236 8.686 1.406) 9.079 1.629 ( 3.607 -3.114 -3.519) 5.924 1.824 ( -6.139 3.418 -6.863) 9.822 2.360 ( -5.947 5.919 0.360) 8.399 2.405 ( 2.856 -2.476 -4.734) 6.057 2.568 ( -3.060 -0.611 3.898) 4.993 2.746 ( -2.621 3.035 -0.586) 4.053 2.902 ( -0.535 0.773 1.980) 2.192 3.066 ( 1.079 -0.149 -2.179) 2.436 3.250 ( 3.840 -2.193 0.469) 4.447 3.306 ( 0.290 0.151 4.120) 4.133 3.459 ( -0.042 -2.702 0.839) 2.829 3.965 ( -0.142 -0.963 1.280) 1.608 4.429 ( -6.228 2.112 -0.039) 6.577 4.864 ( 11.644 -10.183 3.448) 15.848 5.967 ( -1.400 -0.095 -4.988) 5.182 8.405 ( -1.697 1.884 1.841) 3.133 9.364 ( -7.511 10.276 4.345) 13.450 9.596 ( 1.058 -8.173 -2.180) 8.525 11.419 ( 7.602 1.061 8.943) 11.786 14.371 ( -0.171 -0.614 6.136) 6.169 15.187 ( -8.450 7.566 0.777) 11.368 15.283 ( 5.493 -4.944 0.060) 7.391 15.577 ( 0.387 -0.921 -0.057) 1.001 17.083 ( -2.140 3.809 -2.033) 4.819 17.196 ( -7.506 8.201 -6.834) 13.050 17.909 ( 1.011 -8.668 -4.681) 9.903 18.171 ( 7.862 -1.542 2.464) 8.382 ======================= Grid point 214 (94/306) ======================= q-point: (-0.30 0.00 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.735 ( -6.700 9.242 2.858) 11.768 0.921 ( -13.121 6.449 -0.284) 14.623 1.190 ( -3.080 7.769 -2.550) 8.737 1.537 ( -14.354 7.754 -0.363) 16.318 1.713 ( 4.083 0.433 -2.121) 4.621 2.197 ( -7.360 6.385 2.315) 10.015 2.412 ( 2.510 -1.871 -4.609) 5.572 2.582 ( -2.291 -1.573 3.871) 4.766 2.748 ( 3.597 -1.169 -0.703) 3.847 2.899 ( -1.638 0.138 1.531) 2.246 3.066 ( 2.284 0.094 -2.078) 3.089 3.303 ( 1.195 -1.519 -1.066) 2.207 3.350 ( 0.040 1.159 4.802) 4.940 3.506 ( 0.994 -3.020 -0.148) 3.183 3.979 ( -0.053 0.013 0.448) 0.452 4.305 ( -7.457 1.969 -0.865) 7.761 5.228 ( 15.164 -12.846 3.693) 20.214 5.891 ( -1.920 0.576 -4.030) 4.501 8.358 ( -0.894 4.675 2.438) 5.348 9.112 ( -4.158 9.084 -10.625) 14.584 9.845 ( -5.757 -16.452 18.527) 25.437 11.571 ( 9.392 4.980 6.882) 12.664 14.407 ( -4.154 1.294 5.496) 7.010 14.949 ( -10.003 9.085 0.553) 13.524 15.431 ( 2.687 -6.650 -0.506) 7.190 15.600 ( 3.965 1.282 0.937) 4.271 16.918 ( -8.854 7.555 -7.176) 13.674 16.991 ( 0.218 4.470 -3.109) 5.450 17.919 ( -4.279 -6.050 -3.863) 8.357 18.335 ( 11.303 -1.028 -0.387) 11.356 ======================= Grid point 215 (95/306) ======================= q-point: (-0.20 0.00 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 552 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.585 ( -11.098 6.734 4.838) 13.853 0.640 ( -14.095 8.207 2.795) 16.548 1.021 ( -6.532 7.354 2.079) 10.054 1.256 ( -13.355 13.874 8.422) 21.018 1.735 ( 3.382 0.747 -2.361) 4.192 2.109 ( -4.284 1.661 3.296) 5.655 2.419 ( 2.663 -1.750 -3.900) 5.037 2.651 ( -0.711 -6.196 3.051) 6.943 2.787 ( 3.389 -0.032 -2.456) 4.185 2.908 ( -0.908 -1.499 1.674) 2.424 3.072 ( 2.298 0.301 -1.617) 2.826 3.299 ( -0.844 -0.520 -2.088) 2.311 3.378 ( -1.062 0.560 3.290) 3.502 3.541 ( 0.981 -1.234 -1.136) 1.943 3.977 ( 0.008 0.068 -0.358) 0.365 4.184 ( -5.943 1.338 -2.173) 6.468 5.604 ( 14.392 -9.197 3.894) 17.518 5.853 ( 0.544 -1.618 1.953) 2.593 8.353 ( 0.446 3.768 7.205) 8.143 8.846 ( -4.304 5.078 -11.417) 13.216 10.187 ( -9.181 -22.532 14.346) 28.245 11.671 ( 7.008 4.607 -0.460) 8.399 14.354 ( -7.535 2.846 3.284) 8.698 14.739 ( -8.138 5.759 -2.151) 10.199 15.498 ( -0.062 -3.797 -0.592) 3.844 15.673 ( 6.454 2.685 3.119) 7.654 16.660 ( -5.967 5.133 -3.143) 8.475 16.928 ( 3.502 6.042 0.154) 6.986 17.890 ( -4.719 -4.270 -2.546) 6.854 18.427 ( 8.881 3.364 -4.021) 10.313 ======================= Grid point 216 (96/306) ======================= q-point: (-0.10 0.00 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.429 ( -2.125 5.478 11.124) 12.580 0.560 ( -6.467 4.446 12.762) 14.982 0.935 ( -3.307 3.613 3.466) 6.000 1.113 ( -6.659 9.894 20.902) 24.065 1.723 ( 1.646 1.506 -2.531) 3.374 2.083 ( -3.998 0.143 1.613) 4.313 2.426 ( 2.598 -1.037 -4.599) 5.383 2.739 ( -1.115 -6.474 -2.249) 6.943 2.791 ( 0.918 -0.777 -2.848) 3.092 2.928 ( -0.435 -0.607 0.389) 0.842 3.079 ( 1.498 0.238 -0.947) 1.788 3.261 ( -1.075 0.095 -2.517) 2.738 3.388 ( -1.362 -0.076 2.431) 2.788 3.534 ( 0.252 0.675 -1.235) 1.430 3.974 ( 0.079 -0.349 -0.780) 0.858 4.077 ( -4.187 1.125 -2.906) 5.219 5.783 ( 3.076 -2.033 2.067) 4.227 6.116 ( 16.498 -8.913 5.122) 19.439 8.442 ( 1.089 -0.428 10.748) 10.812 8.634 ( -4.570 2.174 -9.748) 10.983 10.433 ( -6.740 -20.110 -0.911) 21.229 11.416 ( -23.953 12.056 -13.849) 30.181 14.246 ( -7.167 2.223 0.478) 7.519 14.545 ( -6.427 3.381 -6.089) 9.476 15.520 ( 2.363 0.347 -1.486) 2.813 15.679 ( -3.003 2.031 -1.216) 3.824 16.740 ( 5.625 -6.881 5.887) 10.661 17.006 ( 20.289 4.408 9.397) 22.790 17.862 ( -2.077 -1.334 0.333) 2.491 18.388 ( 2.933 6.315 -3.921) 7.990 ======================= Grid point 218 (97/306) ======================= q-point: ( 0.10 0.10 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 305 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.847 ( 3.370 -0.000 8.105) 8.778 0.902 ( 1.339 -0.000 9.467) 9.562 1.263 ( 8.142 -0.000 7.270) 10.915 1.745 ( -6.728 0.000 -0.301) 6.735 1.801 ( 0.930 -0.000 1.988) 2.194 2.092 ( 14.676 -0.000 10.815) 18.231 2.322 ( 5.531 -0.000 -8.420) 10.075 2.552 ( -0.894 0.000 -2.593) 2.743 2.786 ( -1.032 0.000 1.596) 1.901 2.847 ( -7.382 0.000 -5.531) 9.224 2.964 ( -0.251 0.000 2.123) 2.137 3.174 ( 0.474 -0.000 -0.989) 1.097 3.415 ( -1.697 0.000 0.805) 1.878 3.473 ( -1.489 0.000 -2.539) 2.944 3.890 ( 0.548 -0.000 -3.262) 3.308 3.966 ( 1.808 -0.000 -0.128) 1.813 5.836 ( -5.991 0.000 3.001) 6.701 6.279 ( -6.158 0.000 -5.797) 8.457 7.957 ( -7.386 0.000 -1.844) 7.613 9.273 ( 6.743 -0.000 25.984) 26.845 10.180 ( 5.413 -0.000 -20.282) 20.991 10.558 ( -7.783 0.000 7.607) 10.883 14.101 ( 4.728 -0.000 -2.715) 5.452 14.162 ( 2.755 -0.000 -8.207) 8.657 15.495 ( -0.344 0.000 -1.202) 1.251 15.786 ( 9.575 -0.000 1.856) 9.753 16.930 ( 1.855 -0.000 3.415) 3.886 17.427 ( -1.979 0.000 0.186) 1.988 18.145 ( -6.030 0.000 -3.332) 6.889 18.192 ( 5.652 -0.000 -2.883) 6.344 ======================= Grid point 219 (98/306) ======================= q-point: ( 0.20 0.10 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.968 ( 5.097 2.338 7.423) 9.303 1.064 ( 2.480 -4.933 8.387) 10.042 1.388 ( 6.505 5.990 5.332) 10.326 1.608 ( -7.377 -2.134 -5.131) 9.236 1.977 ( 7.830 -5.724 7.906) 12.513 2.282 ( 8.520 2.523 -6.780) 11.177 2.356 ( 5.723 -3.356 2.806) 7.203 2.533 ( 2.665 -2.073 -4.758) 5.835 2.691 ( -7.888 0.318 -2.845) 8.392 2.787 ( -1.603 -0.322 0.998) 1.916 2.985 ( -0.400 0.654 2.741) 2.846 3.169 ( 0.148 -0.310 -0.880) 0.945 3.381 ( -2.227 1.636 -0.484) 2.806 3.433 ( -2.707 -1.523 -1.185) 3.325 3.877 ( 1.189 -0.936 -2.350) 2.795 4.003 ( 4.372 0.777 0.927) 4.536 5.715 ( -9.708 9.551 2.522) 13.850 6.127 ( -8.439 -2.398 -5.425) 10.315 7.920 ( -2.476 -1.455 5.086) 5.841 9.639 ( 4.873 1.791 25.039) 25.572 10.030 ( 8.011 -0.842 -22.240) 23.654 10.571 ( -3.655 -4.313 3.272) 6.532 14.098 ( 6.157 2.990 -2.823) 7.404 14.247 ( 8.570 -8.884 -3.570) 12.849 15.494 ( 2.058 0.812 -0.027) 2.212 15.903 ( 6.499 1.194 0.722) 6.647 17.004 ( 4.299 -0.211 4.040) 5.904 17.396 ( -2.533 -0.070 -0.347) 2.557 18.030 ( -6.851 0.021 -3.414) 7.654 18.181 ( 0.565 1.434 -3.724) 4.031 ======================= Grid point 220 (99/306) ======================= q-point: ( 0.30 0.10 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.063 ( 2.910 1.446 4.720) 5.731 1.233 ( 3.465 -0.148 6.701) 7.545 1.433 ( 5.893 5.372 5.046) 9.437 1.528 ( -1.170 -1.621 -3.962) 4.438 2.229 ( 6.007 1.501 5.147) 8.052 2.247 ( 6.749 -2.260 -8.671) 11.218 2.400 ( -0.107 -2.863 -4.788) 5.580 2.572 ( 2.530 -3.455 -3.836) 5.749 2.628 ( -2.251 -3.110 1.799) 4.240 2.808 ( 0.174 -2.998 2.408) 3.849 2.991 ( -0.397 2.575 2.751) 3.789 3.170 ( -0.936 -1.571 0.110) 1.831 3.332 ( -2.376 0.110 -0.994) 2.578 3.400 ( -4.001 -0.366 0.213) 4.024 3.888 ( 1.112 -1.317 -1.058) 2.022 4.081 ( 7.447 0.405 1.429) 7.594 5.431 ( -13.262 15.106 1.498) 20.157 6.025 ( -7.537 -5.242 -4.531) 10.238 8.037 ( 1.307 -3.307 11.268) 11.816 9.710 ( -5.564 1.478 -6.995) 9.060 10.003 ( 11.585 8.465 -0.490) 14.356 10.698 ( 2.657 -11.044 6.321) 13.000 14.148 ( 7.636 1.189 0.676) 7.758 14.469 ( 11.447 -10.840 -1.526) 15.839 15.523 ( 3.815 1.581 1.118) 4.278 15.900 ( -0.781 5.574 -0.661) 5.667 17.141 ( 7.364 -1.897 3.700) 8.457 17.369 ( -1.183 -2.277 -1.505) 2.975 17.885 ( -7.199 3.064 -4.150) 8.857 18.117 ( -2.742 -0.021 -2.708) 3.853 ======================= Grid point 221 (100/306) ======================= q-point: (-0.60 0.10 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.109 ( 1.058 1.367 2.224) 2.817 1.259 ( 0.313 5.066 1.682) 5.347 1.517 ( 2.628 -0.885 -3.391) 4.380 1.543 ( 7.602 4.882 7.681) 11.859 2.091 ( -0.455 4.588 -11.962) 12.820 2.329 ( 2.606 -0.582 -1.637) 3.132 2.442 ( 1.967 -2.924 -0.626) 3.579 2.569 ( -1.192 -0.273 -0.406) 1.289 2.724 ( 4.277 -5.940 -0.672) 7.350 2.915 ( 1.561 -5.407 3.070) 6.411 2.984 ( 0.711 2.783 3.158) 4.269 3.187 ( -3.767 -2.547 2.381) 5.133 3.278 ( -2.069 0.776 -2.585) 3.401 3.371 ( -3.553 -1.600 2.161) 4.456 3.912 ( 1.000 -0.904 0.494) 1.436 4.213 ( 9.590 -2.529 0.999) 9.968 5.091 ( -12.883 14.378 1.187) 19.342 5.955 ( -7.156 -5.787 -4.255) 10.139 8.251 ( 2.409 -3.266 14.266) 14.832 9.512 ( -4.052 0.497 -11.424) 12.131 9.933 ( 3.110 12.739 -4.639) 13.910 11.013 ( 7.409 -10.780 11.240) 17.247 14.259 ( 7.413 0.697 3.928) 8.418 14.745 ( 11.758 -11.117 0.041) 16.181 15.567 ( 4.692 2.390 1.018) 5.363 15.746 ( -6.815 9.280 -0.657) 11.533 17.210 ( 0.099 1.470 -1.214) 1.909 17.467 ( 7.190 -7.850 -0.203) 10.647 17.686 ( -7.204 5.715 -4.817) 10.381 18.072 ( -3.209 -2.174 -0.542) 3.914 ======================= Grid point 222 (101/306) ======================= q-point: (-0.50 0.10 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.089 ( -1.751 4.551 0.823) 4.945 1.195 ( -1.237 5.610 -0.196) 5.748 1.526 ( 0.951 -0.289 -1.763) 2.024 1.603 ( 6.129 8.045 1.141) 10.177 1.911 ( 0.270 3.763 -8.557) 9.351 2.345 ( 2.676 -1.862 -3.919) 5.098 2.456 ( -1.317 1.585 0.313) 2.084 2.559 ( -1.388 0.342 2.729) 3.081 2.791 ( -0.679 -1.490 -1.437) 2.179 2.947 ( -1.244 2.564 2.119) 3.552 3.045 ( -0.245 -1.663 1.256) 2.098 3.165 ( -0.767 -2.726 -0.506) 2.877 3.294 ( 2.573 -1.919 2.590) 4.124 3.389 ( -2.899 -3.128 2.311) 4.850 3.944 ( 0.948 -0.482 1.582) 1.906 4.380 ( 6.308 -4.447 -0.508) 7.735 4.839 ( -4.999 7.276 2.145) 9.085 5.892 ( -7.189 -5.821 -4.147) 10.137 8.435 ( 0.777 0.700 10.406) 10.458 9.418 ( -0.688 -4.051 -1.992) 4.566 9.699 ( -1.561 13.656 -8.628) 16.229 11.336 ( 7.127 -7.075 9.630) 13.913 14.383 ( 5.229 1.476 5.880) 8.006 15.018 ( 9.388 -9.786 1.189) 13.613 15.483 ( -8.768 9.241 -2.752) 13.033 15.630 ( 4.835 4.902 2.853) 7.453 17.145 ( -1.374 1.619 -4.487) 4.964 17.417 ( -8.581 8.942 -3.138) 12.785 17.678 ( 4.591 -9.339 -3.599) 11.011 18.102 ( 1.624 -3.915 2.134) 4.745 ======================= Grid point 223 (102/306) ======================= q-point: (-0.40 0.10 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.981 ( -3.598 9.023 1.692) 9.860 1.059 ( -7.794 5.445 -2.745) 9.897 1.444 ( 0.591 10.665 -2.502) 10.971 1.588 ( 3.576 -0.688 -5.152) 6.309 1.831 ( 2.086 7.081 1.665) 7.567 2.350 ( -0.873 0.431 -3.322) 3.461 2.370 ( -2.963 3.329 -0.619) 4.499 2.582 ( -2.914 0.665 5.080) 5.894 2.739 ( -0.558 0.963 -1.412) 1.798 2.920 ( -1.731 1.564 1.368) 2.704 3.057 ( 1.475 -0.967 -1.252) 2.163 3.221 ( 0.229 -4.309 0.091) 4.316 3.388 ( 3.036 -0.089 3.816) 4.878 3.414 ( -1.795 -3.371 0.356) 3.836 3.975 ( 0.448 -0.026 1.390) 1.460 4.357 ( -6.525 2.076 -2.616) 7.330 4.948 ( 12.710 -8.316 4.019) 15.711 5.829 ( -7.398 -5.501 -3.514) 9.866 8.480 ( -0.082 5.123 5.742) 7.696 9.360 ( -2.385 8.235 -17.365) 19.366 9.579 ( -1.354 -4.160 15.942) 16.532 11.563 ( 5.337 -4.250 4.868) 8.381 14.464 ( 1.346 3.223 6.057) 6.992 15.175 ( -4.895 5.263 -1.024) 7.261 15.268 ( -0.584 -2.848 0.460) 2.944 15.682 ( 8.626 4.896 2.273) 10.176 17.031 ( -2.694 1.880 -9.971) 10.498 17.172 ( -7.566 9.759 1.497) 12.439 17.755 ( -1.223 -7.125 -3.602) 8.076 18.247 ( 7.314 -5.571 1.295) 9.285 ======================= Grid point 224 (103/306) ======================= q-point: (-0.30 0.10 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.803 ( -9.458 9.517 0.572) 13.429 0.865 ( -5.595 9.073 3.634) 11.262 1.274 ( 1.614 12.789 -3.735) 13.420 1.553 ( -1.867 5.416 0.883) 5.796 1.807 ( 3.774 7.553 3.912) 9.306 2.199 ( -7.748 5.688 1.778) 9.775 2.369 ( 2.510 -2.076 -4.227) 5.336 2.578 ( -2.999 0.014 3.638) 4.715 2.766 ( 3.948 -1.610 -1.343) 4.470 2.894 ( -2.241 0.493 1.089) 2.540 3.075 ( 2.301 -0.302 -1.484) 2.755 3.261 ( -1.178 -2.935 -0.202) 3.169 3.405 ( -1.051 1.226 0.985) 1.892 3.468 ( 0.527 -3.648 0.387) 3.706 3.980 ( -0.550 0.290 0.016) 0.622 4.219 ( -5.866 1.703 -2.520) 6.608 5.319 ( 16.215 -12.431 4.489) 20.919 5.773 ( -7.284 -5.453 -1.403) 9.207 8.479 ( 1.522 6.232 6.253) 8.959 9.019 ( -6.554 8.370 -13.935) 17.528 9.832 ( -1.229 -8.294 15.942) 18.013 11.671 ( 1.555 -3.193 -2.431) 4.304 14.456 ( -3.549 5.246 4.155) 7.575 14.936 ( -7.384 9.601 -3.147) 12.514 15.374 ( 0.417 -5.764 1.874) 6.075 15.767 ( 8.930 4.632 2.264) 10.311 16.809 ( -5.515 5.747 -7.673) 11.059 17.062 ( -0.220 5.777 2.662) 6.365 17.776 ( -2.184 -5.082 -1.587) 5.754 18.403 ( 7.317 -4.661 -2.399) 9.001 ======================= Grid point 225 (104/306) ======================= q-point: (-0.20 0.10 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.634 ( -2.276 9.943 7.543) 12.686 0.764 ( -3.870 10.088 9.702) 14.521 1.118 ( 2.019 11.265 0.370) 11.451 1.443 ( -2.119 12.563 6.498) 14.302 1.811 ( 3.498 6.489 3.293) 8.073 2.098 ( -5.450 1.509 2.295) 6.103 2.380 ( 2.589 -2.235 -4.591) 5.725 2.599 ( -2.190 -2.789 2.383) 4.273 2.792 ( 2.177 0.149 -2.996) 3.707 2.894 ( -0.913 -1.608 1.048) 2.125 3.086 ( 1.670 0.132 -1.311) 2.127 3.256 ( -1.669 -0.987 -1.689) 2.571 3.384 ( -1.957 0.012 0.902) 2.155 3.507 ( -0.336 -2.829 -0.706) 2.935 3.964 ( -0.840 -0.327 -0.932) 1.297 4.117 ( -3.069 1.983 -2.494) 4.424 5.667 ( 4.967 -7.905 1.524) 9.460 5.827 ( 4.559 -12.058 4.827) 13.765 8.490 ( 3.558 4.929 -0.938) 6.151 8.730 ( -9.894 5.372 -0.278) 11.261 10.070 ( -1.309 -8.432 10.989) 13.913 11.574 ( -9.153 1.058 -12.292) 15.362 14.347 ( -6.436 5.782 0.822) 8.690 14.702 ( -4.587 8.930 -5.458) 11.427 15.469 ( 1.974 -4.334 1.884) 5.121 15.770 ( -1.708 4.732 -1.494) 5.248 16.693 ( 2.859 2.842 1.830) 4.427 17.083 ( 6.929 2.638 4.734) 8.797 17.805 ( -0.115 -3.211 0.782) 3.307 18.468 ( 4.251 -1.281 -6.131) 7.570 ======================= Grid point 226 (105/306) ======================= q-point: (-0.10 0.10 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.644 ( 1.164 6.319 9.489) 11.460 0.744 ( -0.340 7.270 12.854) 14.771 1.069 ( 4.127 8.988 3.871) 10.621 1.430 ( 6.699 6.701 12.438) 15.636 1.800 ( 2.534 8.067 4.843) 9.745 2.037 ( -5.943 0.683 0.295) 5.989 2.378 ( 2.752 -1.774 -6.643) 7.406 2.625 ( -2.606 -3.296 -0.105) 4.203 2.777 ( 0.505 -0.160 -1.871) 1.944 2.910 ( -0.829 -1.673 0.156) 1.873 3.076 ( -0.689 0.459 -1.799) 1.980 3.216 ( -1.352 -0.014 -2.551) 2.888 3.390 ( -0.790 -1.290 1.695) 2.272 3.515 ( -0.496 -1.187 -1.089) 1.686 3.951 ( -0.481 -0.908 -1.274) 1.637 4.028 ( -1.696 2.590 -3.142) 4.411 5.757 ( -3.389 -7.053 2.943) 8.360 6.165 ( 10.012 -13.277 1.301) 16.680 8.341 ( -5.658 -0.076 -13.607) 14.737 8.731 ( -1.496 4.498 19.767) 20.328 10.241 ( 0.880 -7.027 2.775) 7.606 11.140 ( -20.977 12.795 -11.909) 27.305 14.203 ( -4.877 3.906 -2.116) 6.598 14.479 ( -2.257 7.964 -7.985) 11.502 15.564 ( 5.159 -1.173 0.986) 5.382 15.629 ( -6.227 3.311 -1.878) 7.299 16.779 ( 2.928 -2.205 3.294) 4.928 17.276 ( 10.696 -3.569 4.733) 12.229 17.893 ( 6.112 -2.808 3.159) 7.431 18.408 ( -0.086 2.816 -6.973) 7.521 ======================= Grid point 229 (106/306) ======================= q-point: ( 0.20 0.20 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.092 ( 0.262 -0.000 5.571) 5.577 1.213 ( 8.421 -0.000 8.115) 11.694 1.480 ( -0.032 0.000 -3.232) 3.232 1.566 ( 7.230 -0.000 2.325) 7.595 2.122 ( 10.573 -0.000 4.175) 11.367 2.332 ( 4.930 -0.000 -1.117) 5.055 2.364 ( -2.778 0.000 -4.935) 5.663 2.495 ( 4.111 -0.000 -5.942) 7.225 2.596 ( -4.128 0.000 1.980) 4.579 2.774 ( -1.890 0.000 1.016) 2.146 3.025 ( -0.067 0.000 3.763) 3.763 3.150 ( -0.727 0.000 -1.558) 1.719 3.348 ( -2.960 0.000 -3.062) 4.259 3.376 ( -3.184 0.000 1.182) 3.397 3.869 ( 1.456 -0.000 -1.271) 1.933 4.099 ( 7.283 -0.000 1.948) 7.539 5.692 ( -10.162 0.000 2.039) 10.364 5.890 ( -13.356 0.000 -6.223) 14.735 7.997 ( 1.321 -0.000 11.699) 11.774 9.717 ( -1.836 0.000 -14.176) 14.295 10.177 ( 16.820 -0.000 16.364) 23.466 10.496 ( -3.764 0.000 -2.111) 4.316 14.208 ( 9.630 -0.000 -1.619) 9.765 14.287 ( 11.256 -0.000 0.954) 11.296 15.553 ( 5.494 -0.000 0.776) 5.548 15.961 ( 1.718 -0.000 -1.903) 2.564 17.115 ( 7.177 -0.000 4.064) 8.247 17.347 ( -3.232 0.000 -1.850) 3.724 17.918 ( -6.396 0.000 -2.010) 6.705 18.119 ( -4.115 0.000 -4.515) 6.109 ======================= Grid point 230 (107/306) ======================= q-point: ( 0.30 0.20 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.136 ( 0.165 0.713 3.063) 3.149 1.288 ( -1.316 -1.162 -0.693) 1.887 1.590 ( 11.405 4.611 2.047) 12.471 1.642 ( 8.961 2.292 3.716) 9.968 2.184 ( -1.243 2.910 -10.873) 11.324 2.301 ( 7.267 -6.013 -7.531) 12.069 2.387 ( 2.731 4.040 5.570) 7.403 2.515 ( -1.333 -4.299 2.826) 5.315 2.622 ( 2.422 -1.696 0.773) 3.056 2.790 ( -0.803 -3.241 3.010) 4.495 3.053 ( 0.226 2.295 3.043) 3.818 3.130 ( -1.663 -1.724 -0.111) 2.398 3.280 ( -2.743 -0.093 -2.363) 3.621 3.347 ( -4.252 -0.627 0.833) 4.378 3.885 ( 1.529 -0.768 -0.002) 1.711 4.216 ( 8.900 1.009 1.813) 9.139 5.442 ( -13.734 13.325 -0.804) 19.153 5.755 ( -12.130 -10.069 -4.006) 16.265 8.197 ( 3.743 -1.084 16.784) 17.230 9.508 ( -0.531 -0.306 -18.968) 18.978 10.278 ( 0.727 14.094 -0.506) 14.122 10.702 ( 9.347 -13.364 13.634) 21.257 14.312 ( 10.769 3.317 2.519) 11.546 14.510 ( 12.464 -7.245 2.077) 14.565 15.637 ( 7.788 2.269 1.509) 8.251 15.893 ( -4.625 2.672 -3.789) 6.549 17.243 ( 2.740 1.460 -0.441) 3.136 17.308 ( 3.786 -4.271 -1.055) 5.804 17.810 ( -5.863 3.414 -1.396) 6.927 18.012 ( -6.768 -2.140 -2.779) 7.623 ======================= Grid point 231 (108/306) ======================= q-point: (-0.60 0.20 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 552 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.148 ( -0.135 1.126 1.001) 1.512 1.271 ( -1.360 -0.445 -1.131) 1.824 1.566 ( 2.436 4.948 -4.288) 6.986 1.814 ( 11.209 6.966 5.258) 14.206 2.010 ( 1.065 4.059 -8.793) 9.743 2.332 ( 3.373 0.298 -5.025) 6.060 2.431 ( 1.686 -2.744 0.426) 3.249 2.579 ( 0.700 0.448 2.356) 2.498 2.700 ( 2.351 -4.209 0.197) 4.825 2.898 ( 0.227 -5.356 4.430) 6.955 3.052 ( 0.796 1.566 1.362) 2.223 3.138 ( -5.481 -0.246 3.680) 6.606 3.245 ( 2.058 -1.477 -1.577) 2.984 3.319 ( -4.188 -2.061 1.469) 4.893 3.926 ( 2.092 -1.071 1.334) 2.703 4.332 ( 8.650 0.544 0.957) 8.720 5.096 ( -12.570 12.288 -1.216) 17.621 5.692 ( -11.738 -10.121 -3.629) 15.919 8.448 ( 3.313 0.415 17.747) 18.059 9.338 ( 1.473 -2.385 -14.141) 14.417 10.049 ( -2.518 13.566 -6.643) 15.313 11.111 ( 8.110 -10.079 12.560) 18.031 14.443 ( 9.421 3.373 5.190) 11.273 14.789 ( 11.383 -8.355 3.138) 14.465 15.668 ( -1.639 6.209 -3.597) 7.360 15.761 ( 2.216 4.039 0.991) 4.712 17.168 ( -2.472 0.276 -6.034) 6.526 17.467 ( 7.578 -5.743 -1.527) 9.630 17.639 ( -7.673 7.663 -1.232) 10.914 17.984 ( -3.501 -5.591 1.205) 6.706 ======================= Grid point 232 (109/306) ======================= q-point: (-0.50 0.20 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.118 ( -1.367 2.893 -0.359) 3.220 1.203 ( -4.949 4.536 -1.546) 6.889 1.498 ( 0.395 -0.648 -3.542) 3.623 1.788 ( 6.709 11.701 -4.994) 14.383 1.987 ( 7.914 5.459 1.151) 9.683 2.311 ( 1.792 -0.788 -4.186) 4.621 2.467 ( -0.928 1.445 0.921) 1.948 2.595 ( -0.200 0.945 3.667) 3.792 2.744 ( -1.015 -1.715 -1.415) 2.444 2.969 ( -0.321 -0.574 1.201) 1.370 3.033 ( -4.054 1.332 2.081) 4.748 3.118 ( -1.166 -3.241 0.754) 3.526 3.310 ( -1.522 -3.381 0.430) 3.733 3.365 ( 4.041 -2.885 3.813) 6.260 3.984 ( 2.868 0.293 1.969) 3.491 4.398 ( 0.796 1.675 -1.618) 2.461 4.882 ( -0.869 3.128 0.876) 3.362 5.633 ( -11.602 -10.032 -3.203) 15.669 8.608 ( 1.162 5.147 11.995) 13.104 9.318 ( 2.805 -5.893 -6.468) 9.189 9.771 ( -2.692 12.884 -4.817) 14.016 11.406 ( 4.227 -7.736 6.821) 11.147 14.559 ( 6.035 4.326 6.201) 9.674 15.045 ( 7.455 -7.328 3.699) 11.089 15.440 ( -8.566 8.142 -4.507) 12.648 15.816 ( 9.735 5.387 1.433) 11.218 17.056 ( -2.385 0.289 -8.492) 8.825 17.416 ( -8.259 9.635 1.289) 12.756 17.584 ( 2.530 -6.212 -3.579) 7.603 18.082 ( 2.118 -7.519 2.302) 8.144 ======================= Grid point 233 (110/306) ======================= q-point: (-0.40 0.20 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 552 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.020 ( -5.668 7.496 -0.738) 9.427 1.051 ( -3.155 6.088 1.771) 7.083 1.510 ( 1.353 -0.087 -0.006) 1.356 1.660 ( 8.014 11.766 -7.110) 15.912 2.024 ( 6.569 7.494 3.421) 10.536 2.305 ( 1.278 -1.168 -3.688) 4.074 2.378 ( -5.603 6.053 1.045) 8.314 2.619 ( -3.151 2.138 5.080) 6.348 2.728 ( 1.830 -1.263 -1.539) 2.704 2.929 ( -2.868 2.534 1.025) 3.962 3.045 ( 0.488 -2.246 0.011) 2.299 3.162 ( -2.032 -4.453 1.087) 5.014 3.337 ( -1.361 -4.565 -0.484) 4.788 3.463 ( 2.546 0.622 1.873) 3.221 4.013 ( 1.506 2.727 0.767) 3.208 4.275 ( -6.198 3.115 -3.082) 7.590 5.046 ( 13.024 -8.842 3.520) 16.131 5.582 ( -11.619 -9.846 -2.050) 15.367 8.651 ( 1.879 7.531 8.763) 11.706 9.205 ( -6.063 5.066 -13.979) 16.057 9.727 ( 4.156 -0.037 10.035) 10.861 11.551 ( -0.335 -6.055 -0.415) 6.078 14.601 ( 0.613 6.292 4.995) 8.057 15.179 ( -4.405 8.731 -2.867) 10.191 15.233 ( 0.365 -4.673 2.398) 5.265 15.885 ( 9.509 4.636 -0.279) 10.582 16.915 ( -1.988 3.013 -7.602) 8.415 17.240 ( -5.363 8.485 3.608) 10.666 17.641 ( 0.774 -5.672 -2.246) 6.150 18.235 ( 3.619 -8.377 -0.271) 9.129 ======================= Grid point 234 (111/306) ======================= q-point: (-0.30 0.20 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.886 ( -1.396 10.065 5.495) 11.552 0.976 ( -2.124 6.698 5.244) 8.768 1.442 ( 3.799 12.531 -2.953) 13.423 1.608 ( 5.621 3.213 -2.309) 6.874 2.041 ( 5.163 8.953 4.972) 11.469 2.196 ( -7.836 7.093 2.685) 10.906 2.332 ( 2.296 -1.633 -3.799) 4.730 2.594 ( -2.668 1.937 3.493) 4.803 2.777 ( 3.469 -1.543 -1.594) 4.118 2.880 ( -2.895 0.912 0.898) 3.165 3.071 ( 0.502 -1.674 -1.040) 2.034 3.189 ( -3.163 -4.045 0.174) 5.138 3.373 ( 0.358 -3.101 -1.599) 3.508 3.456 ( -1.855 1.101 0.210) 2.168 3.974 ( -1.468 1.873 -0.972) 2.571 4.174 ( -1.353 2.528 -1.199) 3.108 5.405 ( 13.955 -11.970 3.659) 18.746 5.553 ( -10.024 -10.961 0.175) 14.855 8.668 ( 6.038 8.843 -0.409) 10.715 8.885 ( -12.633 6.928 -1.630) 14.500 9.939 ( 5.767 -3.463 9.807) 11.892 11.529 ( -6.213 -3.822 -7.870) 10.730 14.518 ( -5.218 7.805 1.329) 9.482 14.961 ( -1.877 11.475 -4.244) 12.378 15.343 ( 0.482 -5.385 3.442) 6.410 15.887 ( 0.715 4.309 -2.859) 5.220 16.810 ( 3.275 5.601 -1.693) 6.706 17.169 ( 0.488 4.668 4.431) 6.455 17.707 ( 1.692 -4.645 0.225) 4.948 18.349 ( 1.755 -7.599 -3.773) 8.664 ======================= Grid point 235 (112/306) ======================= q-point: (-0.20 0.20 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 552 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.840 ( 0.694 8.592 6.559) 10.832 0.951 ( -1.369 8.358 9.680) 12.862 1.322 ( 4.517 11.127 -0.157) 12.010 1.608 ( 7.869 6.517 -0.718) 10.242 2.035 ( -0.544 5.224 2.813) 5.958 2.085 ( -1.725 8.066 7.005) 10.822 2.336 ( 2.622 -1.398 -4.850) 5.688 2.590 ( -1.051 0.430 2.327) 2.589 2.780 ( 0.529 0.520 -2.728) 2.827 2.868 ( -1.189 -1.464 -0.011) 1.886 3.071 ( -0.981 -1.295 -2.053) 2.618 3.193 ( -1.883 -2.371 -0.836) 3.141 3.363 ( -0.815 -0.137 -1.000) 1.298 3.456 ( -1.655 -3.260 0.511) 3.692 3.936 ( -1.119 0.045 -0.864) 1.414 4.115 ( 0.399 4.330 -1.798) 4.705 5.528 ( -10.241 -10.881 2.260) 15.112 5.820 ( 12.574 -14.092 2.892) 19.106 8.441 ( -3.076 7.732 -16.154) 18.171 8.858 ( -3.831 5.696 21.054) 22.144 10.138 ( 7.108 -2.639 4.386) 8.760 11.308 ( -13.140 1.851 -12.408) 18.167 14.340 ( -6.480 7.060 -2.129) 9.817 14.746 ( 0.692 13.021 -6.396) 14.523 15.467 ( 2.200 -5.892 3.613) 7.253 15.746 ( -6.782 5.383 -2.407) 8.986 16.807 ( 4.891 4.290 1.390) 6.653 17.240 ( 6.359 0.376 5.040) 8.123 17.811 ( 4.641 -3.890 2.591) 6.587 18.373 ( -1.458 -5.171 -6.528) 8.454 ======================= Grid point 236 (113/306) ======================= q-point: (-0.10 0.20 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.816 ( 0.466 6.910 5.315) 8.730 0.958 ( -0.256 5.969 11.616) 13.062 1.242 ( -0.644 7.881 1.388) 8.028 1.696 ( 15.171 4.085 2.440) 15.899 1.949 ( -7.540 0.976 -1.549) 7.760 2.097 ( 6.466 11.284 9.957) 16.379 2.325 ( 3.139 -0.734 -5.625) 6.484 2.595 ( 0.001 0.566 0.111) 0.577 2.753 ( -0.763 -0.550 -1.063) 1.419 2.867 ( -1.655 -1.981 -0.884) 2.729 3.029 ( -2.923 -0.281 -2.705) 3.992 3.184 ( -0.228 -0.313 -1.160) 1.223 3.372 ( -0.494 -2.125 0.593) 2.261 3.477 ( -1.394 -2.242 0.213) 2.649 3.921 ( -0.423 -0.711 -1.075) 1.356 4.033 ( 0.373 5.079 -2.850) 5.835 5.584 ( -10.048 -13.015 3.727) 16.860 6.122 ( 7.325 -10.790 -0.320) 13.045 8.161 ( -5.818 4.683 -9.724) 12.262 9.021 ( 0.735 4.057 22.961) 23.329 10.261 ( 8.528 -0.837 -4.913) 9.878 10.933 ( -15.662 8.104 -7.973) 19.353 14.168 ( -3.550 4.509 -3.816) 6.891 14.525 ( 2.812 12.918 -7.850) 15.375 15.562 ( -4.671 0.969 -0.075) 4.771 15.640 ( 3.751 -1.751 2.619) 4.899 16.845 ( 3.537 1.549 2.780) 4.758 17.364 ( 3.835 -1.380 2.543) 4.804 17.973 ( 7.547 -4.105 2.905) 9.069 18.303 ( -4.389 -2.163 -7.275) 8.767 ======================= Grid point 240 (114/306) ======================= q-point: ( 0.30 0.30 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 305 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.161 ( -0.226 0.000 1.148) 1.170 1.251 ( 0.077 -0.000 -1.717) 1.719 1.650 ( -0.895 0.000 -5.827) 5.896 1.909 ( 16.190 -0.000 5.939) 17.245 2.084 ( -1.222 0.000 -5.136) 5.280 2.289 ( 12.286 -0.000 -10.184) 15.958 2.420 ( -4.020 0.000 0.273) 4.029 2.572 ( 2.765 -0.000 5.991) 6.598 2.648 ( 1.809 -0.000 0.720) 1.947 2.809 ( -0.349 0.000 6.605) 6.614 3.081 ( -1.639 0.000 -1.391) 2.150 3.128 ( -0.125 0.000 5.659) 5.661 3.228 ( -0.210 0.000 -2.306) 2.316 3.294 ( -4.973 0.000 0.677) 5.019 3.910 ( 2.323 -0.000 1.295) 2.660 4.350 ( 8.635 -0.000 1.213) 8.720 5.397 ( -14.926 0.000 -1.171) 14.972 5.420 ( -13.091 0.000 -4.611) 13.879 8.454 ( 4.320 -0.000 20.768) 21.212 9.307 ( 1.907 -0.000 -17.943) 18.045 10.258 ( -4.577 0.000 -9.667) 10.696 10.945 ( 10.492 -0.000 16.907) 19.898 14.517 ( 11.122 -0.000 4.154) 11.873 14.652 ( 12.075 -0.000 4.528) 12.897 15.776 ( -7.707 0.000 -5.722) 9.599 15.788 ( 10.202 -0.000 1.862) 10.370 17.167 ( -3.335 0.000 -7.031) 7.782 17.393 ( 8.621 -0.000 -0.559) 8.639 17.797 ( -2.226 0.000 2.174) 3.112 17.853 ( -10.255 0.000 -1.539) 10.370 ======================= Grid point 241 (115/306) ======================= q-point: (-0.60 0.30 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.158 ( -0.249 0.649 -0.572) 0.900 1.247 ( 0.462 0.054 -0.819) 0.941 1.518 ( -4.859 1.264 -5.954) 7.788 2.030 ( 5.533 6.720 -2.566) 9.075 2.087 ( 10.049 2.274 -1.112) 10.363 2.331 ( 3.204 2.314 -3.407) 5.218 2.423 ( 4.462 -4.147 -0.184) 6.095 2.629 ( 0.779 1.184 2.310) 2.710 2.682 ( 0.346 -2.061 0.504) 2.150 2.895 ( -1.311 -2.741 5.308) 6.116 3.052 ( -1.187 -0.534 -0.660) 1.459 3.125 ( -6.025 2.170 3.286) 7.197 3.248 ( -4.196 -1.529 0.626) 4.510 3.295 ( 7.428 -1.972 2.660) 8.133 3.976 ( 4.655 -0.523 2.423) 5.274 4.448 ( 6.596 1.684 0.323) 6.816 5.060 ( -12.520 10.149 -2.526) 16.314 5.355 ( -13.293 -11.949 -3.168) 18.153 8.716 ( 1.906 2.919 20.361) 20.658 9.194 ( 4.499 -3.300 -11.843) 13.091 10.039 ( -3.431 6.930 -11.262) 13.661 11.233 ( 4.901 -4.818 10.704) 12.721 14.667 ( 8.603 3.899 5.695) 11.029 14.884 ( 9.702 -5.060 5.185) 12.108 15.589 ( -7.903 3.381 -5.667) 10.296 15.917 ( 10.018 2.313 0.371) 10.288 17.052 ( -1.747 -0.341 -7.803) 8.003 17.467 ( 4.961 -2.397 -3.789) 6.687 17.646 ( -8.863 8.236 1.503) 12.192 17.890 ( -0.999 -7.637 2.891) 8.227 ======================= Grid point 242 (116/306) ======================= q-point: (-0.50 0.30 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.127 ( -0.361 2.060 -1.039) 2.335 1.200 ( -2.620 4.980 0.362) 5.639 1.457 ( 0.466 -2.285 -0.418) 2.369 1.960 ( 7.344 10.314 -5.859) 13.952 2.146 ( 7.558 1.931 -2.204) 8.106 2.296 ( 0.432 1.833 -0.617) 1.982 2.495 ( 0.707 2.188 0.854) 2.453 2.647 ( 0.518 0.518 3.294) 3.374 2.699 ( -1.021 -1.248 -0.790) 1.796 2.951 ( -1.463 -3.091 1.732) 3.833 3.026 ( -3.937 2.263 1.372) 4.744 3.076 ( -2.575 -1.595 1.634) 3.441 3.238 ( -2.881 -3.267 0.304) 4.366 3.443 ( 5.345 -1.684 2.964) 6.339 4.078 ( 7.175 1.393 2.280) 7.656 4.405 ( -4.723 7.587 -2.652) 9.322 4.907 ( 2.010 -2.387 0.536) 3.166 5.309 ( -12.639 -11.573 -2.211) 17.279 8.840 ( 0.691 7.507 12.978) 15.008 9.215 ( 0.475 -3.474 -4.901) 6.026 9.823 ( 1.890 5.984 -6.415) 8.974 11.400 ( -0.822 -5.487 3.207) 6.408 14.752 ( 3.717 5.634 5.539) 8.732 15.093 ( 4.201 -5.052 4.526) 7.979 15.392 ( -4.603 6.453 -3.992) 8.875 15.978 ( 7.528 2.678 -3.484) 8.717 16.973 ( 2.020 1.821 -4.922) 5.623 17.456 ( -8.317 8.566 3.077) 12.330 17.512 ( 3.017 -4.304 -3.778) 6.473 18.016 ( 0.410 -8.799 1.321) 8.907 ======================= Grid point 243 (117/306) ======================= q-point: (-0.40 0.30 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.096 ( 0.095 3.204 1.581) 3.575 1.114 ( -0.307 8.113 3.982) 9.043 1.525 ( 2.479 -2.065 1.962) 3.776 1.839 ( 7.826 11.662 -7.600) 15.969 2.180 ( 4.572 2.684 -1.155) 5.426 2.286 ( 0.776 0.260 -0.443) 0.931 2.417 ( -3.128 7.546 1.595) 8.323 2.657 ( -3.014 2.328 3.195) 4.971 2.724 ( 2.760 -2.559 -0.031) 3.764 2.936 ( -2.768 2.730 0.376) 3.907 2.997 ( -3.906 -3.403 0.953) 5.267 3.099 ( -1.284 -2.972 0.531) 3.281 3.267 ( -0.703 -4.488 0.157) 4.545 3.499 ( -0.034 0.879 -0.369) 0.954 4.101 ( 0.978 8.679 -1.160) 8.810 4.232 ( -1.860 2.261 -0.070) 2.928 5.121 ( 12.117 -11.173 2.556) 16.679 5.275 ( -12.554 -10.817 -0.737) 16.588 8.892 ( 4.651 8.587 8.768) 13.124 9.051 ( -10.667 6.034 -6.894) 14.061 9.870 ( 8.657 -2.320 3.206) 9.519 11.417 ( -6.016 -4.767 -3.866) 8.595 14.715 ( -3.629 7.875 2.201) 8.946 15.195 ( -1.667 -1.573 1.084) 2.535 15.257 ( 2.238 6.872 0.266) 7.232 15.961 ( 1.841 1.388 -5.997) 6.425 16.951 ( 6.895 5.835 -0.820) 9.070 17.311 ( -5.088 6.558 3.872) 9.159 17.583 ( 3.636 -5.126 -1.230) 6.404 18.128 ( -0.950 -9.679 -1.698) 9.873 ======================= Grid point 244 (118/306) ======================= q-point: (-0.30 0.30 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.036 ( -1.210 6.449 2.864) 7.159 1.129 ( 2.803 6.490 7.726) 10.472 1.543 ( -0.444 4.821 -0.746) 4.899 1.763 ( 12.120 7.239 -4.416) 14.792 2.125 ( -6.171 4.517 0.421) 7.659 2.296 ( 1.398 -0.485 -0.625) 1.606 2.336 ( 3.943 7.848 1.605) 8.928 2.630 ( -2.073 2.115 3.432) 4.533 2.777 ( 2.255 -1.437 -1.794) 3.220 2.873 ( -2.657 2.496 0.879) 3.750 2.990 ( -4.178 -4.862 -2.019) 6.721 3.126 ( -0.095 -2.407 0.138) 2.413 3.323 ( 0.046 -4.323 0.191) 4.328 3.431 ( -3.639 1.859 -2.036) 4.565 3.986 ( -1.737 4.794 0.189) 5.103 4.227 ( 3.554 4.453 0.237) 5.702 5.244 ( -13.973 -11.867 0.585) 18.342 5.480 ( 14.599 -13.130 2.806) 19.834 8.687 ( -3.751 11.376 -15.213) 19.363 9.002 ( -3.597 5.853 20.511) 21.631 10.064 ( 10.229 -3.901 1.436) 11.041 11.288 ( -10.628 -2.530 -8.563) 13.881 14.538 ( -7.420 8.699 -1.500) 11.532 15.088 ( 3.713 13.858 -3.794) 14.840 15.311 ( -1.195 -6.215 3.643) 7.302 15.860 ( -4.512 3.226 -3.558) 6.590 16.956 ( 6.708 7.404 0.047) 9.991 17.282 ( 2.419 2.797 4.651) 5.941 17.703 ( 5.168 -4.864 1.755) 7.311 18.186 ( -3.331 -9.400 -4.580) 10.975 ======================= Grid point 245 (119/306) ======================= q-point: (-0.20 0.30 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.982 ( -0.605 6.191 3.408) 7.093 1.142 ( -0.354 7.966 7.715) 11.095 1.424 ( -3.173 6.550 -1.637) 7.460 1.832 ( 15.216 5.745 -1.426) 16.327 1.975 ( -9.811 2.074 -0.231) 10.030 2.315 ( 4.049 -0.218 -4.074) 5.749 2.334 ( 5.058 7.192 4.875) 10.054 2.631 ( -0.040 1.965 3.288) 3.831 2.768 ( 0.931 1.063 -2.553) 2.918 2.835 ( -1.734 0.229 -0.161) 1.757 2.974 ( -3.108 -4.278 -3.430) 6.303 3.156 ( 0.232 -1.792 -0.028) 1.807 3.345 ( -0.713 -0.011 -0.100) 0.720 3.396 ( -2.258 -3.841 0.944) 4.555 3.934 ( -0.974 2.447 0.618) 2.705 4.191 ( 3.057 7.199 -1.439) 7.952 5.242 ( -14.341 -13.820 2.719) 20.101 5.834 ( 12.179 -12.375 1.207) 17.404 8.353 ( -4.974 10.474 -9.711) 15.125 9.134 ( -1.778 4.834 21.446) 22.055 10.221 ( 11.023 -3.088 -6.058) 12.951 11.046 ( -13.219 1.681 -7.731) 15.406 14.321 ( -6.094 7.677 -2.957) 10.238 14.891 ( 4.787 16.121 -7.038) 18.230 15.436 ( -0.816 -8.279 4.535) 9.475 15.715 ( -5.813 5.204 -0.102) 7.803 16.947 ( 5.097 6.048 1.158) 7.994 17.361 ( 5.078 0.971 2.825) 5.892 17.866 ( 6.834 -4.615 3.243) 8.861 18.175 ( -5.630 -7.737 -6.391) 11.507 ======================= Grid point 246 (120/306) ======================= q-point: (-0.10 0.30 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.942 ( 0.322 5.318 3.184) 6.206 1.138 ( 0.153 4.969 8.747) 10.061 1.284 ( -5.655 5.106 0.228) 7.622 1.825 ( -8.467 0.919 -2.796) 8.964 1.957 ( 13.395 3.068 0.038) 13.742 2.306 ( 6.368 3.238 -5.378) 8.942 2.388 ( 4.695 3.422 4.478) 7.335 2.636 ( 2.428 3.278 -0.019) 4.080 2.753 ( 0.725 2.014 1.966) 2.906 2.807 ( -2.071 -1.042 -2.247) 3.229 2.944 ( -2.821 -2.780 -2.212) 4.536 3.172 ( 0.445 -0.681 -0.198) 0.837 3.355 ( -0.506 -0.844 1.379) 1.694 3.427 ( -2.145 -3.377 0.800) 4.080 3.907 ( -0.551 0.784 -0.066) 0.960 4.102 ( 2.344 8.202 -2.511) 8.892 5.291 ( -13.785 -16.168 4.051) 21.629 6.082 ( 6.559 -8.118 -1.459) 10.538 8.112 ( -3.751 8.241 -2.694) 9.447 9.316 ( -0.336 1.626 21.747) 21.810 10.240 ( 8.017 -1.080 -18.772) 20.441 10.812 ( -8.902 5.392 1.401) 10.501 14.155 ( -2.110 5.323 -2.709) 6.335 14.681 ( 6.666 15.641 -7.322) 18.512 15.524 ( -4.340 -0.237 2.429) 4.979 15.664 ( 0.955 -4.301 2.787) 5.213 16.972 ( 5.682 4.353 2.954) 7.744 17.416 ( 2.417 1.132 0.812) 2.790 18.032 ( 5.182 -4.748 1.094) 7.113 18.104 ( -6.474 -4.803 -6.132) 10.129 ======================= Grid point 251 (121/306) ======================= q-point: ( 0.40 -0.60 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.150 ( 0.128 -0.000 -1.200) 1.207 1.265 ( 1.696 -0.000 0.537) 1.779 1.425 ( -2.907 0.000 -0.856) 3.030 2.127 ( 6.030 0.000 -8.607) 10.510 2.127 ( 5.380 0.000 -1.452) 5.572 2.358 ( -1.993 0.000 1.694) 2.616 2.493 ( 10.511 -0.000 -0.882) 10.548 2.664 ( -1.575 0.000 0.394) 1.624 2.673 ( 0.549 -0.000 2.139) 2.208 2.902 ( -3.124 0.000 3.621) 4.782 3.026 ( -1.261 0.000 -0.021) 1.261 3.099 ( -5.184 0.000 2.004) 5.558 3.189 ( -4.011 0.000 0.847) 4.100 3.416 ( 6.497 -0.000 3.603) 7.429 4.088 ( 8.776 -0.000 2.890) 9.239 4.541 ( 5.078 -0.000 -0.046) 5.078 4.904 ( -18.065 0.000 -4.357) 18.583 5.111 ( -5.998 0.000 -0.878) 6.062 8.971 ( -4.233 0.000 21.828) 22.234 9.128 ( 7.873 -0.000 -8.737) 11.761 9.914 ( 0.180 -0.000 -13.391) 13.392 11.324 ( -0.809 0.000 5.602) 5.660 14.843 ( 4.772 -0.000 5.640) 7.388 15.010 ( 5.199 -0.000 4.978) 7.198 15.476 ( -3.732 0.000 -3.777) 5.310 16.012 ( 5.868 -0.000 -5.138) 7.800 16.998 ( 4.461 -0.000 -3.173) 5.474 17.454 ( 3.597 -0.000 -4.927) 6.100 17.601 ( -10.592 0.000 2.497) 10.882 17.868 ( 0.369 -0.000 2.285) 2.314 ======================= Grid point 253 (122/306) ======================= q-point: (-0.50 0.40 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.144 ( 0.660 0.877 0.146) 1.107 1.271 ( 1.212 4.138 2.538) 5.004 1.463 ( 3.120 -2.249 3.799) 5.406 2.047 ( 4.464 4.570 -9.890) 11.774 2.181 ( 4.252 -0.996 -2.168) 4.876 2.345 ( -0.670 2.761 2.249) 3.623 2.558 ( 2.801 3.596 -0.549) 4.591 2.661 ( 0.622 -1.949 -0.282) 2.065 2.695 ( -1.020 0.508 2.755) 2.981 2.894 ( -4.576 -2.319 0.940) 5.216 3.019 ( -1.489 0.678 0.679) 1.771 3.053 ( -2.999 0.241 1.529) 3.375 3.175 ( -2.221 -2.514 0.743) 3.436 3.499 ( 1.089 -0.324 1.279) 1.711 4.230 ( 8.517 0.707 2.362) 8.866 4.431 ( -6.012 13.957 -2.266) 15.365 4.810 ( -2.957 -14.203 -1.336) 14.569 5.091 ( -2.351 -3.520 1.042) 4.359 9.056 ( -8.244 3.977 16.844) 19.170 9.157 ( 4.439 2.144 -6.130) 7.867 9.828 ( 7.625 -0.950 -8.233) 11.261 11.323 ( -6.223 -2.245 -0.378) 6.626 14.889 ( -1.505 5.682 3.994) 7.107 15.083 ( -2.658 -4.476 1.525) 5.425 15.445 ( 4.512 4.792 1.562) 6.765 15.963 ( 0.999 -0.581 -9.876) 9.943 17.079 ( 11.048 3.664 2.127) 11.833 17.454 ( -2.598 1.249 -1.060) 3.071 17.485 ( -1.952 0.554 0.073) 2.031 17.912 ( -2.618 -6.404 -0.119) 6.919 ======================= Grid point 254 (123/306) ======================= q-point: (-0.40 0.40 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 552 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.136 ( -0.618 2.030 1.111) 2.395 1.279 ( 2.475 4.953 5.134) 7.550 1.585 ( 4.483 0.190 4.388) 6.276 1.928 ( 4.661 4.816 -9.538) 11.657 2.209 ( 1.327 0.318 -1.100) 1.753 2.302 ( -2.860 3.323 0.667) 4.435 2.515 ( 2.504 6.021 0.314) 6.529 2.670 ( -2.383 0.951 1.837) 3.156 2.723 ( 0.729 -2.354 0.672) 2.554 2.864 ( -4.649 -3.972 -2.609) 6.648 2.967 ( -2.859 3.345 1.428) 4.626 3.072 ( 0.453 -1.979 0.695) 2.146 3.209 ( -0.784 -4.284 0.856) 4.438 3.468 ( -3.982 0.764 -2.224) 4.625 4.178 ( -6.290 9.345 1.706) 11.393 4.332 ( 8.584 4.879 0.766) 9.903 4.936 ( -7.385 -13.492 -1.652) 15.470 5.211 ( 9.349 -7.764 3.200) 12.567 8.947 ( -12.013 8.141 -1.658) 14.606 9.148 ( 4.273 6.266 9.288) 11.992 9.939 ( 10.803 -5.895 -3.830) 12.889 11.221 ( -10.013 -2.357 -4.543) 11.245 14.754 ( -7.373 8.649 -0.229) 11.368 15.134 ( -3.887 -6.664 3.093) 8.312 15.429 ( 5.946 11.568 -0.755) 13.029 15.882 ( -1.086 -1.521 -6.169) 6.445 17.160 ( 9.247 8.833 0.471) 12.796 17.364 ( -2.660 3.468 4.282) 6.119 17.574 ( 6.563 -5.534 -0.045) 8.585 17.944 ( -5.392 -9.261 -2.762) 11.066 ======================= Grid point 255 (124/306) ======================= q-point: (-0.30 0.40 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.105 ( -1.303 3.394 1.992) 4.146 1.306 ( 0.829 4.961 5.924) 7.772 1.574 ( -2.534 6.030 -2.181) 6.894 1.905 ( 7.686 0.383 -3.725) 8.550 2.106 ( -7.407 7.562 0.390) 10.593 2.285 ( 2.545 -1.607 -1.572) 3.396 2.488 ( 3.661 5.245 -0.293) 6.403 2.652 ( -3.695 -0.676 3.408) 5.072 2.758 ( 3.019 -1.112 -2.937) 4.356 2.842 ( -2.415 -4.899 -2.712) 6.098 2.910 ( -1.640 3.763 1.460) 4.356 3.110 ( 0.878 -1.760 0.259) 1.984 3.268 ( -0.833 -4.872 0.905) 5.025 3.381 ( -3.427 1.051 -1.052) 3.735 4.057 ( -2.105 7.243 2.852) 8.064 4.362 ( 6.021 6.119 0.354) 8.592 4.938 ( -12.281 -10.229 0.104) 15.983 5.525 ( 13.464 -12.295 1.981) 18.341 8.647 ( -7.666 12.628 -4.774) 15.525 9.245 ( -1.752 3.870 16.004) 16.559 10.094 ( 11.188 -7.038 -9.269) 16.144 11.052 ( -11.217 -0.541 -4.007) 11.924 14.532 ( -7.916 9.139 -1.612) 12.197 15.220 ( -4.467 -8.772 4.740) 10.926 15.288 ( 5.619 15.255 -6.336) 17.448 15.822 ( -3.061 2.619 -0.215) 4.035 17.118 ( 3.273 7.652 0.062) 8.323 17.403 ( 5.825 2.273 2.545) 6.751 17.748 ( 6.845 -4.858 3.126) 8.957 17.947 ( -6.197 -10.133 -4.870) 12.838 ======================= Grid point 256 (125/306) ======================= q-point: (-0.20 0.40 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 552 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.067 ( -1.088 4.287 2.453) 5.057 1.291 ( -2.089 6.277 5.849) 8.831 1.403 ( -6.706 5.099 -3.302) 9.048 1.853 ( -10.675 1.287 -1.503) 10.856 2.027 ( 9.769 3.326 -3.474) 10.888 2.336 ( 4.250 -0.791 -0.648) 4.371 2.467 ( 2.863 3.302 -0.910) 4.464 2.677 ( -1.751 -1.857 3.427) 4.273 2.768 ( 5.104 1.101 -3.738) 6.421 2.848 ( -1.770 -4.006 -3.124) 5.379 2.873 ( 0.460 4.027 2.882) 4.973 3.142 ( 0.864 -1.484 0.008) 1.717 3.320 ( -1.713 -4.655 0.488) 4.984 3.353 ( -0.749 0.300 1.953) 2.113 3.984 ( -1.641 5.412 1.925) 5.974 4.332 ( 5.168 9.429 -1.344) 10.836 4.923 ( -14.258 -12.530 2.839) 19.193 5.842 ( 11.340 -11.119 -0.130) 15.882 8.375 ( -4.997 12.636 -1.154) 13.637 9.355 ( -4.916 1.158 17.312) 18.034 10.148 ( 8.490 -6.134 -19.381) 22.030 10.908 ( -7.151 2.446 2.499) 7.960 14.323 ( -5.361 8.044 -1.192) 9.740 15.084 ( 6.342 16.159 -7.849) 19.051 15.344 ( -4.321 -10.382 5.998) 12.745 15.727 ( -4.017 5.716 0.995) 7.057 17.094 ( 4.035 4.979 1.634) 6.614 17.468 ( 6.164 2.884 0.702) 6.842 17.863 ( -5.398 -8.716 -2.785) 10.624 17.981 ( 4.091 -4.816 -0.489) 6.337 ======================= Grid point 257 (126/306) ======================= q-point: (-0.10 0.40 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.032 ( -0.005 3.968 2.585) 4.736 1.227 ( -4.885 2.267 -1.405) 5.566 1.284 ( -4.179 2.931 7.796) 9.319 1.706 ( -6.392 0.953 -2.977) 7.115 2.076 ( 7.456 -0.401 -4.496) 8.716 2.365 ( 3.817 2.079 -2.328) 4.931 2.464 ( 1.836 0.762 -0.684) 2.102 2.683 ( -1.779 0.115 -1.483) 2.319 2.778 ( 4.913 3.079 -3.007) 6.531 2.844 ( 0.463 -1.489 1.108) 1.913 2.892 ( 1.786 2.167 3.510) 4.495 3.175 ( 1.473 -1.049 0.792) 1.974 3.344 ( -2.778 -3.457 -0.425) 4.455 3.378 ( -0.757 -0.407 3.011) 3.131 3.927 ( -1.211 3.150 0.996) 3.518 4.240 ( 4.977 11.155 -2.297) 12.429 4.963 ( -13.928 -15.412 4.568) 21.270 6.050 ( 6.105 -6.531 -2.534) 9.292 8.203 ( -2.296 10.300 4.407) 11.436 9.479 ( -6.937 -3.468 16.269) 18.023 10.032 ( 5.044 -3.033 -25.248) 25.925 10.883 ( 0.475 4.725 7.602) 8.964 14.190 ( -1.100 5.700 0.271) 5.812 14.897 ( 8.422 15.687 -6.431) 18.930 15.478 ( -4.440 -7.559 5.830) 10.528 15.637 ( -2.767 0.792 0.322) 2.896 17.125 ( 4.595 2.873 2.409) 5.931 17.494 ( 4.768 4.604 0.094) 6.629 17.828 ( -7.781 -8.721 -6.146) 13.205 18.085 ( 3.757 -1.962 0.424) 4.259 ======================= Grid point 263 (127/306) ======================= q-point: ( 0.50 -0.50 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 305 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.158 ( -0.337 0.000 0.717) 0.792 1.343 ( 0.891 0.000 3.369) 3.484 1.587 ( 7.995 0.000 7.151) 10.726 1.985 ( 1.190 0.000 -11.341) 11.403 2.199 ( 2.298 0.000 -1.006) 2.509 2.367 ( -2.974 0.000 2.018) 3.594 2.611 ( 2.922 0.000 -2.860) 4.088 2.662 ( 2.401 0.000 1.576) 2.872 2.699 ( -4.110 0.000 2.178) 4.651 2.803 ( -6.131 0.000 -2.126) 6.489 3.030 ( -2.598 0.000 0.945) 2.765 3.032 ( 0.889 -0.000 1.008) 1.344 3.145 ( -1.300 0.000 1.054) 1.674 3.475 ( -4.068 0.000 -1.591) 4.368 4.290 ( -5.527 0.000 5.505) 7.800 4.549 ( -2.561 0.000 -2.828) 3.816 4.618 ( 8.695 -0.000 -1.823) 8.884 5.116 ( 4.336 0.000 2.929) 5.233 9.043 ( -18.334 0.000 13.546) 22.795 9.259 ( 10.868 -0.000 -4.057) 11.601 9.840 ( 10.198 0.000 -7.128) 12.442 11.190 ( -9.831 0.000 -2.693) 10.194 14.953 ( -5.370 -0.000 4.980) 7.324 14.961 ( -7.031 0.000 -2.181) 7.362 15.609 ( 8.064 0.000 5.346) 9.675 15.829 ( -0.458 -0.000 -11.741) 11.750 17.326 ( 15.245 0.000 5.154) 16.093 17.428 ( -7.875 0.000 2.734) 8.336 17.451 ( 5.277 -0.000 -4.351) 6.840 17.806 ( -6.321 0.000 -1.567) 6.512 ======================= Grid point 265 (128/306) ======================= q-point: (-0.40 0.50 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.149 ( -2.011 0.567 1.177) 2.398 1.385 ( 0.343 1.535 4.745) 4.999 1.722 ( 2.988 5.244 2.264) 6.446 1.877 ( 1.068 -2.361 -7.532) 7.965 2.220 ( 1.361 -0.026 0.674) 1.519 2.312 ( -3.618 4.470 0.324) 5.760 2.573 ( -5.052 0.592 -1.587) 5.328 2.616 ( -4.601 -0.725 -2.827) 5.449 2.731 ( 2.792 -0.693 1.482) 3.236 2.751 ( 0.245 -2.168 -2.251) 3.135 2.993 ( -1.852 2.494 1.120) 3.302 3.072 ( 1.573 -1.329 0.858) 2.231 3.166 ( -0.476 -2.702 1.047) 2.936 3.399 ( -3.803 0.349 -0.971) 3.941 4.244 ( -6.196 6.237 6.880) 11.163 4.455 ( -1.089 0.786 -1.614) 2.100 4.770 ( 7.068 -2.894 -2.774) 8.125 5.272 ( 9.585 -6.677 2.967) 12.052 8.917 ( -15.511 7.379 9.780) 19.766 9.310 ( 4.801 1.264 -1.184) 5.103 9.920 ( 9.878 -5.244 -8.775) 14.215 11.039 ( -10.022 -0.363 -1.576) 10.152 14.760 ( -8.371 9.026 -0.407) 12.317 15.000 ( -7.641 -8.769 3.499) 12.146 15.618 ( 4.401 10.645 -5.556) 12.789 15.813 ( 3.008 -3.576 0.294) 4.682 17.309 ( -2.845 6.752 -0.081) 7.327 17.463 ( 6.909 2.326 0.471) 7.305 17.628 ( 11.685 -5.134 3.495) 13.233 17.722 ( -8.789 -6.150 -3.073) 11.158 ======================= Grid point 266 (129/306) ======================= q-point: (-0.30 -0.50 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.126 ( -3.146 0.554 1.898) 3.716 1.408 ( -1.201 3.241 4.976) 6.058 1.563 ( -6.402 7.162 -5.722) 11.181 1.863 ( -6.353 -0.928 -1.956) 6.712 2.150 ( -1.484 6.848 -2.230) 7.353 2.302 ( 4.643 -1.448 1.226) 5.016 2.507 ( -3.656 -2.231 -1.043) 4.408 2.589 ( 0.155 -2.572 -1.560) 3.012 2.743 ( -1.337 -3.182 -1.956) 3.967 2.807 ( 4.788 0.662 0.832) 4.904 2.957 ( -0.858 2.440 1.553) 3.017 3.115 ( 1.962 -0.775 0.419) 2.150 3.209 ( -0.946 -3.629 0.818) 3.838 3.370 ( -0.218 0.735 1.303) 1.512 4.147 ( -3.776 7.157 2.432) 8.450 4.452 ( -3.157 -2.517 2.690) 4.852 4.787 ( 2.250 3.873 -2.055) 4.928 5.555 ( 12.463 -11.430 0.872) 16.933 8.708 ( -9.297 13.580 5.211) 17.263 9.341 ( -6.074 -2.984 6.398) 9.313 9.978 ( 8.955 -6.327 -16.418) 19.743 10.942 ( -6.201 0.545 3.410) 7.098 14.540 ( -7.776 9.355 0.271) 12.167 15.068 ( -7.682 -10.634 4.703) 13.936 15.458 ( 4.443 12.143 -6.759) 14.590 15.852 ( 0.505 3.596 1.404) 3.894 17.211 ( -0.905 4.638 0.121) 4.727 17.539 ( 8.913 2.058 0.207) 9.150 17.639 ( -10.895 -8.208 -3.565) 14.099 17.871 ( 10.453 -3.877 2.483) 11.421 ======================= Grid point 267 (130/306) ======================= q-point: (-0.20 -0.50 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.101 ( -3.432 0.548 2.236) 4.132 1.319 ( -9.659 4.578 -4.085) 11.443 1.378 ( -4.222 5.524 4.542) 8.305 1.724 ( -8.325 0.599 -1.709) 8.519 2.083 ( 3.089 0.866 -5.055) 5.987 2.384 ( 3.752 -0.418 0.492) 3.807 2.477 ( 0.077 0.188 -2.871) 2.878 2.637 ( -1.440 -3.001 1.852) 3.809 2.751 ( -0.127 -3.667 -1.097) 3.830 2.849 ( 3.438 1.325 -0.451) 3.712 2.961 ( 1.921 1.483 2.776) 3.687 3.151 ( 2.089 -0.810 0.117) 2.243 3.242 ( -1.847 -3.378 0.225) 3.856 3.390 ( 1.315 0.898 2.214) 2.727 4.041 ( -3.392 5.149 0.667) 6.202 4.473 ( -0.166 1.436 2.228) 2.656 4.725 ( -3.019 2.349 0.797) 3.908 5.838 ( 10.713 -10.328 -1.583) 14.964 8.499 ( -5.192 13.309 4.523) 14.985 9.372 ( -12.864 -5.973 10.731) 17.785 9.932 ( 7.381 -4.176 -21.539) 23.148 10.953 ( -0.353 1.077 7.550) 7.635 14.361 ( -5.051 7.974 1.736) 9.598 15.167 ( -4.479 -8.478 3.358) 10.160 15.301 ( 3.049 9.893 -3.330) 10.874 15.774 ( -2.361 7.238 -0.168) 7.615 17.175 ( 0.365 1.512 0.229) 1.572 17.559 ( -8.584 -6.089 -2.917) 10.921 17.641 ( 8.480 0.208 -1.004) 8.542 18.033 ( 6.602 -1.975 0.877) 6.947 ======================= Grid point 268 (131/306) ======================= q-point: (-0.10 -0.50 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.066 ( -3.865 -0.409 -0.334) 3.901 1.151 ( -6.002 1.657 0.553) 6.251 1.332 ( -4.930 0.238 6.069) 7.822 1.638 ( -1.510 0.933 -2.285) 2.894 2.058 ( 2.118 -1.257 -6.916) 7.342 2.406 ( 2.965 2.211 -2.042) 4.225 2.453 ( -0.484 -1.525 -2.000) 2.562 2.619 ( -3.650 0.033 -0.838) 3.745 2.815 ( -0.351 -4.091 2.319) 4.715 2.853 ( 2.008 1.735 -0.988) 2.832 3.016 ( 3.919 2.318 3.064) 5.487 3.198 ( 1.082 -2.858 0.736) 3.143 3.247 ( -1.851 -1.465 -0.461) 2.405 3.417 ( 0.665 1.183 2.242) 2.621 3.962 ( -1.928 3.326 0.992) 3.971 4.437 ( 5.684 10.076 -1.243) 11.636 4.716 ( -7.917 -6.872 5.029) 11.627 6.014 ( 5.721 -5.710 -3.696) 8.888 8.369 ( -2.296 9.361 6.241) 11.483 9.409 ( -14.913 -7.929 11.824) 20.618 9.815 ( 7.430 -1.666 -21.875) 23.162 11.056 ( 4.211 1.763 9.350) 10.405 14.267 ( -1.222 5.331 3.453) 6.468 15.120 ( 8.282 13.065 -4.753) 16.183 15.338 ( -7.676 -12.584 6.157) 15.975 15.645 ( -2.880 6.097 -1.056) 6.825 17.171 ( -0.562 -0.801 -0.517) 1.106 17.501 ( -8.242 -7.733 -3.861) 11.943 17.725 ( 11.062 5.410 -0.565) 12.327 18.102 ( 1.791 -0.770 -0.571) 2.031 ======================= Grid point 275 (132/306) ======================= q-point: (-0.40 -0.40 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.126 ( -4.221 0.000 1.336) 4.428 1.449 ( -0.651 0.000 5.395) 5.434 1.684 ( -6.986 0.000 -9.406) 11.716 1.826 ( -2.738 0.000 0.741) 2.837 2.282 ( 5.311 -0.000 1.619) 5.552 2.341 ( -15.752 0.000 -4.206) 16.304 2.353 ( 1.044 -0.000 3.806) 3.946 2.580 ( 2.210 -0.000 -5.555) 5.978 2.700 ( -1.300 0.000 -0.963) 1.618 2.814 ( 3.727 -0.000 2.090) 4.273 2.991 ( -2.524 0.000 0.947) 2.696 3.095 ( 1.239 -0.000 0.666) 1.407 3.169 ( 1.875 -0.000 1.166) 2.207 3.380 ( -0.134 0.000 1.340) 1.347 4.315 ( -7.636 0.000 -5.547) 9.438 4.319 ( -6.261 0.000 10.728) 12.421 4.907 ( 15.006 -0.000 -3.567) 15.424 5.371 ( 9.963 -0.000 1.955) 10.153 8.938 ( -17.531 0.000 20.902) 27.280 9.249 ( 0.770 -0.000 -14.840) 14.860 9.894 ( 8.441 -0.000 -11.125) 13.965 10.946 ( -6.119 0.000 3.530) 7.064 14.735 ( -7.812 0.000 -0.525) 7.829 14.857 ( -9.883 0.000 6.030) 11.577 15.627 ( 1.192 -0.000 -7.079) 7.178 15.891 ( 6.090 -0.000 1.866) 6.369 17.298 ( -4.413 0.000 -0.350) 4.427 17.479 ( -6.494 0.000 -4.100) 7.680 17.594 ( 3.308 -0.000 -0.147) 3.311 17.815 ( 13.535 -0.000 3.816) 14.062 ======================= Grid point 276 (133/306) ======================= q-point: (-0.30 -0.40 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.082 ( -6.276 -0.982 1.819) 6.608 1.414 ( -10.755 2.312 -4.161) 11.761 1.518 ( -1.925 4.096 2.181) 5.024 1.736 ( -9.317 0.275 -1.935) 9.520 2.118 ( -7.570 1.758 -2.674) 8.218 2.337 ( 0.427 -2.735 -0.455) 2.805 2.485 ( 5.292 0.478 3.431) 6.325 2.562 ( 3.001 -2.293 -2.078) 4.310 2.685 ( -1.068 -1.342 -0.685) 1.846 2.860 ( 0.607 -0.028 1.039) 1.203 2.973 ( -1.137 -0.002 1.143) 1.613 3.103 ( -1.481 -1.919 -0.940) 2.600 3.223 ( 4.025 0.582 1.752) 4.428 3.410 ( 1.914 0.479 1.871) 2.720 4.143 ( -6.349 2.564 -3.582) 7.728 4.378 ( -6.967 -3.334 8.821) 11.724 4.976 ( 12.343 10.274 -3.095) 16.355 5.576 ( 11.663 -9.099 -0.766) 14.813 8.839 ( -9.834 13.822 6.243) 18.075 9.159 ( -12.653 -11.223 3.226) 17.218 9.863 ( 8.426 -1.269 -15.521) 17.706 10.956 ( -2.234 -0.316 6.726) 7.094 14.572 ( -7.648 8.496 2.351) 11.671 14.892 ( -8.905 -10.108 6.597) 14.999 15.544 ( 2.364 5.878 -5.070) 8.115 15.926 ( 2.205 3.925 -1.503) 4.747 17.217 ( -3.119 2.205 -1.688) 4.176 17.359 ( -10.896 -6.639 -3.704) 13.286 17.687 ( 9.724 1.009 1.354) 9.869 18.001 ( 10.217 -0.592 1.411) 10.331 ======================= Grid point 277 (134/306) ======================= q-point: (-0.20 -0.40 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 552 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.031 ( -8.297 -1.977 0.750) 8.563 1.187 ( -11.975 0.903 -2.054) 12.183 1.429 ( -6.920 6.996 2.208) 10.085 1.640 ( -2.243 -0.843 -0.806) 2.528 2.035 ( -2.610 -0.900 -2.736) 3.887 2.358 ( -2.722 -4.094 -0.738) 4.971 2.485 ( 3.541 2.304 -4.370) 6.078 2.634 ( -0.763 1.196 1.866) 2.344 2.711 ( 0.510 -3.830 0.980) 3.986 2.855 ( -2.418 -0.798 0.936) 2.713 3.013 ( 2.520 -2.136 2.661) 4.242 3.095 ( -2.122 -3.192 -1.632) 4.166 3.279 ( 4.242 2.056 1.544) 4.961 3.446 ( 2.097 1.000 1.460) 2.744 4.027 ( -3.708 1.451 -1.521) 4.262 4.423 ( -7.287 -3.907 7.348) 11.061 4.924 ( 10.564 15.266 -1.988) 18.671 5.817 ( 10.187 -9.831 -3.404) 14.561 8.599 ( -5.842 8.575 -3.485) 10.945 9.214 ( -17.297 -7.530 17.317) 25.608 9.798 ( 8.116 0.324 -15.787) 17.754 11.040 ( 0.737 -2.337 7.428) 7.822 14.425 ( -5.570 7.352 4.299) 10.176 15.002 ( -8.359 -12.176 7.219) 16.439 15.434 ( 3.871 9.616 -4.225) 11.194 15.826 ( -1.677 7.359 -3.213) 8.203 17.145 ( -4.015 -1.083 -2.199) 4.704 17.289 ( -7.811 -7.846 -4.353) 11.897 17.827 ( 12.011 1.756 2.087) 12.317 18.100 ( 5.274 0.831 -0.973) 5.427 ======================= Grid point 278 (135/306) ======================= q-point: (-0.10 -0.40 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.929 ( -8.701 -3.419 -2.290) 9.625 1.105 ( -7.592 -3.134 3.682) 9.001 1.307 ( -6.241 0.450 2.040) 6.582 1.639 ( 2.951 0.911 -1.802) 3.576 1.959 ( -4.380 -0.666 -6.461) 7.834 2.359 ( -5.270 -5.480 -0.385) 7.613 2.449 ( 3.250 2.392 -4.588) 6.110 2.593 ( -3.487 1.654 1.509) 4.144 2.744 ( -3.503 -4.198 -0.116) 5.469 2.871 ( -0.021 -0.485 2.493) 2.540 3.077 ( 1.204 -0.146 -1.733) 2.115 3.147 ( 2.262 -4.642 4.015) 6.541 3.303 ( 2.670 3.165 0.731) 4.205 3.465 ( 1.328 1.633 1.124) 2.386 3.976 ( -1.316 1.146 0.396) 1.790 4.450 ( -6.885 -3.969 4.171) 8.976 4.855 ( 10.680 14.578 0.533) 18.079 5.966 ( 5.211 -5.613 -5.058) 9.178 8.441 ( -3.546 2.461 -1.953) 4.738 9.283 ( -14.226 -6.498 15.468) 21.997 9.710 ( 5.461 4.010 -11.038) 12.952 11.202 ( 4.645 -4.112 8.681) 10.670 14.355 ( -2.731 4.355 5.578) 7.585 15.127 ( -9.216 -13.121 6.030) 17.131 15.323 ( 6.317 10.752 -3.552) 12.966 15.669 ( -3.063 6.513 -2.664) 7.674 17.097 ( -4.579 -3.576 -1.816) 6.087 17.250 ( -5.542 -7.736 -6.042) 11.273 17.963 ( 12.948 6.113 -0.005) 14.318 18.101 ( 0.250 0.196 -0.916) 0.969 ======================= Grid point 286 (136/306) ======================= q-point: (-0.30 -0.30 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 305 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.000 ( -9.306 0.000 2.619) 9.668 1.201 ( -15.032 0.000 -4.785) 15.775 1.583 ( -11.093 0.000 -2.715) 11.420 1.585 ( 1.367 -0.000 3.015) 3.310 2.019 ( -7.088 0.000 2.428) 7.492 2.291 ( -3.349 0.000 -2.148) 3.979 2.517 ( 2.540 -0.000 -5.415) 5.981 2.647 ( 5.307 -0.000 3.126) 6.159 2.669 ( 0.190 -0.000 -0.034) 0.193 2.843 ( -4.582 0.000 3.008) 5.482 2.964 ( -1.399 0.000 1.061) 1.756 3.065 ( 1.075 -0.000 -1.804) 2.100 3.307 ( 4.373 -0.000 2.116) 4.858 3.459 ( 2.377 -0.000 1.296) 2.707 4.041 ( -4.243 0.000 -3.061) 5.232 4.378 ( -6.963 0.000 8.516) 11.000 5.185 ( 13.198 -0.000 -2.560) 13.444 5.631 ( 11.216 -0.000 -3.371) 11.712 8.730 ( -7.813 0.000 -17.969) 19.595 9.095 ( -17.670 0.000 29.710) 34.568 9.810 ( 9.229 -0.000 -11.836) 15.009 10.998 ( -2.048 0.000 5.774) 6.126 14.571 ( -8.016 0.000 3.507) 8.749 14.794 ( -8.396 0.000 8.818) 12.176 15.563 ( 2.433 -0.000 -3.280) 4.084 15.933 ( -0.057 0.000 -4.931) 4.931 17.136 ( -10.421 0.000 -2.939) 10.828 17.173 ( -2.121 0.000 -4.223) 4.725 17.838 ( 10.125 -0.000 2.584) 10.450 18.118 ( 7.949 -0.000 -0.900) 8.000 ======================= Grid point 287 (137/306) ======================= q-point: (-0.20 -0.30 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.898 ( -12.431 0.613 1.365) 12.521 0.998 ( -13.804 -3.822 0.531) 14.333 1.387 ( -10.789 3.383 -1.793) 11.448 1.638 ( 3.233 -0.527 0.109) 3.277 1.975 ( -6.072 2.269 1.347) 6.620 2.192 ( -12.011 -6.755 -3.086) 14.121 2.486 ( 2.362 0.677 -4.849) 5.436 2.628 ( -4.121 0.796 -0.907) 4.294 2.687 ( 1.795 -0.737 -0.039) 1.941 2.882 ( 0.943 2.095 5.097) 5.591 3.003 ( 0.205 -5.150 2.257) 5.626 3.087 ( 3.902 -0.051 0.498) 3.934 3.366 ( 3.073 1.440 1.286) 3.629 3.493 ( 2.033 0.530 0.570) 2.177 3.986 ( -1.369 -0.006 -0.959) 1.672 4.377 ( -7.588 -1.466 6.085) 9.837 5.231 ( 12.244 12.702 -1.476) 17.705 5.774 ( 9.381 -8.356 -5.760) 13.821 8.466 ( -6.351 0.026 -11.303) 12.965 9.168 ( -14.475 -2.475 15.342) 21.237 9.852 ( 6.774 5.313 6.157) 10.584 11.052 ( -1.550 -5.633 4.146) 7.165 14.480 ( -7.327 4.926 5.406) 10.352 14.848 ( -8.467 -8.256 8.018) 14.288 15.533 ( 3.516 5.163 -2.953) 6.910 15.822 ( -2.965 4.275 -5.879) 7.851 17.008 ( -7.789 -2.527 -2.399) 8.533 17.109 ( -1.968 -3.331 -6.928) 7.935 17.999 ( 10.327 -0.850 2.810) 10.736 18.159 ( 4.318 2.471 -3.349) 5.997 ======================= Grid point 288 (138/306) ======================= q-point: (-0.10 -0.30 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.751 ( -11.337 -2.883 0.539) 11.711 0.955 ( -12.093 -7.554 4.663) 15.002 1.228 ( -7.792 -0.386 -1.447) 7.934 1.678 ( 4.036 0.745 -2.116) 4.617 1.760 ( -16.636 -0.725 -6.802) 17.988 2.173 ( -8.460 -8.542 2.685) 12.319 2.452 ( 2.319 1.199 -4.635) 5.320 2.587 ( -2.198 1.277 2.759) 3.752 2.720 ( 2.938 0.108 -0.254) 2.951 2.898 ( -0.842 1.102 2.570) 2.920 3.058 ( 1.675 -1.216 -1.775) 2.727 3.203 ( 4.244 -3.086 5.288) 7.450 3.366 ( 0.505 2.969 -0.116) 3.014 3.512 ( 1.718 1.192 0.416) 2.132 3.975 ( -0.161 -0.090 0.133) 0.227 4.358 ( -7.591 -2.563 2.900) 8.521 5.201 ( 12.816 14.730 0.604) 19.535 5.891 ( 4.315 -6.162 -6.061) 9.660 8.342 ( -3.342 -2.929 -3.776) 5.832 9.153 ( -7.947 -6.179 -0.947) 10.111 9.905 ( -1.068 16.476 18.624) 24.889 11.251 ( 5.334 -12.624 7.869) 15.803 14.413 ( -5.689 2.623 5.969) 8.653 14.925 ( -9.662 -9.728 5.290) 14.696 15.473 ( 5.173 7.114 -2.745) 9.214 15.660 ( -3.698 4.701 -4.024) 7.209 16.950 ( -6.526 -5.346 -0.837) 8.478 17.045 ( -1.927 -4.807 -10.091) 11.342 18.080 ( -1.803 4.855 -4.273) 6.714 18.179 ( 12.286 -0.623 1.143) 12.355 ======================= Grid point 297 (139/306) ======================= q-point: (-0.20 -0.20 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.767 ( -15.479 0.000 0.758) 15.498 0.806 ( -14.102 0.000 7.251) 15.857 1.230 ( -11.872 0.000 -3.333) 12.331 1.681 ( 4.549 -0.000 -1.287) 4.727 1.787 ( -26.151 0.000 -8.978) 27.650 2.025 ( -3.106 0.000 7.174) 7.817 2.466 ( 2.005 -0.000 -4.217) 4.669 2.615 ( -0.663 0.000 3.317) 3.382 2.715 ( 3.755 -0.000 -0.945) 3.872 2.953 ( -1.557 0.000 1.009) 1.855 3.003 ( 3.450 -0.000 2.397) 4.202 3.165 ( 4.392 -0.000 4.229) 6.098 3.411 ( 1.277 -0.000 0.004) 1.277 3.519 ( 1.470 -0.000 -0.233) 1.488 3.973 ( 0.096 -0.000 -0.318) 0.332 4.322 ( -7.964 0.000 3.341) 8.637 5.459 ( 11.082 -0.000 -0.112) 11.083 5.742 ( 7.320 -0.000 -7.286) 10.328 8.297 ( -4.449 0.000 -4.974) 6.673 9.075 ( -8.359 0.000 -2.025) 8.601 10.231 ( 6.567 -0.000 36.469) 37.055 10.972 ( -4.678 0.000 -1.218) 4.834 14.464 ( -9.343 0.000 5.401) 10.792 14.783 ( -7.631 0.000 7.092) 10.418 15.577 ( 3.659 -0.000 -3.096) 4.793 15.733 ( -4.128 0.000 -6.302) 7.534 16.887 ( -4.587 0.000 -2.418) 5.185 16.963 ( -3.253 0.000 -10.535) 11.026 18.135 ( 8.353 -0.000 2.324) 8.670 18.169 ( 2.183 -0.000 -5.954) 6.341 ======================= Grid point 298 (140/306) ======================= q-point: (-0.10 -0.20 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.605 ( -13.573 -0.580 5.557) 14.678 0.753 ( -15.013 -5.749 5.099) 16.866 1.059 ( -12.521 -3.754 -1.778) 13.192 1.378 ( -25.954 -2.606 -3.444) 26.311 1.715 ( 4.209 -0.090 -2.658) 4.979 2.083 ( -3.197 -2.535 5.409) 6.775 2.445 ( 2.256 0.714 -3.727) 4.415 2.659 ( 2.019 3.569 5.188) 6.612 2.756 ( 4.177 -0.694 -1.545) 4.507 2.928 ( -1.590 2.022 1.488) 2.972 3.056 ( 2.630 -0.601 -1.260) 2.977 3.276 ( 3.237 -1.369 4.155) 5.442 3.386 ( -1.450 2.193 -1.043) 2.829 3.536 ( 1.377 -0.618 -0.523) 1.597 3.975 ( 0.411 -0.101 -0.172) 0.457 4.258 ( -7.270 -1.590 0.467) 7.456 5.519 ( 11.252 9.539 1.826) 14.863 5.805 ( 3.696 -5.561 -3.160) 7.387 8.263 ( -1.820 -2.521 2.710) 4.125 8.953 ( -4.473 -3.468 -8.841) 10.497 10.442 ( -3.115 32.082 24.199) 40.306 11.224 ( 11.011 -24.871 15.048) 31.085 14.398 ( -9.006 0.203 4.765) 10.191 14.777 ( -8.243 -4.117 3.509) 9.860 15.562 ( 2.978 3.789 -2.624) 5.487 15.614 ( -2.042 1.161 -3.485) 4.203 16.778 ( -8.148 -2.447 -8.215) 11.827 16.865 ( -0.638 -5.311 -4.997) 7.320 18.057 ( -3.042 5.057 -6.064) 8.462 18.284 ( 8.801 -4.390 -0.477) 9.846 ======================= Grid point 308 (141/306) ======================= q-point: (-0.10 -0.10 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 305 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.516 ( -20.814 0.000 -1.483) 20.867 0.524 ( -12.167 0.000 10.247) 15.907 0.896 ( -14.424 0.000 15.382) 21.087 1.083 ( -15.488 0.000 0.352) 15.492 1.725 ( 2.696 -0.000 -3.173) 4.164 2.094 ( -2.574 0.000 3.823) 4.609 2.442 ( 2.446 -0.000 -3.196) 4.024 2.769 ( 3.430 -0.000 -2.868) 4.471 2.806 ( 6.264 -0.000 1.781) 6.512 2.934 ( -1.288 0.000 0.823) 1.529 3.070 ( 2.079 -0.000 -1.688) 2.678 3.307 ( -0.808 0.000 -2.439) 2.569 3.375 ( -1.301 0.000 2.177) 2.536 3.530 ( 0.423 -0.000 -0.643) 0.769 3.978 ( 0.549 -0.000 -0.475) 0.726 4.158 ( -6.161 0.000 -1.307) 6.298 5.707 ( 6.757 -0.000 1.807) 6.995 5.887 ( 12.306 -0.000 7.537) 14.431 8.304 ( -0.588 0.000 10.148) 10.165 8.782 ( -1.841 0.000 -11.312) 11.461 10.743 ( -3.570 0.000 -8.891) 9.581 11.463 ( 12.476 -0.000 17.788) 21.727 14.319 ( -9.393 0.000 2.791) 9.799 14.669 ( -8.221 0.000 -1.736) 8.403 15.541 ( -1.183 0.000 -3.707) 3.891 15.641 ( 4.624 -0.000 2.530) 5.271 16.602 ( -2.505 0.000 4.435) 5.094 16.799 ( -0.037 0.000 -0.684) 0.685 17.968 ( -5.072 0.000 -6.609) 8.331 18.317 ( 3.698 -0.000 0.057) 3.698 ======================= Grid point 309 (142/306) ======================= q-point: ( 0.00 0.00 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.844 ( -3.200 0.000 9.636) 10.154 0.858 ( 1.993 -0.000 11.450) 11.622 1.048 ( 7.327 -0.000 7.499) 10.484 1.716 ( 1.421 -0.000 3.302) 3.595 1.770 ( 7.228 -0.000 13.970) 15.729 1.998 ( -7.562 0.000 -2.135) 7.857 2.210 ( 3.739 -0.000 -10.042) 10.715 2.603 ( -2.165 0.000 -3.948) 4.503 2.801 ( -0.326 0.000 2.575) 2.595 2.965 ( -0.210 0.000 1.625) 1.639 3.001 ( -4.032 0.000 -4.008) 5.685 3.156 ( 0.807 -0.000 -2.628) 2.749 3.438 ( -0.592 0.000 0.984) 1.148 3.495 ( -0.064 0.000 -1.793) 1.794 3.921 ( -2.785 0.000 -2.944) 4.052 3.946 ( 0.235 -0.000 -1.157) 1.181 5.907 ( 0.295 -0.000 2.717) 2.733 6.280 ( 6.335 -0.000 -4.689) 7.881 8.190 ( -8.338 0.000 -3.564) 9.068 9.113 ( 3.289 -0.000 23.026) 23.260 10.108 ( 2.342 -0.000 -18.804) 18.949 10.897 ( -19.663 0.000 0.276) 19.665 14.089 ( -3.814 0.000 -4.197) 5.671 14.188 ( -4.147 0.000 -9.115) 10.014 15.564 ( 7.203 -0.000 0.962) 7.267 15.575 ( -5.619 0.000 -0.283) 5.626 16.896 ( 0.968 -0.000 4.173) 4.284 17.374 ( 8.184 -0.000 -0.123) 8.185 17.993 ( 7.636 -0.000 1.896) 7.868 18.257 ( -2.368 0.000 -3.164) 3.952 ======================= Grid point 310 (143/306) ======================= q-point: ( 0.10 0.00 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.891 ( -0.082 1.987 9.155) 9.369 1.051 ( -1.043 -7.864 9.676) 12.512 1.226 ( 6.321 1.430 6.870) 9.445 1.789 ( 6.567 0.582 5.897) 8.845 1.851 ( -10.132 -1.114 -4.772) 11.254 2.016 ( 10.343 -1.814 0.665) 10.522 2.196 ( 5.667 -3.222 -3.278) 7.296 2.545 ( -1.588 -0.233 -2.680) 3.124 2.811 ( -1.503 1.442 2.312) 3.112 2.877 ( -5.143 1.099 -3.297) 6.207 2.991 ( -0.703 -0.983 1.185) 1.693 3.149 ( 1.422 -0.175 -1.725) 2.242 3.419 ( -0.764 1.944 -0.534) 2.156 3.483 ( -1.211 -1.843 -0.832) 2.357 3.876 ( -1.071 -1.014 -1.930) 2.429 3.940 ( 1.068 0.290 -0.941) 1.453 5.887 ( -4.017 5.102 2.591) 6.991 6.234 ( 0.786 3.407 -5.753) 6.732 8.076 ( -8.777 0.666 4.631) 9.946 9.439 ( 6.543 -1.188 22.494) 23.456 9.938 ( 3.142 -1.241 -19.197) 19.492 10.735 ( -10.853 -3.355 -0.818) 11.389 14.022 ( -0.154 0.013 -4.262) 4.265 14.119 ( 1.595 -6.715 -6.754) 9.657 15.519 ( -4.050 -0.874 0.078) 4.144 15.689 ( 9.107 -0.999 1.344) 9.260 16.946 ( 0.705 1.189 4.929) 5.119 17.413 ( 2.214 1.018 -1.403) 2.811 18.082 ( 6.369 1.775 -0.093) 6.612 18.182 ( -4.233 -0.494 -4.318) 6.067 ======================= Grid point 311 (144/306) ======================= q-point: ( 0.20 0.00 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 552 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.986 ( 1.319 0.559 8.332) 8.454 1.217 ( -2.377 -6.328 7.529) 10.119 1.304 ( 3.834 4.382 4.681) 7.471 1.686 ( -9.406 -2.489 -6.198) 11.536 1.996 ( 10.647 -4.979 5.378) 12.925 2.063 ( 8.929 2.655 -7.959) 12.253 2.350 ( 6.640 -4.898 1.469) 8.381 2.495 ( -0.702 -1.499 -5.900) 6.128 2.762 ( -5.360 0.127 0.303) 5.370 2.824 ( -1.511 0.086 2.167) 2.643 2.995 ( -0.374 1.558 1.197) 2.000 3.157 ( 1.612 -0.744 -0.930) 2.004 3.385 ( -1.538 0.233 0.274) 1.579 3.477 ( -2.188 -0.857 -0.148) 2.354 3.875 ( -0.057 -1.938 -0.838) 2.113 3.952 ( 2.844 -0.153 -0.414) 2.878 5.721 ( -9.691 11.933 2.063) 15.510 6.136 ( -0.665 1.920 -4.979) 5.378 8.083 ( -5.686 -1.871 11.967) 13.381 9.687 ( 11.446 1.974 -12.196) 16.842 9.848 ( -3.285 -1.847 10.776) 11.416 10.685 ( -2.635 -6.078 -1.878) 6.886 14.013 ( 2.664 -1.965 -1.757) 3.748 14.227 ( 7.534 -10.460 -4.206) 13.559 15.499 ( -2.133 -1.421 0.621) 2.637 15.812 ( 7.073 1.022 1.054) 7.223 17.009 ( 2.308 -0.168 5.150) 5.646 17.397 ( 0.263 0.324 -2.371) 2.408 18.058 ( -5.914 2.027 -5.183) 8.121 18.113 ( 3.111 1.588 -0.703) 3.563 ======================= Grid point 312 (145/306) ======================= q-point: ( 0.30 0.00 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.070 ( 0.966 0.825 5.595) 5.738 1.259 ( -1.212 3.178 2.119) 4.007 1.398 ( 2.757 -1.546 6.657) 7.369 1.560 ( -5.565 -3.208 -5.467) 8.435 2.033 ( 6.126 3.283 -8.548) 11.017 2.231 ( 7.694 -3.939 2.358) 8.960 2.397 ( -0.239 -2.880 -4.060) 4.983 2.524 ( 5.975 -4.212 -2.846) 7.845 2.705 ( -3.814 -0.224 0.567) 3.862 2.873 ( 0.971 -2.787 3.561) 4.625 2.975 ( -0.044 2.987 1.310) 3.262 3.188 ( 2.116 -1.244 0.049) 2.455 3.378 ( -3.607 -0.999 1.431) 4.007 3.446 ( -2.576 0.317 0.615) 2.667 3.895 ( 0.272 -1.499 0.331) 1.559 4.020 ( 5.231 -3.201 0.063) 6.133 5.424 ( -13.232 15.014 1.673) 20.082 6.063 ( -0.883 0.606 -4.136) 4.272 8.232 ( -2.495 -4.066 16.324) 17.007 9.526 ( 6.244 -0.149 -25.372) 26.129 9.942 ( -6.060 7.242 13.179) 16.213 10.823 ( 6.679 -9.657 4.481) 12.567 14.097 ( 4.721 -3.482 2.108) 6.233 14.452 ( 11.143 -12.110 -2.209) 16.604 15.510 ( -0.474 -1.625 0.688) 1.827 15.833 ( 0.510 5.520 0.927) 5.620 17.124 ( 4.810 -2.063 3.523) 6.309 17.376 ( 1.119 -2.257 -3.415) 4.244 17.872 ( -7.081 5.400 -5.196) 10.310 18.115 ( 0.447 0.446 -0.403) 0.749 ======================= Grid point 313 (146/306) ======================= q-point: (-0.60 0.00 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 552 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.113 ( -0.349 0.858 3.042) 3.180 1.200 ( -1.250 5.292 0.429) 5.454 1.476 ( 1.447 -1.851 -2.546) 3.465 1.533 ( -0.159 0.164 3.178) 3.187 1.935 ( 0.564 2.700 -9.110) 9.519 2.289 ( 1.956 -1.357 -3.059) 3.876 2.442 ( 1.988 -1.917 -0.514) 2.809 2.582 ( 0.373 -1.683 -0.746) 1.878 2.738 ( 3.295 -4.309 0.692) 5.469 2.959 ( 0.144 2.663 2.069) 3.375 2.974 ( 3.170 -3.780 2.363) 5.471 3.239 ( 2.744 -1.174 0.362) 3.006 3.301 ( -6.910 2.617 -0.206) 7.392 3.450 ( -1.860 -1.141 2.638) 3.424 3.928 ( 0.187 -1.750 1.457) 2.285 4.164 ( 7.901 -6.749 0.170) 10.393 5.095 ( -13.130 13.538 1.764) 18.942 6.003 ( -1.154 0.138 -3.839) 4.011 8.424 ( -1.508 -1.994 12.995) 13.233 9.372 ( 6.223 -2.959 -17.062) 18.401 9.823 ( -9.340 9.169 4.217) 13.751 11.118 ( 9.419 -7.288 8.625) 14.705 14.246 ( 4.730 -3.639 5.463) 8.090 14.735 ( 12.314 -11.871 -0.473) 17.111 15.533 ( 0.316 -1.398 -0.242) 1.454 15.715 ( -6.105 9.041 1.258) 10.982 17.169 ( 0.330 1.326 -3.143) 3.427 17.473 ( 7.144 -8.079 -1.033) 10.834 17.646 ( -7.070 7.350 -4.384) 11.101 18.111 ( -0.643 -0.297 0.402) 0.814 ======================= Grid point 314 (147/306) ======================= q-point: (-0.50 0.00 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.066 ( -3.878 6.941 2.459) 8.323 1.152 ( -0.949 0.468 -0.827) 1.343 1.480 ( -0.112 5.881 -1.169) 5.997 1.512 ( 0.280 -1.752 -2.589) 3.138 1.832 ( -1.352 -0.091 -4.314) 4.522 2.299 ( 2.349 -2.078 -4.088) 5.152 2.442 ( -0.744 2.172 -0.065) 2.297 2.606 ( -0.193 -1.377 2.421) 2.791 2.808 ( -0.769 -0.923 -0.423) 1.274 2.952 ( -0.733 1.989 2.353) 3.167 3.060 ( -0.130 0.007 -0.030) 0.134 3.184 ( -0.948 -0.807 -1.004) 1.599 3.315 ( 2.700 -1.080 2.829) 4.057 3.463 ( -1.547 -0.485 1.640) 2.306 3.967 ( -0.122 -1.368 1.678) 2.168 4.364 ( 7.266 -8.001 -0.985) 10.853 4.850 ( -6.795 6.380 2.441) 9.635 5.945 ( -1.455 0.090 -3.486) 3.779 8.480 ( -0.839 3.474 2.554) 4.393 9.362 ( 4.199 -0.027 -9.540) 10.423 9.681 ( -8.673 -0.571 9.397) 12.800 11.382 ( 8.409 -2.765 7.254) 11.445 14.404 ( 2.494 -2.506 7.358) 8.163 15.023 ( 11.117 -9.995 1.059) 14.987 15.477 ( -9.463 7.068 -0.806) 11.839 15.570 ( 0.135 2.515 0.492) 2.566 17.078 ( -1.067 2.257 -7.369) 7.780 17.385 ( -8.613 9.534 -1.630) 12.951 17.692 ( 7.413 -9.973 -3.172) 12.825 18.128 ( 1.436 -0.618 1.684) 2.298 ======================= Grid point 315 (148/306) ======================= q-point: (-0.40 0.00 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 552 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.949 ( -5.134 7.979 4.093) 10.333 1.091 ( -7.209 0.665 -1.185) 7.336 1.300 ( -4.168 9.017 -3.462) 10.520 1.562 ( 2.480 -4.089 -2.377) 5.341 1.781 ( -2.465 3.305 1.210) 4.297 2.303 ( 2.084 -1.556 -4.869) 5.520 2.372 ( -4.351 4.644 0.993) 6.441 2.653 ( -1.060 -0.172 3.948) 4.092 2.731 ( -3.468 2.540 -0.839) 4.380 2.944 ( -1.717 0.769 1.930) 2.696 3.026 ( 0.931 0.603 -1.563) 1.917 3.242 ( 2.451 -3.158 -0.787) 4.074 3.394 ( 2.609 0.408 3.973) 4.771 3.466 ( -1.049 -1.790 -0.174) 2.082 3.988 ( -0.314 -0.046 0.930) 0.982 4.391 ( -5.713 0.294 -3.334) 6.622 4.942 ( 11.560 -9.184 3.636) 15.205 5.890 ( -1.643 0.338 -2.383) 2.914 8.436 ( 1.141 4.710 0.437) 4.866 9.170 ( -4.497 8.725 -8.950) 13.283 9.874 ( -3.121 -13.896 14.007) 19.976 11.552 ( 6.998 0.662 4.158) 8.167 14.512 ( -1.603 -0.450 7.205) 7.395 15.181 ( -8.506 5.012 -1.241) 9.951 15.310 ( 3.758 -3.548 2.593) 5.782 15.571 ( 3.482 1.441 -0.683) 3.830 16.930 ( -2.224 3.114 -10.094) 10.796 17.159 ( -7.345 9.786 1.525) 12.330 17.817 ( 1.016 -8.187 -4.150) 9.235 18.209 ( 6.690 -1.098 1.176) 6.881 ======================= Grid point 316 (149/306) ======================= q-point: (-0.30 0.00 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.829 ( -8.497 6.102 3.472) 11.022 0.926 ( -11.806 6.260 4.077) 13.971 1.143 ( -2.879 4.704 -1.365) 5.681 1.563 ( -5.498 1.704 0.428) 5.772 1.731 ( 1.184 5.864 4.064) 7.232 2.224 ( -4.292 4.122 -0.848) 6.010 2.325 ( 1.304 -0.907 -2.488) 2.952 2.650 ( -2.412 -0.923 2.248) 3.424 2.728 ( 2.378 -0.446 -0.739) 2.530 2.937 ( -2.155 -0.314 1.975) 2.940 3.028 ( 2.519 0.267 -1.405) 2.897 3.273 ( 0.522 -1.146 -1.683) 2.103 3.431 ( -1.241 0.824 2.583) 2.981 3.492 ( 1.485 -2.336 -0.788) 2.878 3.982 ( -0.541 0.634 -0.096) 0.839 4.253 ( -7.064 1.036 -3.641) 8.014 5.307 ( 16.421 -12.297 3.502) 20.811 5.856 ( -0.809 -0.243 0.128) 0.854 8.421 ( 1.965 2.310 0.864) 3.153 8.921 ( -5.958 8.823 -2.884) 11.030 10.138 ( -4.003 -15.539 6.582) 17.343 11.634 ( 3.921 1.183 -0.269) 4.104 14.518 ( -6.788 2.076 4.631) 8.475 14.916 ( -11.770 7.368 -3.869) 14.415 15.444 ( 0.949 -4.290 0.839) 4.473 15.635 ( 9.002 2.096 2.638) 9.612 16.741 ( -4.478 3.737 -6.083) 8.427 17.016 ( -1.932 7.947 3.063) 8.733 17.850 ( -2.111 -5.511 -2.777) 6.522 18.312 ( 7.755 -0.135 -1.680) 7.936 ======================= Grid point 317 (150/306) ======================= q-point: (-0.20 0.00 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 552 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.668 ( -8.595 6.437 6.654) 12.632 0.809 ( -6.064 6.476 7.950) 11.912 1.070 ( -4.381 3.767 4.306) 7.206 1.452 ( -6.942 5.397 7.362) 11.468 1.738 ( 2.358 5.134 3.641) 6.721 2.142 ( -2.498 1.592 -0.585) 3.020 2.323 ( 1.804 -1.387 -4.790) 5.303 2.673 ( -0.956 -3.813 -0.961) 4.047 2.748 ( 1.673 -0.106 -0.415) 1.727 2.939 ( -1.728 -0.896 1.225) 2.300 3.047 ( 2.497 0.167 -0.656) 2.587 3.251 ( -0.948 0.198 -2.623) 2.796 3.425 ( -1.866 -0.475 1.105) 2.220 3.515 ( 0.878 -0.343 -0.832) 1.257 3.966 ( -0.416 0.147 -0.672) 0.805 4.122 ( -5.569 1.110 -3.529) 6.686 5.664 ( 12.302 -7.786 2.340) 14.746 5.920 ( 5.666 -5.075 3.079) 8.206 8.415 ( -0.644 -2.491 -5.789) 6.335 8.788 ( -3.540 8.545 11.117) 14.462 10.273 ( -3.103 -12.194 -5.210) 13.618 11.564 ( -7.797 2.118 -7.264) 10.865 14.399 ( -10.165 3.627 0.451) 10.802 14.641 ( -9.866 5.701 -6.990) 13.368 15.479 ( 1.532 -0.687 -1.055) 1.983 15.719 ( 2.117 2.613 1.142) 3.551 16.691 ( 1.867 -1.987 4.520) 5.279 16.994 ( 5.925 5.873 5.556) 10.023 17.858 ( -1.579 -3.065 -0.609) 3.501 18.350 ( 4.787 1.961 -3.490) 6.240 ======================= Grid point 318 (151/306) ======================= q-point: (-0.10 0.00 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.684 ( 2.160 2.768 12.586) 13.067 0.794 ( -2.626 2.154 9.637) 10.218 1.002 ( -2.327 7.236 4.942) 9.066 1.509 ( -0.441 -3.420 13.293) 13.733 1.733 ( 1.445 6.728 4.846) 8.416 2.086 ( -3.299 0.830 -1.185) 3.602 2.283 ( 1.591 -0.485 -8.428) 8.590 2.667 ( -1.679 -2.267 -4.567) 5.368 2.772 ( 0.554 -0.434 1.589) 1.738 2.946 ( -0.908 -1.085 1.096) 1.789 3.057 ( 0.440 0.408 -1.230) 1.368 3.196 ( -1.057 0.457 -3.623) 3.801 3.428 ( -0.988 -0.825 1.132) 1.714 3.511 ( 0.334 0.429 -0.898) 1.049 3.954 ( -0.235 -0.363 -1.055) 1.140 4.009 ( -4.159 1.076 -3.439) 5.503 5.835 ( 3.657 -2.635 2.654) 5.230 6.153 ( 11.999 -6.325 -0.513) 13.573 8.328 ( -4.883 -3.058 -8.972) 10.663 8.872 ( 0.316 4.508 20.906) 21.388 10.253 ( 0.335 -5.426 -14.820) 15.786 11.234 ( -22.300 4.893 -5.835) 23.565 14.223 ( -8.557 2.388 -2.903) 9.346 14.385 ( -7.388 3.655 -8.890) 12.123 15.498 ( 4.184 1.188 -0.391) 4.367 15.660 ( -5.341 1.681 -0.333) 5.609 16.822 ( 1.915 -2.877 3.797) 5.135 17.179 ( 15.719 -0.289 6.165) 16.887 17.891 ( 2.277 -1.264 2.114) 3.355 18.317 ( 0.698 2.139 -3.283) 3.980 ======================= Grid point 320 (152/306) ======================= q-point: ( 0.10 0.10 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 305 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.037 ( 2.545 -0.000 10.554) 10.856 1.089 ( -0.445 0.000 8.816) 8.827 1.391 ( 6.314 -0.000 4.617) 7.822 1.645 ( -9.982 0.000 -6.930) 12.152 1.893 ( 7.415 -0.000 0.038) 7.415 2.193 ( 13.216 -0.000 -0.314) 13.220 2.209 ( 4.871 -0.000 1.303) 5.042 2.479 ( -2.423 0.000 -5.358) 5.880 2.770 ( -6.957 0.000 -0.741) 6.996 2.825 ( -2.135 0.000 2.004) 2.929 3.011 ( 0.689 -0.000 2.262) 2.364 3.146 ( 1.137 -0.000 -1.651) 2.004 3.417 ( -2.071 0.000 -2.593) 3.318 3.429 ( -1.279 0.000 0.390) 1.337 3.850 ( 0.015 -0.000 -0.698) 0.699 3.964 ( 3.401 -0.000 -0.126) 3.404 5.889 ( -5.791 0.000 2.217) 6.201 6.146 ( -5.694 0.000 -6.668) 8.769 8.068 ( -7.555 0.000 12.392) 14.514 9.707 ( 9.373 -0.000 -20.830) 22.842 9.828 ( 3.577 -0.000 22.896) 23.174 10.598 ( -5.206 0.000 -3.463) 6.253 14.029 ( 4.434 -0.000 -4.389) 6.239 14.053 ( 6.684 -0.000 -1.619) 6.878 15.487 ( -0.608 0.000 0.193) 0.638 15.811 ( 9.115 -0.000 0.551) 9.132 17.016 ( 1.027 -0.000 4.779) 4.888 17.404 ( -0.537 0.000 -2.657) 2.710 18.075 ( -5.590 0.000 -3.404) 6.545 18.137 ( 2.791 -0.000 -2.226) 3.570 ======================= Grid point 321 (153/306) ======================= q-point: ( 0.20 0.10 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.129 ( 0.739 3.406 7.321) 8.108 1.246 ( 3.047 -3.354 9.338) 10.379 1.448 ( 1.550 3.099 -2.083) 4.042 1.498 ( -1.092 -0.738 -3.060) 3.331 1.996 ( 10.115 -4.482 -8.056) 13.686 2.252 ( 7.676 5.607 4.563) 10.544 2.352 ( -3.155 -0.853 -6.025) 6.854 2.408 ( 6.738 -5.556 -1.124) 8.805 2.702 ( -6.159 -0.077 2.762) 6.750 2.823 ( -1.996 -1.066 2.487) 3.363 3.037 ( 0.797 1.672 1.790) 2.575 3.146 ( 0.513 -1.509 -1.254) 2.028 3.358 ( -2.737 0.109 -0.908) 2.885 3.426 ( -2.229 -1.538 -0.105) 2.710 3.858 ( 0.623 -0.857 0.303) 1.102 4.020 ( 6.144 1.059 0.621) 6.265 5.748 ( -10.313 10.117 0.643) 14.461 6.013 ( -7.507 -4.192 -5.087) 9.991 8.173 ( -3.800 -0.959 18.584) 18.993 9.506 ( 3.688 -0.871 -24.934) 25.221 10.154 ( 6.239 8.713 19.381) 22.146 10.565 ( 1.195 -9.715 -1.465) 9.897 14.069 ( 7.960 1.145 0.381) 8.051 14.209 ( 10.834 -6.972 -0.141) 12.884 15.502 ( 2.443 0.378 0.544) 2.531 15.899 ( 4.735 0.558 -1.061) 4.884 17.092 ( 3.578 -0.433 4.187) 5.524 17.352 ( -1.656 -0.218 -4.232) 4.550 17.960 ( -5.863 1.710 -3.147) 6.870 18.118 ( -1.199 -0.014 -2.006) 2.337 ======================= Grid point 322 (154/306) ======================= q-point: ( 0.30 0.10 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.152 ( -0.399 2.127 3.355) 3.993 1.317 ( -1.797 0.956 -0.189) 2.044 1.435 ( 4.581 1.806 -2.749) 5.640 1.553 ( 7.644 1.219 5.562) 9.531 2.008 ( 4.277 1.613 -11.518) 12.392 2.261 ( 0.018 -3.298 -6.978) 7.718 2.352 ( 5.560 -0.763 2.826) 6.284 2.537 ( 3.844 -2.117 0.948) 4.489 2.678 ( -2.559 -0.807 2.827) 3.898 2.881 ( 0.255 -3.721 4.338) 5.721 3.027 ( 0.673 2.763 0.581) 2.903 3.178 ( 0.740 -3.250 0.203) 3.339 3.321 ( -4.890 -0.739 0.532) 4.974 3.409 ( -2.971 -1.319 0.626) 3.310 3.890 ( 0.927 -1.459 1.067) 2.032 4.106 ( 8.412 0.918 0.974) 8.518 5.439 ( -13.882 13.634 -0.614) 19.467 5.938 ( -7.255 -5.363 -3.624) 9.723 8.385 ( -0.742 -1.036 20.803) 20.842 9.305 ( 3.562 -2.294 -21.589) 22.001 10.105 ( -2.319 12.992 -0.324) 13.201 10.873 ( 9.322 -11.952 11.897) 19.269 14.198 ( 9.135 -0.072 4.302) 10.097 14.471 ( 13.168 -9.159 1.664) 16.126 15.541 ( 4.396 1.538 0.412) 4.675 15.871 ( -2.595 3.422 -2.080) 4.771 17.188 ( 3.348 0.200 -0.418) 3.380 17.308 ( 1.901 -4.334 -3.666) 5.986 17.810 ( -6.260 5.343 -2.638) 8.643 18.084 ( -3.235 -1.679 -0.400) 3.666 ======================= Grid point 323 (155/306) ======================= q-point: (-0.60 0.10 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.147 ( -0.748 1.553 0.905) 1.947 1.269 ( -0.966 3.577 -0.457) 3.733 1.426 ( 4.702 0.820 -4.428) 6.511 1.671 ( 5.580 5.737 2.906) 8.514 1.868 ( 0.228 3.069 -7.657) 8.252 2.256 ( 2.754 -1.746 -4.653) 5.682 2.442 ( 2.353 -2.419 0.345) 3.392 2.585 ( 0.951 -0.011 1.508) 1.782 2.732 ( 1.631 -3.553 1.363) 4.141 2.971 ( -0.047 -1.818 2.182) 2.841 3.028 ( 2.793 0.172 1.163) 3.030 3.227 ( -2.947 1.067 -2.196) 3.827 3.258 ( -2.025 -2.203 4.075) 5.056 3.416 ( -3.381 -3.076 2.343) 5.136 3.936 ( 1.156 -1.274 1.655) 2.387 4.232 ( 9.389 -1.725 0.754) 9.576 5.095 ( -13.098 12.127 -0.726) 17.864 5.877 ( -7.295 -5.486 -3.195) 9.671 8.566 ( 0.457 3.431 11.810) 12.307 9.238 ( 4.481 -6.697 -7.696) 11.143 9.868 ( -4.622 11.666 -5.105) 13.547 11.239 ( 8.125 -8.147 10.561) 15.618 14.371 ( 7.850 -0.053 6.893) 10.447 14.779 ( 12.936 -9.442 3.287) 16.349 15.564 ( 2.937 3.334 -1.062) 4.569 15.726 ( -5.787 5.942 -1.695) 8.466 17.120 ( -1.661 1.184 -7.447) 7.721 17.444 ( 7.022 -7.905 -2.052) 10.771 17.622 ( -6.876 7.976 -0.959) 10.575 18.083 ( -1.965 -2.975 1.359) 3.816 ======================= Grid point 324 (156/306) ======================= q-point: (-0.50 0.10 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.109 ( -2.621 2.160 0.276) 3.408 1.175 ( -2.728 7.308 -0.559) 7.821 1.458 ( 4.406 -3.245 -3.198) 6.337 1.553 ( -1.067 10.561 -4.814) 11.656 1.857 ( 5.612 3.114 0.863) 6.476 2.260 ( 2.240 -1.427 -3.776) 4.617 2.461 ( -0.847 2.075 0.517) 2.300 2.628 ( 1.069 -1.177 3.261) 3.628 2.773 ( -2.288 -0.813 -0.445) 2.468 2.977 ( -0.675 1.065 0.869) 1.531 3.058 ( -1.986 1.672 0.131) 2.600 3.159 ( 0.689 -2.087 0.051) 2.199 3.350 ( 2.051 -3.019 2.366) 4.350 3.437 ( -2.643 -1.988 2.411) 4.093 3.980 ( 0.892 -0.433 1.675) 1.946 4.359 ( 3.533 -2.215 -1.585) 4.461 4.870 ( -2.578 3.592 0.968) 4.527 5.823 ( -7.253 -5.577 -2.390) 9.456 8.577 ( 2.858 6.597 0.890) 7.245 9.318 ( -1.174 -0.094 -1.313) 1.764 9.686 ( -1.963 1.022 2.631) 3.438 11.489 ( 4.857 -4.974 5.435) 8.825 14.524 ( 4.373 1.375 7.624) 8.896 15.075 ( 9.504 -7.949 4.296) 13.114 15.421 ( -9.786 7.040 -3.177) 12.467 15.654 ( 6.139 4.671 -0.647) 7.741 16.986 ( -2.086 1.490 -9.545) 9.884 17.406 ( -7.274 9.741 1.557) 12.256 17.602 ( 3.659 -8.472 -3.731) 9.954 18.145 ( 2.206 -3.941 1.797) 4.861 ======================= Grid point 325 (157/306) ======================= q-point: (-0.40 0.10 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.009 ( -6.345 6.439 -0.956) 9.090 1.056 ( -4.228 5.455 5.451) 8.795 1.358 ( 1.247 11.736 -5.067) 12.844 1.525 ( 2.709 -3.097 -1.043) 4.244 1.891 ( 5.642 5.659 2.180) 8.283 2.262 ( 1.858 -0.973 -3.720) 4.271 2.387 ( -4.968 5.084 1.288) 7.224 2.684 ( -3.845 2.058 4.188) 6.047 2.710 ( 0.728 -0.375 -1.051) 1.332 2.950 ( -2.598 1.522 1.509) 3.368 3.034 ( 1.538 0.206 -0.875) 1.781 3.221 ( 1.323 -3.136 -0.100) 3.405 3.400 ( -1.874 -3.586 -1.180) 4.215 3.462 ( 0.540 0.387 2.847) 2.924 3.996 ( -0.351 0.658 0.656) 0.994 4.287 ( -6.086 1.879 -3.764) 7.399 5.025 ( 13.536 -9.292 3.317) 16.750 5.784 ( -7.101 -5.629 -0.874) 9.103 8.534 ( 4.896 6.464 -2.962) 8.633 9.145 ( -7.929 8.962 -0.752) 11.990 9.841 ( 1.241 -8.921 8.165) 12.157 11.602 ( 0.773 -3.242 -0.577) 3.382 14.592 ( -0.945 3.872 5.888) 7.110 15.120 ( -9.300 8.430 -4.326) 13.277 15.315 ( 1.802 -5.574 3.704) 6.931 15.706 ( 10.478 3.494 0.181) 11.047 16.829 ( -2.432 3.011 -8.043) 8.926 17.231 ( -5.399 9.451 3.569) 11.455 17.688 ( 0.775 -7.383 -2.970) 7.995 18.254 ( 4.951 -4.281 -0.470) 6.562 ======================= Grid point 326 (158/306) ======================= q-point: (-0.30 0.10 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.861 ( -4.319 8.792 5.369) 11.171 1.016 ( -4.369 6.801 9.508) 12.480 1.196 ( 2.455 9.007 -3.472) 9.961 1.550 ( 0.049 1.362 -0.586) 1.483 1.910 ( 5.518 7.442 3.745) 9.993 2.215 ( -2.988 3.928 -0.692) 4.983 2.301 ( -1.288 0.410 -1.458) 1.988 2.633 ( -2.526 0.868 1.130) 2.901 2.747 ( 1.569 -0.107 0.154) 1.580 2.922 ( -2.794 -0.085 1.290) 3.079 3.051 ( 2.232 -0.019 -0.716) 2.344 3.245 ( -0.722 -1.151 -1.172) 1.794 3.390 ( -1.995 -2.331 -1.868) 3.593 3.491 ( -0.599 -1.131 1.465) 1.946 3.973 ( -1.565 0.640 -0.459) 1.752 4.161 ( -4.087 2.044 -2.835) 5.377 5.398 ( 16.370 -12.388 3.078) 20.758 5.777 ( -5.960 -6.954 1.303) 9.251 8.447 ( 2.404 4.877 -9.297) 10.770 8.998 ( -6.834 8.454 12.284) 16.403 10.022 ( 1.507 -8.028 1.430) 8.293 11.568 ( -5.635 -1.647 -6.368) 8.661 14.522 ( -6.974 6.186 1.703) 9.476 14.835 ( -7.672 9.570 -6.572) 13.915 15.421 ( 0.961 -3.730 2.359) 4.517 15.789 ( 5.529 2.730 0.200) 6.170 16.718 ( 0.659 3.192 -0.720) 3.338 17.138 ( 0.106 6.409 4.384) 7.766 17.752 ( 0.638 -5.383 -0.726) 5.470 18.339 ( 4.175 -3.099 -3.595) 6.322 ======================= Grid point 327 (159/306) ======================= q-point: (-0.20 0.10 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.821 ( -0.694 7.447 9.608) 12.175 0.954 ( -0.185 10.191 6.492) 12.085 1.173 ( 2.183 4.636 6.671) 8.412 1.499 ( 0.120 3.393 0.574) 3.443 1.928 ( 5.041 7.778 4.436) 10.276 2.130 ( -4.187 3.066 1.429) 5.383 2.268 ( 1.078 -0.469 -5.691) 5.811 2.616 ( -1.313 -0.820 -0.813) 1.748 2.758 ( 0.334 -0.275 0.247) 0.498 2.911 ( -2.058 -1.372 0.472) 2.518 3.064 ( 0.753 -0.018 -0.815) 1.110 3.212 ( -1.644 0.341 -2.517) 3.026 3.385 ( -0.996 -2.454 -0.616) 2.719 3.507 ( -0.976 -1.138 0.751) 1.677 3.945 ( -1.326 -0.162 -0.776) 1.545 4.061 ( -2.396 3.064 -2.814) 4.801 5.707 ( 4.443 -7.619 2.216) 9.094 5.897 ( 5.518 -12.894 1.915) 14.155 8.291 ( -2.971 1.670 -9.249) 9.857 9.028 ( -2.791 7.278 20.393) 21.832 10.103 ( 3.769 -5.395 -7.539) 10.007 11.349 ( -14.440 2.848 -8.859) 17.179 14.331 ( -8.974 6.207 -2.446) 11.182 14.556 ( -4.747 9.807 -8.308) 13.701 15.502 ( 3.589 -1.673 1.428) 4.209 15.740 ( -4.555 4.276 -0.795) 6.298 16.761 ( 3.336 -0.457 4.496) 5.617 17.190 ( 7.618 1.476 4.786) 9.117 17.831 ( 2.812 -3.560 1.663) 4.832 18.347 ( 1.339 -0.920 -5.503) 5.738 ======================= Grid point 328 (160/306) ======================= q-point: (-0.10 0.10 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.819 ( -1.871 3.844 7.715) 8.820 0.998 ( 3.803 4.515 11.458) 12.890 1.164 ( 0.205 8.881 5.197) 10.292 1.587 ( 7.350 -3.479 5.937) 10.069 1.939 ( 4.273 6.164 2.662) 7.959 2.040 ( -6.034 3.691 0.473) 7.089 2.219 ( 3.561 1.051 -6.715) 7.673 2.590 ( -1.326 -0.480 -2.388) 2.773 2.779 ( -0.487 -1.392 1.827) 2.348 2.912 ( -1.885 -2.377 -0.583) 3.089 3.038 ( -2.257 0.985 -1.457) 2.861 3.163 ( 0.177 0.607 -2.470) 2.549 3.405 ( -0.272 -2.143 -0.200) 2.169 3.509 ( -0.909 0.106 0.402) 0.999 3.923 ( -1.145 -0.232 -1.392) 1.818 3.968 ( -1.234 2.607 -2.571) 3.863 5.820 ( -2.475 -6.854 2.995) 7.879 6.146 ( 7.504 -9.974 -2.538) 12.737 8.156 ( -6.736 -0.908 -3.178) 7.503 9.180 ( 1.235 4.781 22.534) 23.069 10.080 ( 5.331 -1.686 -15.486) 16.464 11.000 ( -17.519 6.197 -4.330) 19.081 14.133 ( -5.714 3.836 -4.368) 8.151 14.304 ( -1.937 8.769 -8.563) 12.409 15.584 ( 5.233 0.257 0.986) 5.332 15.613 ( -5.033 3.448 0.233) 6.106 16.860 ( 1.439 -1.888 4.862) 5.410 17.338 ( 7.295 -1.895 1.373) 7.661 17.953 ( 6.429 -2.782 2.412) 7.409 18.283 ( -1.871 0.607 -5.414) 5.760 ======================= Grid point 331 (161/306) ======================= q-point: ( 0.20 0.20 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.188 ( -2.251 0.000 3.330) 4.020 1.293 ( -3.611 0.000 -2.714) 4.517 1.499 ( 13.764 -0.000 6.663) 15.292 1.577 ( 5.436 -0.000 -1.000) 5.528 2.003 ( 11.197 -0.000 -9.998) 15.011 2.192 ( -5.007 0.000 -9.233) 10.503 2.409 ( 6.745 -0.000 -3.139) 7.440 2.480 ( 3.781 -0.000 8.996) 9.759 2.672 ( -5.038 0.000 4.438) 6.713 2.821 ( -1.526 0.000 4.236) 4.503 3.086 ( 1.570 -0.000 1.618) 2.254 3.112 ( -0.538 0.000 -2.021) 2.091 3.308 ( -3.559 0.000 -0.268) 3.569 3.390 ( -2.670 0.000 0.238) 2.681 3.871 ( 0.931 -0.000 1.206) 1.523 4.128 ( 8.401 -0.000 0.918) 8.451 5.718 ( -10.841 0.000 0.574) 10.857 5.763 ( -12.834 0.000 -5.656) 14.025 8.373 ( -0.770 0.000 23.605) 23.617 9.274 ( 3.135 -0.000 -23.328) 23.538 10.359 ( -2.499 0.000 -10.947) 11.228 10.632 ( 11.802 -0.000 22.717) 25.600 14.223 ( 11.342 -0.000 3.104) 11.759 14.328 ( 12.864 -0.000 3.143) 13.243 15.570 ( 6.437 -0.000 0.590) 6.464 15.905 ( -0.856 0.000 -3.435) 3.540 17.186 ( 6.260 -0.000 2.363) 6.691 17.261 ( -2.935 0.000 -6.546) 7.174 17.885 ( -4.545 0.000 -1.083) 4.672 18.053 ( -5.284 0.000 -1.475) 5.486 ======================= Grid point 332 (162/306) ======================= q-point: ( 0.30 0.20 -0.73) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.178 ( -1.446 0.789 0.702) 1.791 1.243 ( -0.555 -1.929 -3.217) 3.792 1.562 ( 3.139 5.494 -2.847) 6.939 1.762 ( 13.737 1.705 5.844) 15.025 1.967 ( 3.142 4.970 -9.446) 11.126 2.137 ( 5.267 -7.757 -7.098) 11.760 2.418 ( 1.585 1.125 -1.135) 2.250 2.591 ( 2.063 0.180 3.494) 4.062 2.678 ( -1.578 -0.848 3.419) 3.860 2.898 ( 0.034 -2.782 6.428) 7.004 3.064 ( 0.349 2.035 -1.009) 2.298 3.154 ( 2.585 -3.273 0.725) 4.233 3.268 ( -5.076 0.238 2.239) 5.553 3.360 ( -3.689 -1.099 0.550) 3.888 3.907 ( 1.466 -0.761 1.729) 2.391 4.241 ( 9.135 1.021 0.797) 9.227 5.405 ( -14.339 12.390 -2.486) 19.112 5.685 ( -12.056 -9.842 -2.894) 15.830 8.640 ( 1.055 2.095 23.728) 23.843 9.103 ( 4.373 -3.445 -17.269) 18.144 10.136 ( -2.773 7.809 -12.227) 14.770 11.037 ( 9.018 -6.275 16.698) 19.988 14.402 ( 11.441 2.245 6.151) 13.182 14.581 ( 13.512 -5.921 4.747) 15.497 15.653 ( 8.135 2.968 -0.188) 8.661 15.807 ( -5.744 0.865 -4.501) 7.348 17.136 ( -3.209 0.142 -8.208) 8.814 17.302 ( 7.423 -2.964 -1.120) 8.071 17.799 ( -4.314 5.635 0.489) 7.114 17.992 ( -6.037 -3.872 0.624) 7.199 ======================= Grid point 333 (163/306) ======================= q-point: (-0.60 0.20 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 552 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.149 ( -1.144 1.114 -0.953) 1.859 1.243 ( -0.078 -1.369 -1.443) 1.991 1.477 ( -0.168 3.879 -3.044) 4.934 1.807 ( 4.807 10.035 -5.290) 12.320 1.933 ( 8.786 2.770 0.215) 9.215 2.230 ( 5.589 -2.239 -3.682) 7.057 2.442 ( 1.966 -2.855 0.399) 3.489 2.627 ( 0.956 0.993 2.157) 2.560 2.719 ( -0.211 -2.348 1.373) 2.728 2.969 ( -0.764 -1.400 1.997) 2.555 3.055 ( 0.923 -0.479 -0.263) 1.072 3.186 ( -3.750 1.846 -0.265) 4.188 3.280 ( 1.592 -2.197 4.521) 5.273 3.357 ( -3.150 -3.524 2.970) 5.582 3.963 ( 2.485 -0.958 1.821) 3.227 4.344 ( 7.732 1.031 0.314) 7.807 5.059 ( -12.196 10.565 -2.150) 16.279 5.627 ( -11.865 -10.071 -2.631) 15.784 8.756 ( 3.806 7.905 3.510) 9.450 9.178 ( 2.491 -8.362 7.555) 11.542 9.857 ( -2.611 8.640 -12.312) 15.266 11.345 ( 4.499 -5.836 9.692) 12.175 14.577 ( 8.900 2.877 7.692) 12.110 14.882 ( 11.576 -7.176 5.874) 14.832 15.579 ( -7.046 5.433 -4.648) 10.038 15.759 ( 7.427 3.047 -1.917) 8.253 17.004 ( -2.553 0.034 -8.698) 9.065 17.409 ( 5.794 -5.397 -3.994) 8.868 17.651 ( -6.639 8.852 2.028) 11.249 18.021 ( -1.941 -5.981 2.088) 6.626 ======================= Grid point 334 (164/306) ======================= q-point: (-0.50 0.20 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.105 ( -1.331 2.290 -0.113) 2.651 1.194 ( -4.274 4.051 0.776) 5.939 1.459 ( 2.741 -1.544 -0.271) 3.158 1.670 ( 5.599 12.656 -5.633) 14.941 1.997 ( 8.361 2.958 -1.336) 8.969 2.252 ( 2.314 0.735 -1.148) 2.686 2.482 ( -0.506 1.574 0.651) 1.777 2.666 ( 1.693 -1.126 2.549) 3.260 2.730 ( -2.675 -0.325 0.341) 2.716 2.984 ( -0.381 -0.195 0.353) 0.555 3.052 ( -2.056 1.108 0.094) 2.338 3.145 ( -1.073 -1.634 1.538) 2.487 3.315 ( -2.923 -2.972 -0.006) 4.169 3.447 ( 2.289 -1.811 3.696) 4.710 4.019 ( 2.805 0.785 1.259) 3.173 4.355 ( -2.175 3.819 -2.210) 4.919 4.899 ( 2.393 -0.373 0.862) 2.571 5.585 ( -11.448 -10.280 -1.438) 15.453 8.718 ( 7.121 7.971 -3.688) 11.307 9.316 ( -8.139 3.141 8.390) 12.104 9.701 ( 4.319 -1.616 -2.361) 5.181 11.499 ( -0.486 -4.569 2.298) 5.137 14.700 ( 4.095 4.628 7.056) 9.379 15.146 ( 6.396 -5.826 5.771) 10.400 15.344 ( -8.650 7.063 -4.888) 12.190 15.795 ( 9.664 3.441 -3.393) 10.805 16.887 ( -0.510 1.797 -6.678) 6.934 17.464 ( -4.577 7.070 2.174) 8.698 17.510 ( 0.962 -4.475 -2.855) 5.394 18.116 ( 1.033 -6.662 0.958) 6.809 ======================= Grid point 335 (165/306) ======================= q-point: (-0.40 0.20 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 552 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.067 ( -0.671 6.878 5.001) 8.530 1.109 ( -3.591 2.932 3.816) 6.005 1.508 ( 3.802 11.712 -3.728) 12.865 1.537 ( 5.638 0.478 -1.340) 5.815 2.043 ( 8.092 3.200 -2.083) 8.947 2.259 ( 1.835 0.852 -0.497) 2.084 2.405 ( -5.156 5.955 1.479) 8.014 2.679 ( -2.110 1.456 -0.517) 2.615 2.737 ( 0.790 -0.642 3.155) 3.315 2.950 ( -3.248 2.172 0.940) 4.019 3.040 ( 0.510 -0.837 -0.409) 1.061 3.180 ( -2.485 -3.642 0.419) 4.429 3.320 ( -0.832 -3.265 -1.116) 3.549 3.486 ( -0.610 0.653 0.315) 0.948 4.018 ( -0.238 3.384 0.104) 3.394 4.224 ( -3.750 3.290 -1.571) 5.230 5.112 ( 13.821 -10.016 2.771) 17.292 5.563 ( -11.343 -10.402 0.124) 15.391 8.628 ( 6.078 9.154 -10.336) 15.085 9.201 ( -9.746 7.808 12.754) 17.850 9.852 ( 6.037 -6.264 1.632) 8.851 11.501 ( -5.463 -3.396 -3.934) 7.540 14.692 ( -3.428 7.286 3.173) 8.655 15.088 ( -4.390 10.471 -5.476) 12.605 15.313 ( 0.636 -4.780 4.556) 6.634 15.841 ( 7.186 1.264 -3.179) 7.959 16.813 ( 2.979 4.288 -2.056) 5.612 17.319 ( -4.911 8.143 3.896) 10.277 17.599 ( 3.354 -6.843 -1.749) 7.819 18.212 ( 1.176 -6.757 -1.845) 7.103 ======================= Grid point 336 (166/306) ======================= q-point: (-0.30 0.20 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.014 ( -1.984 7.632 6.283) 10.083 1.142 ( -0.807 3.256 10.094) 10.637 1.360 ( 7.481 12.336 -4.280) 15.049 1.585 ( 3.520 2.033 -0.189) 4.069 2.066 ( 6.138 3.450 -2.831) 7.589 2.265 ( 2.240 1.657 -0.055) 2.787 2.270 ( -5.814 6.459 1.686) 8.852 2.637 ( -0.827 1.885 -0.096) 2.061 2.764 ( -0.042 0.409 0.697) 0.809 2.898 ( -3.172 0.830 0.704) 3.353 3.047 ( -0.878 -1.692 -1.463) 2.403 3.178 ( -2.945 -3.152 -1.082) 4.447 3.341 ( 0.889 -1.130 -1.063) 1.788 3.462 ( -2.723 -1.630 0.368) 3.195 3.965 ( -1.683 2.400 0.416) 2.961 4.152 ( -0.109 4.072 -0.943) 4.181 5.468 ( 13.124 -11.453 2.354) 17.577 5.574 ( -8.695 -12.792 1.632) 15.553 8.424 ( 0.369 8.767 -11.516) 14.478 9.211 ( -5.563 7.202 21.505) 23.351 9.984 ( 7.452 -4.826 -5.771) 10.589 11.365 ( -10.603 -1.137 -7.430) 12.996 14.516 ( -8.737 8.519 -1.534) 12.299 14.845 ( -0.865 13.080 -7.040) 14.879 15.421 ( 0.883 -4.475 4.018) 6.078 15.833 ( -1.175 2.635 -1.747) 3.372 16.815 ( 5.228 4.413 2.107) 7.159 17.259 ( 1.179 4.157 3.864) 5.796 17.719 ( 4.467 -5.475 0.949) 7.130 18.260 ( -0.539 -5.890 -4.639) 7.517 ======================= Grid point 337 (167/306) ======================= q-point: (-0.20 0.20 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 552 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.969 ( -2.584 6.482 5.681) 8.998 1.142 ( -0.839 7.509 7.131) 10.390 1.351 ( 2.922 5.374 3.886) 7.247 1.603 ( 9.489 4.410 1.277) 10.541 2.031 ( -2.138 2.614 -2.345) 4.111 2.157 ( 0.987 4.370 -4.224) 6.158 2.279 ( 3.741 3.702 2.016) 5.636 2.604 ( 0.155 1.614 -1.471) 2.189 2.761 ( -0.763 0.206 1.504) 1.699 2.867 ( -2.555 -0.960 -0.329) 2.749 3.026 ( -2.820 -2.153 -2.194) 4.171 3.167 ( -0.575 -0.864 -1.597) 1.904 3.356 ( 0.317 -1.179 0.606) 1.363 3.475 ( -1.905 -2.844 1.072) 3.587 3.929 ( -1.242 1.335 0.221) 1.836 4.077 ( 0.113 5.830 -1.856) 6.119 5.588 ( -9.381 -11.517 3.196) 15.194 5.846 ( 11.649 -13.379 -0.166) 17.740 8.216 ( -3.385 6.179 -4.864) 8.561 9.322 ( -2.670 6.393 22.757) 23.788 10.030 ( 9.155 -2.794 -13.446) 16.505 11.118 ( -13.730 2.789 -6.783) 15.566 14.278 ( -7.565 7.706 -3.497) 11.351 14.591 ( 1.026 13.986 -8.276) 16.283 15.540 ( 2.973 -3.960 3.480) 6.053 15.723 ( -5.766 4.923 -0.027) 7.582 16.861 ( 3.412 2.545 4.067) 5.887 17.315 ( 5.229 0.256 2.055) 5.624 17.866 ( 6.239 -4.238 2.503) 7.946 18.240 ( -2.897 -4.243 -6.260) 8.098 ======================= Grid point 338 (168/306) ======================= q-point: (-0.10 0.20 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.930 ( -1.221 4.529 6.045) 7.652 1.175 ( 1.518 1.349 7.935) 8.191 1.288 ( -4.138 7.404 4.123) 9.431 1.778 ( 13.564 0.243 5.409) 14.604 1.893 ( -9.055 1.978 -3.744) 9.996 2.092 ( 7.589 4.255 -8.373) 12.075 2.311 ( 5.657 4.717 2.393) 7.745 2.564 ( 0.054 1.395 -3.038) 3.343 2.779 ( -1.168 -0.181 3.187) 3.399 2.841 ( -2.951 -1.702 -1.623) 3.773 2.993 ( -2.653 -1.462 -0.751) 3.121 3.156 ( 1.166 0.211 -1.452) 1.874 3.383 ( -0.280 -0.968 0.974) 1.401 3.492 ( -1.760 -1.526 0.834) 2.474 3.904 ( -0.669 0.629 -0.504) 1.048 3.983 ( 0.305 5.226 -2.029) 5.614 5.657 ( -9.487 -12.683 3.193) 16.157 6.081 ( 6.426 -8.539 -3.182) 11.151 8.097 ( -5.354 3.408 3.908) 7.454 9.490 ( 2.253 2.861 19.107) 19.451 9.971 ( 5.594 0.591 -16.816) 17.732 10.855 ( -9.973 5.226 -3.151) 11.691 14.090 ( -3.034 5.336 -3.292) 6.965 14.366 ( 3.891 12.877 -7.245) 15.279 15.572 ( -5.409 3.184 0.894) 6.340 15.691 ( 5.775 -1.529 2.247) 6.383 16.928 ( 2.312 0.726 5.185) 5.723 17.385 ( 3.187 -0.807 -0.538) 3.332 18.017 ( 6.247 -3.296 1.393) 7.199 18.163 ( -4.904 -2.644 -6.240) 8.365 ======================= Grid point 342 (169/306) ======================= q-point: ( 0.30 0.30 -0.73) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 305 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.163 ( -1.082 0.000 -0.909) 1.413 1.215 ( 2.079 -0.000 -1.691) 2.680 1.535 ( -3.771 0.000 -3.967) 5.474 1.967 ( 7.481 -0.000 -2.925) 8.033 2.016 ( 2.569 -0.000 -1.876) 3.181 2.116 ( 18.786 -0.000 -3.651) 19.137 2.409 ( -1.111 0.000 -0.915) 1.439 2.645 ( 1.291 -0.000 2.279) 2.619 2.687 ( -1.188 0.000 2.264) 2.557 2.942 ( -0.940 0.000 4.281) 4.383 3.056 ( -0.891 0.000 -0.973) 1.319 3.191 ( 3.031 -0.000 -0.589) 3.087 3.268 ( -1.467 0.000 7.592) 7.732 3.304 ( -4.610 0.000 0.510) 4.638 3.948 ( 2.829 -0.000 1.907) 3.412 4.366 ( 8.493 -0.000 0.536) 8.510 5.343 ( -11.888 0.000 -2.826) 12.219 5.352 ( -16.564 0.000 -2.947) 16.824 8.959 ( 6.799 -0.000 -14.686) 16.183 8.967 ( 0.759 -0.000 27.625) 27.636 9.982 ( -2.919 0.000 -16.630) 16.884 11.260 ( 4.840 -0.000 12.893) 13.772 14.638 ( 10.527 -0.000 7.453) 12.899 14.766 ( 12.473 -0.000 6.581) 14.102 15.656 ( -8.378 0.000 -5.835) 10.210 15.793 ( 10.531 -0.000 -1.811) 10.686 17.000 ( -2.720 0.000 -8.113) 8.557 17.341 ( 6.144 -0.000 -4.354) 7.530 17.849 ( 0.086 -0.000 2.640) 2.641 17.859 ( -9.782 0.000 1.732) 9.935 ======================= Grid point 343 (170/306) ======================= q-point: (-0.60 0.30 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.139 ( -0.470 0.643 -0.472) 0.925 1.239 ( 1.987 0.270 0.089) 2.007 1.455 ( -2.507 0.538 -0.212) 2.573 1.926 ( 5.782 6.582 -7.498) 11.532 2.045 ( 6.226 1.169 -1.720) 6.564 2.298 ( 8.084 2.774 -0.166) 8.548 2.431 ( 3.401 -4.573 0.482) 5.720 2.670 ( 0.210 1.104 1.599) 1.954 2.702 ( -0.680 -1.401 1.241) 1.991 2.960 ( -1.334 -0.868 1.168) 1.974 3.043 ( -0.674 -0.667 -0.196) 0.968 3.166 ( -4.091 1.404 0.976) 4.434 3.262 ( -4.309 -1.271 0.800) 4.563 3.397 ( 4.622 -1.487 5.960) 7.687 4.021 ( 5.470 -0.296 1.553) 5.694 4.450 ( 5.421 2.660 0.032) 6.039 5.007 ( -12.120 8.362 -2.304) 14.904 5.301 ( -12.575 -11.830 -1.844) 17.364 8.894 ( 8.881 5.212 -7.132) 12.526 9.284 ( -3.291 -3.180 24.206) 24.634 9.744 ( -0.174 2.543 -16.936) 17.127 11.406 ( -0.676 -2.328 5.657) 6.155 14.808 ( 6.924 3.669 7.778) 11.041 15.010 ( 8.562 -4.317 6.884) 11.804 15.477 ( -6.735 3.059 -5.129) 9.001 15.859 ( 8.056 1.428 -6.234) 10.286 16.919 ( 1.727 0.715 -4.197) 4.595 17.368 ( 4.774 -3.131 -5.723) 8.083 17.695 ( -8.540 7.815 2.843) 11.921 17.942 ( -0.945 -6.878 2.049) 7.239 ======================= Grid point 344 (171/306) ======================= q-point: (-0.50 0.30 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.136 ( 0.339 1.118 2.214) 2.503 1.234 ( -0.038 4.464 2.859) 5.301 1.483 ( 2.893 -1.668 2.401) 4.113 1.814 ( 5.441 9.093 -7.888) 13.210 2.089 ( 6.869 1.155 -2.434) 7.378 2.309 ( 2.075 3.361 0.854) 4.041 2.504 ( 0.869 1.127 -0.013) 1.423 2.674 ( -0.256 -0.913 -0.280) 0.989 2.727 ( -0.257 -0.397 2.693) 2.734 2.964 ( -1.954 -1.447 0.139) 2.435 3.038 ( -1.445 0.242 0.178) 1.476 3.116 ( -4.209 -0.504 1.354) 4.450 3.245 ( -2.672 -2.461 0.492) 3.666 3.494 ( 1.752 -0.165 1.227) 2.146 4.107 ( 7.065 2.336 0.482) 7.457 4.362 ( -5.672 8.632 -0.852) 10.364 4.923 ( 3.842 -5.399 1.130) 6.722 5.284 ( -11.646 -11.360 -0.225) 16.271 8.859 ( 9.473 8.568 -7.795) 14.963 9.365 ( -12.533 5.071 12.813) 18.627 9.704 ( 8.061 -5.556 -2.129) 10.019 11.420 ( -5.557 -2.710 -1.325) 6.323 14.867 ( -0.264 6.653 4.990) 8.320 15.189 ( -0.146 -4.943 4.400) 6.620 15.326 ( 0.636 7.838 -2.309) 8.195 15.845 ( 5.204 -0.826 -8.296) 9.828 16.923 ( 6.924 4.418 -0.155) 8.215 17.431 ( 4.944 -6.292 -3.858) 8.883 17.524 ( -7.958 7.998 3.225) 11.735 18.029 ( -1.545 -7.553 -0.053) 7.710 ======================= Grid point 345 (172/306) ======================= q-point: (-0.40 0.30 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.144 ( -1.990 2.392 3.154) 4.431 1.239 ( 3.105 5.333 7.535) 9.740 1.570 ( 2.643 0.575 1.872) 3.289 1.683 ( 7.422 8.994 -6.871) 13.535 2.128 ( 6.583 1.737 -3.032) 7.453 2.294 ( -0.440 2.405 0.282) 2.461 2.447 ( -2.062 5.672 1.282) 6.170 2.669 ( 0.262 0.381 -1.032) 1.131 2.761 ( -0.762 -0.599 2.161) 2.368 2.936 ( -3.688 -0.393 -0.297) 3.720 2.995 ( -4.529 -0.023 -1.028) 4.644 3.105 ( -1.513 -2.278 -0.027) 2.735 3.278 ( 0.017 -3.720 0.986) 3.849 3.467 ( -2.430 1.349 -2.481) 3.726 4.092 ( 0.373 8.034 0.688) 8.072 4.248 ( 0.761 3.669 1.313) 3.971 5.161 ( 8.933 -13.562 1.464) 16.305 5.286 ( -9.071 -9.753 1.596) 13.414 8.696 ( 3.731 12.648 -11.593) 17.559 9.357 ( -7.197 3.842 19.649) 21.275 9.851 ( 7.601 -5.703 -4.440) 10.489 11.318 ( -9.096 -2.201 -5.530) 10.870 14.736 ( -7.718 9.040 -0.198) 11.888 15.171 ( 2.898 12.094 -4.026) 13.072 15.300 ( -1.712 -4.425 3.927) 6.159 15.848 ( 2.309 -1.710 -3.855) 4.808 16.958 ( 8.274 6.888 1.200) 10.833 17.387 ( -4.462 5.912 3.182) 8.061 17.566 ( 6.646 -6.810 -0.303) 9.521 18.081 ( -3.222 -8.025 -2.692) 9.057 ======================= Grid point 346 (173/306) ======================= q-point: (-0.30 0.30 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.107 ( -2.531 4.591 3.975) 6.579 1.306 ( 0.444 4.944 8.653) 9.976 1.490 ( 0.551 6.471 -3.813) 7.531 1.718 ( 11.179 3.706 0.008) 11.778 2.115 ( -1.276 4.501 -1.483) 4.908 2.231 ( -0.415 1.750 -3.521) 3.954 2.392 ( 1.929 5.282 1.978) 5.961 2.651 ( 1.722 1.847 -2.185) 3.339 2.758 ( -2.163 -0.899 0.275) 2.358 2.895 ( -2.229 2.458 1.374) 3.591 2.931 ( -4.689 -4.487 -3.365) 7.311 3.125 ( 0.305 -2.003 -0.377) 2.061 3.334 ( 0.333 -2.454 1.001) 2.671 3.404 ( -2.855 -1.087 -0.474) 3.091 4.015 ( -1.092 5.939 2.293) 6.460 4.229 ( 2.949 6.032 -0.081) 6.715 5.275 ( -13.740 -13.553 2.286) 19.434 5.521 ( 14.101 -12.440 1.052) 18.833 8.450 ( -0.386 12.373 -6.675) 14.064 9.471 ( -6.234 4.897 23.843) 25.126 9.925 ( 9.807 -5.643 -14.197) 18.154 11.144 ( -10.577 -0.238 -5.841) 12.085 14.498 ( -8.488 9.779 -2.032) 13.108 14.964 ( 3.658 15.742 -7.898) 17.988 15.405 ( -1.314 -6.608 5.455) 8.668 15.822 ( -2.580 2.428 -0.529) 3.583 16.978 ( 5.533 6.542 2.279) 8.866 17.350 ( 2.072 2.455 1.750) 3.659 17.745 ( 7.579 -5.536 2.233) 9.647 18.085 ( -5.016 -7.832 -4.967) 10.544 ======================= Grid point 347 (174/306) ======================= q-point: (-0.20 0.30 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.059 ( -2.408 5.263 4.065) 7.073 1.277 ( -1.137 6.768 3.099) 7.531 1.420 ( -3.980 2.852 3.138) 5.816 1.825 ( 12.370 3.055 0.476) 12.751 1.947 ( -11.074 3.225 -2.503) 11.802 2.207 ( 8.384 4.199 -5.175) 10.710 2.397 ( 3.319 2.672 1.280) 4.448 2.616 ( 2.929 2.845 -4.104) 5.790 2.769 ( -0.950 -2.312 1.423) 2.877 2.843 ( -1.779 2.832 0.388) 3.367 2.919 ( -2.871 -4.035 -0.896) 5.033 3.144 ( 0.944 -1.248 -1.111) 1.919 3.367 ( 0.105 -0.633 1.960) 2.063 3.418 ( -2.037 -3.891 1.003) 4.505 3.959 ( -1.348 4.384 1.659) 4.878 4.161 ( 2.047 8.381 -1.457) 8.750 5.309 ( -13.682 -14.673 3.563) 20.377 5.832 ( 11.331 -11.321 -1.291) 16.070 8.264 ( -2.312 10.058 1.736) 10.466 9.578 ( -3.847 4.096 16.850) 17.762 9.929 ( 6.871 -4.531 -15.649) 17.681 10.958 ( -7.323 2.967 -3.262) 8.548 14.270 ( -5.480 8.927 -1.653) 10.605 14.730 ( 5.259 16.103 -8.058) 18.759 15.540 ( -0.486 -6.633 5.374) 8.551 15.722 ( -4.537 4.793 0.296) 6.606 17.000 ( 4.283 4.825 3.978) 7.579 17.384 ( 4.194 0.790 -0.515) 4.299 17.921 ( 6.112 -4.447 1.917) 7.798 18.046 ( -5.579 -6.646 -5.870) 10.476 ======================= Grid point 348 (175/306) ======================= q-point: (-0.10 0.30 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.026 ( -0.987 3.507 4.871) 6.083 1.240 ( -0.808 0.533 0.932) 1.344 1.370 ( -4.475 4.750 7.628) 10.039 1.744 ( -9.107 2.192 -4.870) 10.558 1.952 ( 9.192 -1.947 -1.705) 9.549 2.203 ( 9.355 6.688 -3.226) 11.943 2.422 ( 2.822 1.386 0.022) 3.144 2.565 ( 4.009 4.140 -5.180) 7.749 2.760 ( -3.835 -0.747 -1.736) 4.276 2.840 ( 1.529 1.582 4.088) 4.642 2.935 ( -1.403 -2.841 0.961) 3.311 3.164 ( 2.253 -0.516 -0.635) 2.397 3.393 ( -1.137 -0.068 2.295) 2.562 3.446 ( -2.135 -2.892 0.867) 3.698 3.914 ( -0.844 2.436 0.699) 2.671 4.061 ( 2.099 8.113 -1.542) 8.521 5.369 ( -13.197 -15.562 3.338) 20.676 6.028 ( 5.838 -6.758 -3.383) 9.550 8.190 ( -3.046 7.037 9.996) 12.599 9.638 ( 7.339 -1.302 -9.063) 11.735 9.873 ( -7.258 -0.882 3.357) 8.045 10.844 ( 0.825 5.957 0.134) 6.015 14.123 ( -0.599 6.670 -0.058) 6.698 14.543 ( 8.103 14.707 -5.817) 17.770 15.569 ( -4.248 3.697 1.493) 5.827 15.721 ( 1.351 -5.918 2.777) 6.675 17.053 ( 4.505 3.316 4.602) 7.244 17.403 ( 2.758 1.136 -2.141) 3.672 17.954 ( -6.774 -6.218 -6.075) 11.021 18.068 ( 3.929 -2.285 0.505) 4.573 ======================= Grid point 353 (176/306) ======================= q-point: ( 0.40 0.40 -0.73) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.150 ( 0.419 -0.000 1.661) 1.713 1.290 ( 3.109 -0.000 1.966) 3.678 1.461 ( 0.993 -0.000 3.607) 3.741 1.926 ( 4.178 -0.000 -9.680) 10.543 2.107 ( 4.896 -0.000 -0.947) 4.987 2.394 ( -0.269 0.000 1.689) 1.711 2.471 ( 9.393 -0.000 -1.543) 9.519 2.671 ( -1.871 0.000 0.148) 1.876 2.715 ( 0.605 -0.000 1.699) 1.804 2.940 ( -2.727 0.000 0.825) 2.849 3.031 ( -0.577 0.000 0.438) 0.725 3.127 ( -4.950 0.000 0.521) 4.977 3.211 ( -4.025 0.000 1.379) 4.255 3.489 ( 2.735 -0.000 2.342) 3.600 4.128 ( 9.680 -0.000 0.880) 9.720 4.536 ( 3.840 -0.000 -0.251) 3.848 4.838 ( -17.715 0.000 -1.189) 17.755 5.107 ( -4.044 0.000 0.399) 4.063 8.983 ( 11.323 -0.000 -5.073) 12.407 9.431 ( -13.767 0.000 14.171) 19.758 9.621 ( 8.009 -0.000 -6.864) 10.548 11.384 ( -5.533 0.000 -0.051) 5.533 14.983 ( 2.544 -0.000 7.768) 8.174 15.094 ( -1.265 0.000 2.509) 2.809 15.435 ( 3.235 -0.000 0.303) 3.249 15.826 ( 2.664 -0.000 -12.090) 12.380 16.993 ( 9.817 -0.000 2.344) 10.093 17.336 ( 4.737 -0.000 -6.267) 7.856 17.658 ( -10.300 0.000 2.701) 10.648 17.900 ( -1.459 0.000 0.922) 1.726 ======================= Grid point 354 (177/306) ======================= q-point: (-0.50 0.40 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.176 ( -0.344 0.560 2.953) 3.025 1.343 ( 2.524 2.343 4.358) 5.554 1.564 ( 5.925 -0.241 5.479) 8.073 1.841 ( 2.902 3.206 -9.431) 10.375 2.149 ( 4.303 0.141 -1.207) 4.471 2.384 ( -0.020 3.694 1.163) 3.873 2.527 ( 2.831 0.817 -2.373) 3.784 2.661 ( 0.397 -0.467 0.301) 0.683 2.739 ( -0.305 -1.057 1.078) 1.540 2.895 ( -7.156 -0.858 -0.161) 7.209 3.031 ( -0.829 0.698 0.386) 1.151 3.072 ( -2.855 -0.167 0.164) 2.864 3.199 ( -2.361 -2.067 1.655) 3.547 3.492 ( -1.913 0.488 -2.162) 2.928 4.258 ( 11.301 2.307 -0.075) 11.534 4.418 ( -6.259 12.303 1.305) 13.865 4.801 ( -5.342 -14.896 1.143) 15.867 5.124 ( 0.474 -3.295 1.860) 3.813 9.003 ( 8.148 10.575 -6.923) 15.038 9.352 ( -6.297 -4.181 3.735) 8.431 9.745 ( 2.239 -2.046 6.482) 7.156 11.275 ( -8.328 -1.000 -4.451) 9.495 14.950 ( -6.298 8.040 1.163) 10.279 15.136 ( -3.478 -6.552 4.631) 8.745 15.479 ( 6.338 9.683 -0.404) 11.580 15.750 ( 2.871 -5.621 -8.584) 10.655 17.137 ( 12.040 6.863 2.703) 14.120 17.389 ( 7.062 -6.576 -2.715) 10.024 17.531 ( -8.459 4.416 2.286) 9.813 17.900 ( -4.770 -5.446 -0.972) 7.304 ======================= Grid point 355 (178/306) ======================= q-point: (-0.40 0.40 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 552 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.184 ( -1.909 1.617 3.493) 4.297 1.398 ( 1.600 2.710 6.391) 7.123 1.642 ( 0.472 5.386 -1.237) 5.546 1.775 ( 8.072 0.995 -3.051) 8.686 2.189 ( 4.338 0.195 -0.801) 4.415 2.309 ( -4.754 5.388 -0.225) 7.189 2.502 ( 1.459 2.849 -1.525) 3.545 2.686 ( 3.139 0.900 -0.266) 3.276 2.738 ( -5.765 -0.441 0.116) 5.783 2.795 ( -5.537 -4.498 -3.344) 7.878 2.987 ( -1.760 3.135 0.604) 3.646 3.081 ( 0.591 -1.512 0.045) 1.624 3.237 ( -1.206 -4.047 1.869) 4.618 3.417 ( -2.855 0.923 -2.236) 3.742 4.225 ( -1.650 10.882 1.933) 11.175 4.354 ( 6.142 3.777 1.368) 7.339 4.926 ( -8.996 -14.558 1.206) 17.156 5.267 ( 9.327 -7.505 1.971) 12.133 8.801 ( 1.792 15.531 -6.729) 17.020 9.479 ( -3.009 -6.446 13.022) 14.839 9.811 ( 2.274 -1.654 -4.123) 4.990 11.127 ( -8.212 -0.831 -4.962) 9.631 14.743 ( -8.457 9.772 -0.521) 12.934 15.227 ( -5.310 -7.547 5.213) 10.598 15.338 ( 5.304 13.858 -7.047) 16.426 15.817 ( 2.805 -3.103 -0.741) 4.248 17.169 ( 6.853 8.669 0.735) 11.075 17.426 ( -2.405 3.296 1.341) 4.294 17.593 ( 10.262 -6.836 1.907) 12.477 17.884 ( -7.382 -7.674 -3.009) 11.066 ======================= Grid point 356 (179/306) ======================= q-point: (-0.30 0.40 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.168 ( -2.498 2.996 3.874) 5.498 1.439 ( -1.261 3.796 6.619) 7.734 1.492 ( -3.656 5.722 -4.730) 8.275 1.861 ( 6.320 -0.035 -1.353) 6.463 2.101 ( -10.048 8.546 -1.210) 13.246 2.257 ( 5.998 -0.070 -0.747) 6.045 2.466 ( 1.158 2.661 -1.461) 3.250 2.676 ( 0.745 -2.257 -3.422) 4.166 2.707 ( 0.815 0.996 0.729) 1.479 2.796 ( -1.693 -4.141 -1.765) 4.809 2.942 ( -0.386 3.465 1.664) 3.863 3.107 ( 1.071 -1.421 -0.699) 1.912 3.293 ( -1.646 -4.487 1.475) 5.002 3.378 ( -0.644 0.215 0.582) 0.894 4.113 ( -2.260 7.652 2.362) 8.321 4.364 ( 5.500 7.498 -0.379) 9.307 4.970 ( -12.867 -12.232 3.142) 18.029 5.545 ( 12.592 -11.455 -0.158) 17.023 8.575 ( -0.592 14.701 -0.713) 14.730 9.652 ( -10.473 -1.861 21.416) 23.912 9.767 ( 7.559 -5.005 -20.207) 22.147 11.003 ( -4.539 0.860 -2.307) 5.164 14.512 ( -7.334 10.427 0.051) 12.748 15.121 ( 5.010 14.013 -8.753) 17.265 15.347 ( -3.952 -7.517 6.975) 10.989 15.826 ( -1.255 2.684 -0.235) 2.972 17.143 ( 2.681 6.478 2.322) 7.386 17.420 ( 5.046 1.927 -0.673) 5.443 17.802 ( 2.748 -5.189 1.109) 5.975 17.855 ( -2.304 -8.201 -3.212) 9.104 ======================= Grid point 357 (180/306) ======================= q-point: (-0.20 -0.60 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 552 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.132 ( -2.496 4.205 3.408) 5.961 1.315 ( -4.746 4.870 -2.599) 7.280 1.448 ( -4.605 2.241 6.659) 8.401 1.800 ( -10.548 1.983 -3.680) 11.346 1.957 ( 5.709 2.756 -3.394) 7.191 2.313 ( 5.689 2.196 -1.534) 6.288 2.446 ( 1.088 0.590 -0.959) 1.566 2.682 ( 4.116 4.123 -3.268) 6.680 2.723 ( 0.980 -1.998 0.364) 2.255 2.812 ( -0.037 -3.253 -0.097) 3.254 2.939 ( 1.465 2.599 3.326) 4.468 3.132 ( 2.059 -1.617 -0.941) 2.782 3.333 ( -2.784 -4.251 0.648) 5.123 3.398 ( 0.440 -0.641 2.086) 2.226 4.023 ( -2.646 5.712 1.788) 6.544 4.300 ( 4.417 10.522 -1.688) 11.535 5.002 ( -13.574 -13.203 4.569) 19.479 5.815 ( 10.375 -10.252 -2.350) 14.774 8.423 ( -2.125 11.518 5.993) 13.157 9.630 ( 4.645 0.264 -14.945) 15.653 9.784 ( -10.879 -6.097 9.483) 15.666 10.956 ( 2.312 3.013 1.064) 3.944 14.325 ( -4.005 9.392 1.631) 10.340 14.925 ( 7.607 15.509 -7.263) 18.739 15.480 ( -4.220 -9.411 6.865) 12.390 15.731 ( -3.745 5.451 -0.837) 6.666 17.142 ( 2.350 3.296 2.475) 4.745 17.460 ( 7.446 3.332 -1.285) 8.258 17.767 ( -9.232 -8.555 -5.247) 13.636 17.996 ( 6.367 -3.395 1.043) 7.291 ======================= Grid point 358 (181/306) ======================= q-point: (-0.10 -0.60 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.095 ( -1.611 2.258 3.091) 4.153 1.206 ( -4.609 0.375 -0.289) 4.633 1.445 ( -3.327 1.178 6.676) 7.551 1.627 ( -5.166 2.120 -4.590) 7.229 1.965 ( 4.166 -0.993 -6.067) 7.426 2.312 ( 3.340 2.546 -2.598) 4.938 2.447 ( 1.075 0.346 -0.929) 1.462 2.628 ( 0.383 2.783 -2.807) 3.971 2.741 ( 3.894 3.653 -0.222) 5.343 2.881 ( 1.328 -3.399 2.311) 4.320 2.965 ( 2.013 3.194 2.873) 4.744 3.187 ( 3.783 -1.462 0.359) 4.071 3.338 ( -4.739 -3.753 -0.241) 6.050 3.435 ( -0.229 -0.625 2.422) 2.512 3.953 ( -1.624 3.814 1.506) 4.410 4.203 ( 4.947 10.627 -1.327) 11.797 5.054 ( -13.209 -14.055 3.981) 19.694 5.982 ( 5.285 -5.875 -3.715) 8.732 8.373 ( -2.486 7.031 10.862) 13.175 9.512 ( 8.868 -0.782 -22.500) 24.197 9.800 ( -15.307 -4.727 12.473) 20.303 11.007 ( 7.836 4.956 4.974) 10.522 14.229 ( 0.428 6.962 3.603) 7.851 14.784 ( 10.141 14.380 -4.333) 18.122 15.581 ( -3.345 0.839 2.698) 4.379 15.643 ( -4.273 -6.140 1.449) 7.620 17.163 ( 1.796 0.634 0.478) 1.963 17.483 ( 7.357 6.065 -1.029) 9.590 17.701 ( -8.092 -8.186 -5.677) 12.834 18.089 ( 2.509 -1.632 0.247) 3.003 ======================= Grid point 364 (182/306) ======================= q-point: (-0.50 -0.50 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 305 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.200 ( -2.017 0.000 3.434) 3.982 1.433 ( 1.522 -0.000 5.355) 5.567 1.727 ( 8.023 -0.000 5.958) 9.993 1.775 ( -0.041 0.000 -8.892) 8.892 2.182 ( 3.164 -0.000 -0.610) 3.222 2.398 ( -2.994 0.000 1.078) 3.182 2.528 ( 2.777 -0.000 -5.238) 5.929 2.697 ( 3.882 -0.000 1.589) 4.195 2.726 ( -0.798 0.000 -0.321) 0.860 2.744 ( -14.160 0.000 -2.525) 14.383 3.043 ( -1.765 0.000 0.293) 1.790 3.049 ( 1.261 -0.000 0.532) 1.368 3.178 ( -1.924 0.000 2.192) 2.917 3.430 ( -3.134 0.000 -2.366) 3.927 4.402 ( 5.991 -0.000 2.807) 6.616 4.483 ( -4.866 0.000 -3.409) 5.941 4.624 ( -0.575 0.000 4.419) 4.457 5.172 ( 5.561 -0.000 2.103) 5.946 9.154 ( 7.509 -0.000 -5.787) 9.480 9.222 ( -3.766 0.000 0.469) 3.795 9.810 ( -3.946 0.000 7.423) 8.406 11.115 ( -7.265 0.000 -4.817) 8.717 14.923 ( -7.380 0.000 -1.214) 7.479 15.076 ( -7.599 0.000 6.735) 10.155 15.584 ( 2.815 -0.000 -11.460) 11.801 15.708 ( 8.210 -0.000 3.499) 8.924 17.366 ( 6.923 -0.000 -3.400) 7.713 17.414 ( 7.230 -0.000 3.259) 7.930 17.490 ( -0.355 0.000 2.954) 2.975 17.770 ( -7.885 0.000 -1.905) 8.112 ======================= Grid point 365 (183/306) ======================= q-point: (-0.40 -0.50 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.202 ( -3.725 0.287 3.884) 5.389 1.499 ( -0.102 1.522 6.100) 6.288 1.637 ( -3.325 4.072 -6.683) 8.503 1.849 ( 2.645 -0.614 0.861) 2.848 2.236 ( 4.815 -0.910 0.729) 4.954 2.318 ( -5.840 8.160 0.041) 10.034 2.502 ( 1.999 -0.645 -4.519) 4.983 2.550 ( -11.236 -4.949 -2.536) 12.537 2.717 ( -1.137 -1.314 -0.757) 1.895 2.765 ( 5.145 1.054 0.987) 5.344 3.011 ( -1.484 1.937 0.572) 2.506 3.083 ( 2.120 -0.610 0.219) 2.216 3.199 ( -1.533 -2.516 2.176) 3.662 3.389 ( -0.590 0.370 -0.153) 0.713 4.306 ( -5.964 6.958 -1.326) 9.259 4.483 ( 2.353 0.757 3.192) 4.037 4.746 ( 1.771 -4.706 1.925) 5.384 5.313 ( 9.166 -5.989 0.672) 10.969 8.963 ( 0.099 15.963 -4.061) 16.471 9.383 ( -0.605 -14.527 1.936) 14.668 9.786 ( -6.207 1.569 1.710) 6.627 11.011 ( -3.059 0.022 -1.884) 3.593 14.761 ( -7.725 8.695 0.896) 11.665 15.098 ( -8.211 -7.753 5.376) 12.507 15.464 ( 4.564 8.289 -7.349) 11.981 15.836 ( 4.999 -1.415 -0.056) 5.196 17.310 ( -2.552 6.583 0.312) 7.067 17.450 ( 4.941 -0.826 -0.944) 5.097 17.662 ( -9.717 -4.403 -2.860) 11.044 17.704 ( 12.874 -3.532 3.294) 13.750 ======================= Grid point 366 (184/306) ======================= q-point: (-0.30 -0.50 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.188 ( -4.812 0.396 3.853) 6.177 1.442 ( -7.046 4.598 -4.111) 9.364 1.526 ( -2.323 3.936 5.000) 6.774 1.818 ( -6.740 -0.238 -2.894) 7.339 2.095 ( -4.573 7.685 -2.676) 9.334 2.329 ( 4.732 -0.564 0.684) 4.814 2.452 ( -0.867 0.053 -3.534) 3.639 2.608 ( 1.633 -6.580 3.371) 7.571 2.707 ( -0.868 -1.287 -1.587) 2.220 2.814 ( 4.956 1.986 -0.023) 5.339 2.986 ( -0.401 1.047 1.189) 1.634 3.115 ( 2.464 -0.024 -0.400) 2.496 3.235 ( -1.987 -3.010 1.651) 3.966 3.397 ( 1.371 0.340 1.049) 1.760 4.153 ( -5.538 4.145 -1.124) 7.008 4.514 ( 2.841 4.062 1.518) 5.184 4.794 ( -3.451 -1.111 3.543) 5.069 5.547 ( 11.393 -10.689 -1.701) 15.715 8.729 ( -3.344 12.417 -1.949) 13.007 9.546 ( 3.369 -8.883 -4.440) 10.486 9.685 ( -12.039 0.332 5.852) 13.390 10.996 ( 1.799 0.517 0.989) 2.117 14.571 ( -6.609 10.139 2.905) 12.447 15.156 ( -3.311 -5.032 1.729) 6.267 15.351 ( 1.786 6.797 -1.597) 7.207 15.846 ( 0.495 3.078 -2.252) 3.846 17.215 ( -2.721 2.951 -0.203) 4.020 17.527 ( 3.828 -2.474 -1.590) 4.827 17.573 ( -4.971 -2.537 -2.029) 5.938 17.913 ( 9.505 -3.003 1.506) 10.081 ======================= Grid point 367 (185/306) ======================= q-point: (-0.20 -0.50 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.138 ( -6.698 1.176 0.771) 6.844 1.276 ( -6.769 3.303 0.791) 7.573 1.477 ( -6.178 3.037 4.032) 7.979 1.670 ( -6.485 1.279 -3.598) 7.526 1.992 ( 1.325 2.949 -3.582) 4.826 2.366 ( 3.426 1.566 -2.623) 4.590 2.421 ( -0.816 -1.929 -1.648) 2.665 2.656 ( -2.366 0.459 -0.282) 2.426 2.777 ( 1.986 -5.025 3.261) 6.311 2.839 ( 4.152 2.941 0.074) 5.089 3.015 ( 2.260 -0.297 2.466) 3.359 3.144 ( 2.482 -1.495 -0.769) 2.998 3.252 ( -2.270 -1.887 0.709) 3.036 3.427 ( 1.561 0.142 1.199) 1.973 4.044 ( -4.121 2.607 -0.111) 4.877 4.482 ( 5.100 9.337 -1.063) 10.692 4.800 ( -7.650 -3.900 5.492) 10.193 5.784 ( 9.591 -9.887 -3.460) 14.202 8.550 ( -4.843 6.570 0.488) 8.177 9.511 ( 8.090 0.846 -17.515) 19.312 9.694 ( -16.738 -3.746 18.569) 25.278 11.065 ( 6.005 -0.002 3.361) 6.882 14.428 ( -3.858 8.926 4.847) 10.865 15.121 ( 7.578 10.599 -5.042) 13.971 15.362 ( -7.394 -8.524 6.415) 12.980 15.743 ( -2.539 5.769 -2.735) 6.871 17.163 ( -1.591 -0.305 -2.034) 2.601 17.477 ( -10.757 -8.764 -4.335) 14.537 17.641 ( 12.180 5.132 0.547) 13.228 18.042 ( 4.903 -1.924 0.176) 5.270 ======================= Grid point 368 (186/306) ======================= q-point: (-0.10 -0.50 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.052 ( -6.788 -2.610 0.392) 7.283 1.193 ( -3.841 3.281 2.085) 5.465 1.435 ( -5.242 -3.161 2.887) 6.768 1.574 ( -0.227 2.151 -3.583) 4.185 1.923 ( -0.698 1.588 -5.510) 5.777 2.338 ( 2.633 2.251 -3.843) 5.173 2.429 ( -0.684 -2.173 -0.643) 2.367 2.617 ( -1.643 1.309 0.631) 2.193 2.824 ( 0.102 0.166 -0.552) 0.585 2.892 ( 1.350 -1.415 3.733) 4.214 3.057 ( 1.827 1.483 0.926) 2.529 3.202 ( -0.777 -3.494 -0.125) 3.582 3.255 ( 1.710 -0.102 1.171) 2.075 3.453 ( 0.544 0.013 1.290) 1.400 3.984 ( -1.822 2.059 1.072) 2.951 4.409 ( 6.818 11.155 -1.415) 13.150 4.824 ( -8.414 -6.673 4.694) 11.720 5.931 ( 4.731 -5.681 -4.070) 8.439 8.465 ( -3.632 0.944 2.166) 4.332 9.423 ( 6.790 -0.325 -14.566) 16.074 9.702 ( -13.730 1.058 14.961) 20.334 11.212 ( 8.636 0.166 6.239) 10.655 14.369 ( -0.500 6.164 6.409) 8.906 15.038 ( 10.156 12.258 -2.924) 16.185 15.453 ( -9.092 -11.479 4.610) 15.352 15.613 ( -2.464 4.807 -1.911) 5.730 17.127 ( -1.186 -2.040 -4.382) 4.977 17.415 ( -9.506 -9.061 -3.809) 13.674 17.710 ( 11.726 8.310 -1.042) 14.410 18.097 ( 1.255 -1.201 0.375) 1.777 ======================= Grid point 375 (187/306) ======================= q-point: (-0.40 -0.40 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.187 ( -6.083 0.000 4.431) 7.526 1.505 ( -7.721 0.000 -4.137) 8.759 1.587 ( -0.993 0.000 3.729) 3.859 1.811 ( -5.847 0.000 -2.228) 6.257 2.262 ( -12.509 0.000 -3.248) 12.924 2.290 ( 2.798 -0.000 -0.089) 2.799 2.463 ( 1.304 -0.000 -5.344) 5.501 2.471 ( 5.628 -0.000 6.756) 8.793 2.689 ( -1.210 0.000 -0.273) 1.240 2.839 ( 4.022 -0.000 0.531) 4.057 3.003 ( -1.827 0.000 0.283) 1.849 3.103 ( -0.364 0.000 0.015) 0.364 3.205 ( 1.631 -0.000 2.367) 2.875 3.403 ( 1.635 -0.000 0.708) 1.781 4.207 ( -8.161 0.000 -4.612) 9.374 4.519 ( -4.269 0.000 7.438) 8.576 4.860 ( 11.859 -0.000 0.027) 11.859 5.378 ( 9.128 -0.000 -1.397) 9.234 8.934 ( -6.162 0.000 -14.347) 15.614 9.380 ( 2.403 -0.000 15.682) 15.865 9.697 ( -9.432 0.000 -1.892) 9.620 10.999 ( 1.130 -0.000 0.751) 1.357 14.754 ( -7.038 0.000 2.493) 7.467 14.999 ( -8.759 0.000 7.262) 11.378 15.492 ( 3.721 -0.000 -5.783) 6.877 15.877 ( 4.588 -0.000 -3.346) 5.679 17.276 ( -5.823 0.000 -1.787) 6.091 17.413 ( -9.251 0.000 -2.500) 9.583 17.598 ( 7.193 -0.000 0.743) 7.232 17.871 ( 11.789 -0.000 1.705) 11.912 ======================= Grid point 376 (188/306) ======================= q-point: (-0.30 -0.40 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.151 ( -8.162 -0.012 4.502) 9.321 1.325 ( -11.325 1.041 -2.808) 11.715 1.587 ( -2.897 3.774 2.447) 5.350 1.683 ( -8.229 -0.164 -3.337) 8.881 2.096 ( -5.005 4.563 0.355) 6.782 2.327 ( -0.591 -3.454 -0.382) 3.525 2.420 ( 2.331 0.951 -5.163) 5.744 2.642 ( 4.069 -3.063 4.821) 7.013 2.676 ( -0.708 -0.501 -0.292) 0.916 2.883 ( 2.003 0.936 1.959) 2.954 2.992 ( -0.022 -0.647 0.836) 1.057 3.080 ( -3.607 -2.497 -1.201) 4.548 3.265 ( 3.925 1.175 2.177) 4.639 3.435 ( 2.410 0.295 0.488) 2.476 4.072 ( -5.741 0.161 -2.764) 6.374 4.539 ( -5.169 -0.893 5.507) 7.605 4.944 ( 9.904 9.253 0.411) 13.560 5.530 ( 10.342 -8.861 -3.576) 14.080 8.666 ( -8.193 2.502 -11.024) 13.961 9.528 ( -2.807 -0.028 -12.469) 12.781 9.642 ( -3.712 -0.284 27.737) 27.986 11.039 ( 2.594 -1.209 0.909) 3.003 14.648 ( -6.770 7.817 5.183) 11.567 15.042 ( -7.372 -8.276 7.287) 13.264 15.442 ( 3.792 6.077 -4.475) 8.447 15.851 ( 1.205 2.365 -5.583) 6.182 17.168 ( -4.734 1.129 -3.259) 5.857 17.285 ( -11.117 -5.791 -3.488) 13.012 17.726 ( 10.896 1.548 2.276) 11.238 18.010 ( 8.127 -0.555 -0.292) 8.151 ======================= Grid point 377 (189/306) ======================= q-point: (-0.20 -0.40 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 552 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.043 ( -11.486 1.753 1.195) 11.681 1.211 ( -9.005 -2.717 3.428) 10.011 1.446 ( -9.119 4.130 -1.160) 10.077 1.610 ( -0.047 0.680 -1.844) 1.966 1.996 ( -3.578 4.391 -1.199) 5.790 2.348 ( -3.355 -4.493 -0.066) 5.608 2.384 ( 3.033 1.275 -5.038) 6.018 2.649 ( -1.219 1.171 0.433) 1.745 2.732 ( -2.788 -4.652 0.596) 5.456 2.908 ( -0.143 1.194 3.587) 3.783 3.047 ( 0.325 -0.839 -0.922) 1.288 3.089 ( 2.093 -5.145 2.738) 6.192 3.307 ( 3.736 2.861 1.176) 4.850 3.463 ( 2.174 0.480 0.256) 2.241 4.004 ( -2.654 -0.244 -0.686) 2.752 4.530 ( -5.215 -0.937 2.425) 5.827 4.919 ( 8.117 12.765 1.475) 15.199 5.732 ( 8.767 -10.011 -4.439) 14.028 8.468 ( -6.468 -0.455 -5.468) 8.481 9.359 ( -4.912 -3.149 -11.717) 13.089 9.863 ( -1.538 9.383 26.013) 27.696 11.135 ( 4.740 -5.534 2.278) 7.635 14.541 ( -5.302 7.524 6.952) 11.535 15.145 ( -6.464 -9.665 6.031) 13.099 15.348 ( 3.517 8.792 -3.535) 10.108 15.739 ( -1.875 4.545 -5.101) 7.085 17.075 ( -3.493 -1.785 -5.003) 6.358 17.200 ( -9.651 -7.637 -3.781) 12.874 17.864 ( 12.393 3.458 1.253) 12.927 18.073 ( 3.068 -0.160 -1.158) 3.284 ======================= Grid point 378 (190/306) ======================= q-point: (-0.10 -0.40 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.930 ( -9.331 -2.727 2.753) 10.104 1.174 ( -7.377 -0.557 2.300) 7.747 1.315 ( -7.005 -3.228 -1.636) 7.884 1.591 ( 3.088 2.287 -2.366) 4.513 1.858 ( -7.217 2.035 -2.754) 7.988 2.348 ( 2.740 1.597 -5.004) 5.924 2.359 ( -4.232 -4.703 0.490) 6.346 2.636 ( -1.119 0.782 2.392) 2.754 2.742 ( -4.208 -4.127 0.038) 5.895 2.931 ( -0.885 0.113 2.794) 2.933 3.033 ( -0.197 -0.863 -2.124) 2.301 3.220 ( 4.177 -1.169 2.369) 4.942 3.324 ( 2.605 1.706 1.782) 3.588 3.480 ( 1.228 1.020 0.298) 1.624 3.986 ( -0.861 -0.114 0.518) 1.011 4.481 ( -4.959 -0.074 -1.016) 5.063 4.899 ( 8.884 10.864 3.071) 14.366 5.869 ( 4.118 -6.067 -3.916) 8.313 8.398 ( -2.833 -3.021 -1.050) 4.273 9.237 ( -3.831 -6.647 -11.498) 13.823 9.924 ( -3.643 15.922 20.292) 26.049 11.345 ( 8.214 -6.312 5.782) 11.863 14.492 ( -3.343 4.556 7.571) 9.448 15.230 ( -11.781 -10.212 3.475) 15.974 15.263 ( 8.849 8.732 -1.476) 12.519 15.610 ( -2.140 3.627 -3.169) 5.271 17.010 ( -1.623 -3.197 -7.464) 8.281 17.150 ( -9.159 -8.972 -2.234) 13.014 17.920 ( 7.481 7.874 -3.489) 11.408 18.114 ( 3.719 -1.523 1.617) 4.332 ======================= Grid point 386 (191/306) ======================= q-point: (-0.30 -0.30 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 305 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.100 ( -10.231 0.000 6.552) 12.149 1.141 ( -14.091 0.000 -1.044) 14.130 1.514 ( -10.365 0.000 -4.202) 11.184 1.615 ( 0.176 -0.000 -0.031) 0.179 2.105 ( -3.816 0.000 4.963) 6.261 2.239 ( -7.971 0.000 -2.747) 8.431 2.399 ( 3.195 -0.000 -5.693) 6.528 2.663 ( -2.016 0.000 0.167) 2.022 2.670 ( 0.127 -0.000 0.091) 0.156 2.952 ( -0.322 0.000 5.209) 5.219 2.982 ( -0.922 0.000 0.798) 1.220 3.043 ( 3.661 -0.000 0.659) 3.720 3.347 ( 3.683 -0.000 1.676) 4.047 3.469 ( 2.490 -0.000 -0.308) 2.509 3.997 ( -2.531 0.000 -1.359) 2.873 4.510 ( -6.909 0.000 3.829) 7.899 5.164 ( 12.007 -0.000 0.604) 12.022 5.536 ( 9.481 -0.000 -5.429) 10.925 8.459 ( -7.980 0.000 -7.429) 10.903 9.316 ( -8.229 0.000 -10.914) 13.669 10.015 ( 5.077 -0.000 33.219) 33.605 11.037 ( 0.222 -0.000 -2.207) 2.218 14.676 ( -8.017 0.000 6.641) 10.410 14.974 ( -8.016 0.000 8.199) 11.466 15.482 ( 4.123 -0.000 -4.275) 5.939 15.800 ( -0.121 0.000 -7.674) 7.675 17.072 ( -9.856 0.000 -3.429) 10.435 17.073 ( -4.859 0.000 -5.210) 7.124 17.895 ( 10.379 -0.000 2.791) 10.747 18.081 ( 5.589 -0.000 -2.393) 6.080 ======================= Grid point 387 (192/306) ======================= q-point: (-0.20 -0.30 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.941 ( -13.577 2.825 3.274) 14.249 1.077 ( -11.619 -4.628 5.412) 13.627 1.330 ( -10.117 1.174 -3.338) 10.718 1.621 ( 2.645 0.434 -1.396) 3.022 1.957 ( -14.792 6.089 -2.334) 16.165 2.194 ( -7.038 -7.915 2.337) 10.846 2.376 ( 3.380 0.618 -5.435) 6.430 2.642 ( -1.552 0.337 1.908) 2.482 2.687 ( 1.093 -0.988 0.025) 1.474 2.953 ( -0.461 1.907 2.020) 2.816 3.008 ( 0.619 -1.768 -1.106) 2.175 3.162 ( 5.378 -1.737 5.311) 7.755 3.382 ( 1.802 1.811 0.507) 2.605 3.492 ( 2.213 -0.081 -0.587) 2.291 3.974 ( -0.573 -0.459 -0.354) 0.815 4.452 ( -7.709 -1.058 1.031) 7.850 5.226 ( 11.730 12.473 0.788) 17.140 5.663 ( 7.982 -9.344 -4.435) 13.065 8.343 ( -5.059 -1.225 -0.002) 5.205 9.111 ( -6.600 -2.929 -11.983) 13.990 10.367 ( 4.288 16.959 30.511) 35.170 11.082 ( 2.391 -12.791 0.459) 13.021 14.613 ( -8.456 4.353 7.374) 12.034 14.999 ( -9.438 -6.759 6.263) 13.191 15.456 ( 4.912 5.249 -3.818) 8.140 15.690 ( -2.013 1.965 -6.739) 7.303 16.939 ( -4.576 -1.756 -5.707) 7.523 16.974 ( -7.780 -4.577 -3.976) 9.864 18.044 ( 10.014 1.138 0.389) 10.086 18.086 ( 1.667 0.552 -2.404) 2.977 ======================= Grid point 388 (193/306) ======================= q-point: (-0.10 -0.30 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.828 ( -10.767 -1.380 6.184) 12.493 1.023 ( -13.259 -5.055 0.877) 14.217 1.190 ( -7.148 -0.198 -1.040) 7.226 1.634 ( 2.079 1.522 -1.772) 3.127 1.696 ( -16.016 -2.822 0.585) 16.274 2.224 ( -5.375 -5.507 1.361) 7.814 2.349 ( 2.993 1.242 -4.423) 5.483 2.652 ( -0.706 0.993 2.965) 3.206 2.713 ( 1.960 -0.130 -0.496) 2.026 2.945 ( -1.468 0.961 1.920) 2.601 3.017 ( 1.722 -0.367 -1.852) 2.555 3.277 ( 2.946 -0.464 0.882) 3.110 3.383 ( 0.581 0.688 2.579) 2.731 3.507 ( 1.600 0.734 -0.895) 1.975 3.977 ( -0.095 -0.747 -0.004) 0.753 4.366 ( -7.793 -1.308 -1.932) 8.134 5.237 ( 13.863 12.987 2.459) 19.155 5.807 ( 4.124 -6.196 -2.054) 7.721 8.353 ( -1.369 -1.937 4.390) 4.989 8.972 ( -5.089 -6.583 -10.580) 13.460 10.329 ( -3.491 22.751 13.339) 26.603 11.413 ( 10.017 -11.496 8.349) 17.384 14.546 ( -7.743 2.151 6.596) 10.397 14.999 ( -12.043 -7.090 1.257) 14.032 15.438 ( 6.769 4.845 0.368) 8.333 15.582 ( -1.122 1.468 -3.579) 4.028 16.840 ( -4.637 -3.644 -8.594) 10.423 16.943 ( -5.411 -7.335 0.446) 9.126 17.983 ( -1.222 4.954 -4.567) 6.848 18.201 ( 8.919 -1.444 0.684) 9.061 ======================= Grid point 397 (194/306) ======================= q-point: (-0.20 -0.20 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.836 ( -13.246 0.000 5.422) 14.312 0.944 ( -14.021 0.000 2.824) 14.302 1.186 ( -10.535 0.000 1.740) 10.678 1.645 ( 3.480 -0.000 -1.831) 3.932 1.670 ( -26.339 0.000 -2.106) 26.423 2.146 ( -2.065 0.000 3.626) 4.173 2.368 ( 3.599 -0.000 -4.691) 5.913 2.687 ( 2.596 -0.000 2.714) 3.755 2.697 ( 2.028 -0.000 -0.409) 2.068 2.973 ( -1.577 0.000 0.878) 1.805 3.005 ( 2.751 -0.000 -1.167) 2.988 3.262 ( 3.643 -0.000 3.263) 4.890 3.406 ( -0.403 0.000 0.296) 0.500 3.504 ( 1.746 -0.000 -1.162) 2.097 3.966 ( 0.270 -0.000 -0.358) 0.448 4.345 ( -8.170 0.000 -1.036) 8.235 5.477 ( 10.937 -0.000 1.606) 11.054 5.652 ( 8.656 -0.000 -1.574) 8.798 8.333 ( -2.921 0.000 8.281) 8.781 8.883 ( -4.911 0.000 -12.599) 13.522 10.858 ( -3.719 0.000 -9.678) 10.368 11.042 ( 13.945 -0.000 33.587) 36.367 14.586 ( -11.595 0.000 6.036) 13.072 14.896 ( -9.726 0.000 3.073) 10.199 15.515 ( 5.073 -0.000 -1.374) 5.255 15.599 ( -2.166 0.000 -6.450) 6.804 16.791 ( -8.078 0.000 -4.514) 9.253 16.835 ( -3.276 0.000 -2.464) 4.099 18.048 ( -0.937 0.000 -5.250) 5.333 18.172 ( 7.679 -0.000 1.132) 7.762 ======================= Grid point 398 (195/306) ======================= q-point: (-0.10 -0.20 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.753 ( -13.972 -0.723 4.072) 14.571 0.781 ( -13.851 -3.681 3.833) 14.835 1.105 ( -9.070 0.170 3.138) 9.599 1.426 ( -19.140 -5.568 8.167) 21.542 1.669 ( 3.003 -0.637 -1.399) 3.374 2.155 ( -2.107 -1.238 0.671) 2.534 2.357 ( 3.127 1.029 -4.150) 5.297 2.710 ( 1.771 1.974 0.774) 2.763 2.738 ( 2.955 0.902 -0.955) 3.234 2.956 ( -1.736 0.790 1.216) 2.262 3.024 ( 2.638 0.007 -1.344) 2.961 3.289 ( -0.072 0.297 -2.067) 2.089 3.414 ( -0.685 -0.329 2.922) 3.020 3.514 ( 1.467 -0.408 -1.465) 2.113 3.968 ( 0.297 -0.332 -0.470) 0.647 4.231 ( -7.451 -0.704 -2.781) 7.984 5.571 ( 12.509 7.760 2.638) 14.955 5.812 ( 8.188 -3.011 2.246) 9.009 8.422 ( -0.696 1.639 10.763) 10.909 8.732 ( -3.693 -5.529 -9.443) 11.549 10.573 ( -4.565 15.893 -6.659) 17.826 11.528 ( 8.556 -6.241 8.744) 13.734 14.489 ( -11.691 -0.410 3.494) 12.208 14.785 ( -11.373 -2.838 -3.116) 12.129 15.509 ( -0.575 1.025 -3.499) 3.691 15.604 ( 6.660 -0.536 3.199) 7.408 16.686 ( -5.061 -0.038 1.235) 5.209 16.838 ( -0.206 -5.911 1.011) 6.000 17.951 ( -3.149 2.426 -3.811) 5.507 18.274 ( 6.309 -2.078 -0.723) 6.682 ======================= Grid point 408 (196/306) ======================= q-point: (-0.10 -0.10 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 305 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.574 ( -10.937 0.000 7.327) 13.164 0.749 ( -8.222 0.000 10.688) 13.484 1.000 ( -8.873 0.000 0.661) 8.898 1.376 ( -8.989 0.000 19.625) 21.586 1.675 ( 1.624 -0.000 -1.291) 2.074 2.125 ( -1.675 0.000 -1.125) 2.018 2.344 ( 2.214 -0.000 -5.858) 6.262 2.746 ( 1.415 -0.000 0.938) 1.697 2.751 ( 1.215 -0.000 -5.042) 5.186 2.952 ( -1.284 0.000 1.035) 1.649 3.046 ( 2.304 -0.000 -0.719) 2.414 3.247 ( -1.337 0.000 -3.186) 3.455 3.427 ( -1.268 0.000 2.237) 2.571 3.511 ( 0.955 -0.000 -1.148) 1.493 3.964 ( 0.359 -0.000 -0.815) 0.890 4.107 ( -6.227 0.000 -3.282) 7.039 5.754 ( 7.038 -0.000 2.516) 7.474 6.000 ( 15.368 -0.000 2.999) 15.658 8.521 ( -2.854 0.000 -12.306) 12.633 8.613 ( -0.179 0.000 18.992) 18.993 10.486 ( -2.292 0.000 -15.678) 15.844 11.509 ( -11.789 0.000 -4.823) 12.738 14.352 ( -11.540 0.000 -0.145) 11.541 14.569 ( -10.735 0.000 -7.230) 12.942 15.474 ( 0.988 -0.000 -2.426) 2.620 15.684 ( 0.555 -0.000 1.209) 1.330 16.802 ( 1.038 -0.000 1.225) 1.605 16.846 ( 12.911 -0.000 13.588) 18.744 17.898 ( -2.477 0.000 -1.104) 2.712 18.303 ( 2.869 -0.000 -1.324) 3.160 ======================= Grid point 409 (197/306) ======================= q-point: ( 0.00 0.00 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.041 ( -2.838 0.000 9.945) 10.342 1.086 ( -0.587 0.000 11.024) 11.039 1.220 ( 7.177 -0.000 8.258) 10.941 1.748 ( 4.603 -0.000 -3.613) 5.852 1.898 ( 8.523 -0.000 -0.830) 8.563 1.929 ( -11.115 0.000 -5.172) 12.260 2.094 ( 3.981 -0.000 2.438) 4.668 2.544 ( -2.260 0.000 -2.717) 3.534 2.859 ( -0.622 0.000 2.724) 2.794 2.922 ( -5.078 0.000 -2.754) 5.777 2.999 ( -0.209 0.000 1.651) 1.664 3.107 ( 1.959 -0.000 -2.128) 2.892 3.443 ( -0.009 0.000 -0.470) 0.470 3.452 ( -0.484 0.000 -2.091) 2.146 3.879 ( -2.450 0.000 -1.118) 2.693 3.920 ( 0.600 -0.000 -1.321) 1.451 5.959 ( 0.265 -0.000 2.422) 2.437 6.179 ( 3.448 -0.000 -4.943) 6.027 8.262 ( -7.761 0.000 10.427) 12.998 9.457 ( 8.163 -0.000 -2.925) 8.671 9.817 ( -0.586 0.000 3.516) 3.564 10.812 ( -11.516 0.000 -8.454) 14.286 13.995 ( -2.143 0.000 -4.410) 4.903 14.023 ( -3.649 0.000 -6.439) 7.401 15.581 ( -6.425 0.000 0.647) 6.457 15.586 ( 7.641 -0.000 1.025) 7.709 17.006 ( -0.063 0.000 6.309) 6.310 17.351 ( 5.421 -0.000 -2.295) 5.886 18.023 ( 5.177 -0.000 1.291) 5.335 18.186 ( -2.646 0.000 -3.608) 4.474 ======================= Grid point 410 (198/306) ======================= q-point: ( 0.10 0.00 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.097 ( -0.456 3.246 10.423) 10.927 1.247 ( -2.146 -6.341 9.597) 11.701 1.340 ( 4.021 3.136 2.960) 5.896 1.718 ( -9.614 -2.881 -8.414) 13.096 1.790 ( 5.601 -2.856 -5.920) 8.635 1.981 ( 12.269 4.046 -0.612) 12.933 2.238 ( 4.951 -4.026 6.396) 9.035 2.461 ( -3.323 0.035 -6.341) 7.159 2.839 ( -4.662 0.942 0.868) 4.835 2.870 ( -1.631 0.408 2.148) 2.728 3.018 ( 0.158 0.317 1.096) 1.152 3.112 ( 2.089 -0.439 -1.795) 2.789 3.407 ( -1.057 0.558 -0.162) 1.206 3.463 ( -0.791 -2.790 -1.258) 3.161 3.858 ( -0.802 -0.758 0.039) 1.105 3.921 ( 2.026 0.430 -0.885) 2.252 5.934 ( -4.441 5.138 2.059) 7.096 6.118 ( -0.313 2.040 -5.161) 5.559 8.309 ( -7.823 0.595 17.214) 18.918 9.383 ( 7.861 0.669 -23.194) 24.499 10.017 ( 2.452 -1.785 22.195) 22.401 10.622 ( -5.419 -2.924 -9.724) 11.510 13.951 ( 1.029 -0.953 -2.081) 2.510 14.016 ( 4.048 -5.893 -3.145) 7.810 15.527 ( -4.405 -1.181 0.528) 4.591 15.709 ( 8.940 -1.153 0.460) 9.026 17.062 ( -0.707 0.713 6.023) 6.106 17.355 ( 2.207 0.516 -4.427) 4.974 18.081 ( 2.892 1.062 0.015) 3.081 18.098 ( -3.714 0.675 -3.356) 5.051 ======================= Grid point 411 (199/306) ======================= q-point: ( 0.20 0.00 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 552 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.151 ( -0.482 3.167 6.106) 6.895 1.324 ( 1.480 4.230 1.208) 4.641 1.394 ( -0.517 -4.408 4.769) 6.515 1.554 ( -8.540 -3.383 -5.393) 10.652 1.843 ( 8.182 -3.354 -9.356) 12.874 2.126 ( 11.846 0.114 3.285) 12.294 2.338 ( -3.515 -1.292 -7.949) 8.787 2.410 ( 5.157 -2.603 4.642) 7.411 2.781 ( -4.741 1.431 1.411) 5.150 2.882 ( -0.545 -0.714 2.724) 2.868 3.013 ( 0.262 2.012 0.605) 2.117 3.136 ( 2.596 -1.329 -1.184) 3.147 3.411 ( -2.354 -2.336 1.972) 3.859 3.463 ( -1.396 -1.453 -0.971) 2.237 3.875 ( 0.169 -1.666 0.732) 1.827 3.948 ( 4.004 0.046 -0.020) 4.004 5.749 ( -10.509 11.333 0.677) 15.470 6.046 ( -0.849 0.838 -3.510) 3.707 8.439 ( -5.571 -0.473 21.020) 21.751 9.199 ( 7.178 0.220 -24.158) 25.203 10.199 ( -5.514 4.885 8.531) 11.271 10.640 ( 7.804 -9.836 2.411) 12.785 14.014 ( 4.543 -3.436 2.061) 6.058 14.175 ( 9.678 -8.898 -0.762) 13.169 15.509 ( -2.060 -1.551 0.246) 2.590 15.821 ( 6.253 -0.223 -0.182) 6.260 17.114 ( 0.515 -0.243 4.514) 4.549 17.308 ( 0.754 -0.036 -6.125) 6.171 17.964 ( -5.712 3.454 -3.661) 7.614 18.111 ( 1.187 0.454 0.648) 1.427 ======================= Grid point 412 (200/306) ======================= q-point: (-0.70 0.00 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.148 ( 0.023 1.647 0.503) 1.722 1.286 ( -0.214 4.351 0.640) 4.403 1.404 ( -3.520 -2.848 -4.778) 6.583 1.550 ( 1.652 -1.623 3.782) 4.435 1.850 ( 4.011 0.019 -7.539) 8.539 2.229 ( 0.365 -0.939 -4.161) 4.281 2.332 ( 6.222 -6.018 -0.489) 8.670 2.522 ( 3.656 -0.808 2.115) 4.301 2.736 ( -2.593 0.354 2.116) 3.366 2.933 ( 2.051 -1.380 2.250) 3.342 3.001 ( -0.124 1.599 1.275) 2.049 3.182 ( 3.024 -1.875 -0.417) 3.583 3.392 ( -4.304 0.673 -0.562) 4.392 3.476 ( -1.559 -2.166 2.403) 3.591 3.914 ( 0.491 -2.034 1.427) 2.532 4.027 ( 6.032 -2.421 0.676) 6.535 5.443 ( -13.867 13.338 0.215) 19.242 5.990 ( -1.262 0.599 -2.908) 3.226 8.579 ( -3.088 2.107 10.916) 11.539 9.101 ( 7.583 -3.997 -9.725) 12.964 10.036 ( -8.807 5.675 -4.367) 11.351 10.982 ( 11.290 -8.173 11.217) 17.891 14.180 ( 6.218 -4.662 5.841) 9.722 14.442 ( 13.003 -10.306 1.292) 16.642 15.513 ( -0.251 -1.202 -0.450) 1.308 15.838 ( -0.724 3.005 -0.476) 3.127 17.143 ( 0.206 0.998 -3.442) 3.590 17.295 ( 4.020 -5.026 -2.789) 7.014 17.792 ( -6.690 6.278 -2.459) 9.498 18.122 ( -0.450 -0.122 1.179) 1.268 ======================= Grid point 413 (201/306) ======================= q-point: (-0.60 0.00 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 552 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.132 ( 0.408 -0.284 -2.735) 2.780 1.224 ( -2.955 5.914 3.092) 7.299 1.375 ( 1.470 -4.154 -4.676) 6.425 1.585 ( 0.574 4.086 -0.422) 4.147 1.798 ( -0.179 -0.202 -3.454) 3.464 2.217 ( 1.166 -2.269 -3.427) 4.272 2.441 ( 2.364 -1.885 0.174) 3.029 2.587 ( 2.352 -1.638 1.186) 3.102 2.767 ( 1.105 -2.495 1.624) 3.175 2.995 ( -0.225 1.238 1.338) 1.837 3.012 ( 3.222 -2.403 1.235) 4.204 3.224 ( -0.670 -0.063 -1.312) 1.475 3.318 ( -1.970 1.360 1.589) 2.873 3.498 ( -1.612 -0.367 1.904) 2.521 3.964 ( 0.196 -2.042 1.851) 2.763 4.171 ( 8.027 -5.454 0.481) 9.716 5.111 ( -13.557 11.494 -0.161) 17.774 5.936 ( -1.399 0.366 -2.581) 2.958 8.530 ( 0.834 4.898 -4.953) 7.015 9.264 ( 4.513 -4.104 8.512) 10.472 9.816 ( -8.044 1.174 -4.834) 9.458 11.304 ( 9.213 -4.274 9.154) 13.672 14.389 ( 5.218 -4.284 8.118) 10.559 14.762 ( 13.936 -9.911 3.118) 17.383 15.516 ( 0.256 -0.478 -1.214) 1.330 15.719 ( -7.338 6.172 -1.211) 9.665 17.039 ( -1.280 1.917 -8.754) 9.053 17.441 ( 6.941 -8.676 -2.151) 11.317 17.598 ( -6.752 8.351 -0.394) 10.746 18.134 ( -0.547 -0.478 1.712) 1.860 ======================= Grid point 414 (202/306) ======================= q-point: (-0.50 0.00 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.087 ( -0.951 1.868 -4.045) 4.556 1.160 ( -4.445 3.220 5.330) 7.651 1.408 ( 0.088 1.140 -3.795) 3.963 1.476 ( -1.467 1.525 -1.170) 2.417 1.795 ( 1.488 -0.390 -1.012) 1.841 2.224 ( 1.201 -1.702 -2.785) 3.478 2.453 ( -0.737 1.911 0.995) 2.277 2.654 ( 1.821 -1.693 2.136) 3.278 2.801 ( -1.580 -0.167 -0.430) 1.646 2.985 ( -1.199 0.731 0.860) 1.646 3.055 ( -1.405 1.979 -0.247) 2.439 3.171 ( 0.424 -1.690 -0.280) 1.765 3.372 ( 3.110 -1.339 2.443) 4.175 3.490 ( -1.658 0.671 1.172) 2.139 4.000 ( -0.250 -0.724 1.395) 1.592 4.335 ( 4.989 -5.276 -1.778) 7.476 4.880 ( -4.742 3.387 0.618) 5.860 5.892 ( -1.275 0.233 -1.710) 2.146 8.439 ( 2.962 3.797 -5.049) 6.977 9.295 ( -4.425 8.530 1.651) 9.750 9.834 ( -1.180 -12.188 4.903) 13.190 11.509 ( 6.124 -1.109 5.009) 7.989 14.568 ( 1.759 -2.430 7.994) 8.539 15.081 ( 11.910 -7.830 4.356) 14.904 15.455 ( -10.497 4.514 -1.267) 11.496 15.546 ( 0.708 3.318 -2.749) 4.367 16.893 ( -1.756 2.166 -9.212) 9.624 17.390 ( -7.090 9.755 1.677) 12.175 17.621 ( 5.631 -9.417 -3.613) 11.552 18.164 ( 1.630 -0.557 1.589) 2.344 ======================= Grid point 415 (203/306) ======================= q-point: (-0.40 0.00 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 552 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.987 ( -4.218 3.552 -1.284) 5.662 1.145 ( -6.160 1.249 7.094) 9.478 1.234 ( -5.048 7.533 -2.107) 9.310 1.536 ( 1.891 -4.133 -0.403) 4.563 1.801 ( 2.130 1.959 -0.277) 2.907 2.217 ( 0.678 0.061 -3.230) 3.301 2.401 ( -3.998 3.886 1.665) 5.819 2.698 ( -0.194 0.238 -0.871) 0.923 2.735 ( -3.124 2.169 2.409) 4.502 2.978 ( -0.488 0.356 1.420) 1.543 3.007 ( -0.673 1.262 -0.267) 1.455 3.223 ( 2.058 -2.213 -0.974) 3.175 3.438 ( 0.749 -2.207 -0.791) 2.462 3.479 ( -0.374 0.982 2.435) 2.652 4.003 ( -0.826 0.778 0.474) 1.230 4.307 ( -5.800 0.484 -4.303) 7.238 5.006 ( 12.687 -9.466 2.583) 16.038 5.865 ( -0.785 0.067 -0.240) 0.824 8.394 ( 2.128 1.356 -4.066) 4.785 9.132 ( -5.420 10.178 5.188) 12.644 10.028 ( -0.887 -12.569 0.472) 12.609 11.601 ( 2.613 -0.127 0.760) 2.724 14.645 ( -3.407 0.439 4.838) 5.933 15.122 ( -12.666 6.585 -4.628) 15.007 15.384 ( 3.578 -4.352 3.998) 6.909 15.558 ( 8.051 1.295 -0.115) 8.155 16.756 ( -2.083 2.007 -5.519) 6.231 17.213 ( -5.686 9.991 3.524) 12.023 17.737 ( 1.987 -8.157 -3.618) 9.142 18.220 ( 4.478 -0.498 -0.076) 4.506 ======================= Grid point 416 (204/306) ======================= q-point: (-0.30 0.00 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.882 ( -6.206 3.721 3.304) 7.955 1.023 ( -6.057 8.613 2.382) 10.796 1.202 ( -3.685 -0.311 7.915) 8.736 1.558 ( -2.955 -0.667 -0.377) 3.053 1.806 ( 3.813 3.700 1.439) 5.505 2.160 ( 0.146 3.313 -3.381) 4.736 2.323 ( -4.055 2.039 0.805) 4.610 2.653 ( -1.655 -0.347 -1.371) 2.177 2.746 ( 0.324 0.432 2.041) 2.111 2.969 ( -2.500 -0.208 0.760) 2.622 3.016 ( 2.528 0.277 0.421) 2.578 3.236 ( 0.132 -0.086 -1.841) 1.848 3.428 ( -1.795 -1.932 -2.066) 3.350 3.508 ( 0.924 0.426 1.783) 2.053 3.978 ( -1.113 1.024 -0.264) 1.535 4.172 ( -6.139 1.003 -3.960) 7.374 5.368 ( 16.727 -11.980 2.443) 20.719 5.876 ( 0.898 -1.220 1.424) 2.079 8.349 ( -1.472 -1.237 -5.117) 5.466 9.070 ( -2.531 9.311 14.879) 17.734 10.097 ( -1.357 -9.229 -9.726) 13.476 11.584 ( -3.397 -0.030 -4.273) 5.459 14.569 ( -8.805 3.458 -0.338) 9.466 14.795 ( -13.368 7.238 -7.506) 16.954 15.452 ( 0.414 -1.025 0.309) 1.147 15.696 ( 8.263 0.639 2.937) 8.793 16.705 ( -0.189 -0.259 2.407) 2.429 17.100 ( -1.266 7.812 4.814) 9.264 17.803 ( 0.385 -5.609 -1.794) 5.901 18.270 ( 4.713 0.030 -2.322) 5.254 ======================= Grid point 417 (205/306) ======================= q-point: (-0.20 0.00 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 552 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.849 ( -1.370 4.962 10.155) 11.386 0.919 ( -3.491 3.061 4.171) 6.241 1.215 ( -4.526 6.751 8.160) 11.518 1.542 ( -2.416 -4.042 3.065) 5.618 1.827 ( 3.916 4.088 1.607) 5.885 2.094 ( 1.708 3.615 -2.430) 4.679 2.249 ( -4.548 0.819 -2.452) 5.232 2.628 ( -1.345 -1.185 -2.337) 2.945 2.776 ( 0.475 -0.887 2.178) 2.399 2.955 ( -1.821 -1.218 0.302) 2.212 3.044 ( 1.554 0.376 0.252) 1.619 3.189 ( -1.433 1.415 -3.255) 3.827 3.418 ( -0.740 -2.113 -1.340) 2.609 3.519 ( 0.200 1.234 0.662) 1.414 3.951 ( -0.798 0.411 -0.750) 1.169 4.048 ( -5.025 1.192 -3.525) 6.252 5.707 ( 12.012 -7.934 1.771) 14.504 5.964 ( 5.587 -4.569 1.250) 7.325 8.290 ( -4.210 -2.720 -2.731) 5.708 9.148 ( -0.519 7.194 20.130) 21.383 10.030 ( 0.388 -5.559 -16.672) 17.578 11.405 ( -11.893 1.949 -8.539) 14.770 14.359 ( -11.122 4.620 -4.234) 12.766 14.471 ( -10.632 5.889 -8.925) 15.079 15.469 ( 2.327 0.861 0.237) 2.493 15.740 ( -1.617 2.351 1.299) 3.135 16.804 ( 2.483 -2.922 6.301) 7.376 17.118 ( 6.423 3.266 5.532) 9.084 17.859 ( 1.378 -3.201 0.567) 3.530 18.279 ( 2.534 0.611 -3.496) 4.361 ======================= Grid point 418 (206/306) ======================= q-point: (-0.10 0.00 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.919 ( -2.070 -1.467 9.893) 10.213 0.992 ( 5.069 1.663 10.640) 11.902 1.134 ( -3.158 8.717 7.398) 11.861 1.663 ( 2.271 -6.558 3.710) 7.870 1.836 ( 3.930 3.336 0.449) 5.175 2.056 ( 0.811 3.378 -0.297) 3.487 2.128 ( -5.242 0.914 -5.762) 7.843 2.592 ( -1.755 -0.407 -2.376) 2.982 2.823 ( 0.157 -1.223 2.751) 3.015 2.960 ( -1.679 -2.663 -0.234) 3.156 3.033 ( -1.674 1.993 -0.618) 2.675 3.121 ( 0.462 0.935 -3.411) 3.567 3.428 ( -0.094 -2.135 -0.852) 2.300 3.498 ( 0.073 2.425 -0.692) 2.523 3.931 ( -0.770 -0.170 -1.207) 1.442 3.945 ( -3.484 0.855 -2.591) 4.425 5.887 ( 4.173 -2.910 2.432) 5.639 6.118 ( 8.125 -4.611 -2.534) 9.680 8.260 ( -5.913 -2.131 3.220) 7.062 9.303 ( 2.201 3.460 17.490) 17.964 9.902 ( 1.433 -1.785 -15.873) 16.038 11.095 ( -15.574 2.633 -8.761) 18.062 14.132 ( -8.131 2.723 -5.460) 10.166 14.202 ( -7.422 3.686 -8.419) 11.813 15.505 ( 4.888 1.205 0.877) 5.110 15.667 ( -6.544 1.686 0.865) 6.813 16.923 ( 1.037 -1.483 6.114) 6.376 17.259 ( 9.339 -0.411 1.750) 9.511 17.935 ( 3.957 -1.442 1.981) 4.655 18.246 ( -0.278 0.405 -3.594) 3.628 ======================= Grid point 420 (207/306) ======================= q-point: ( 0.10 0.10 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 305 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.259 ( 3.332 -0.000 9.369) 9.944 1.260 ( -3.768 0.000 6.852) 7.820 1.437 ( 5.306 -0.000 0.248) 5.312 1.479 ( -9.150 0.000 -8.838) 12.722 1.774 ( 7.695 -0.000 -7.603) 10.817 2.151 ( 13.068 -0.000 -2.104) 13.236 2.325 ( -4.474 0.000 -8.810) 9.881 2.367 ( 4.195 -0.000 10.034) 10.876 2.804 ( -5.070 0.000 2.804) 5.794 2.870 ( -2.376 0.000 2.586) 3.512 3.047 ( 1.425 -0.000 0.932) 1.702 3.107 ( 1.195 -0.000 -2.117) 2.430 3.381 ( -2.269 0.000 -0.540) 2.332 3.429 ( -0.569 0.000 -0.317) 0.651 3.856 ( 0.064 -0.000 1.143) 1.145 3.960 ( 4.715 -0.000 -0.175) 4.718 5.931 ( -6.253 0.000 1.885) 6.531 6.018 ( -6.389 0.000 -5.445) 8.395 8.439 ( -6.541 0.000 22.508) 23.439 9.200 ( 5.559 -0.000 -24.863) 25.477 10.343 ( 8.290 -0.000 23.860) 25.259 10.430 ( -2.625 0.000 -12.407) 12.681 13.988 ( 6.535 -0.000 0.437) 6.550 14.045 ( 8.799 -0.000 0.992) 8.855 15.494 ( -0.644 0.000 0.256) 0.693 15.808 ( 7.849 -0.000 -0.843) 7.894 17.115 ( -0.462 0.000 4.476) 4.500 17.310 ( -0.054 0.000 -6.423) 6.423 18.008 ( -4.815 0.000 -2.960) 5.652 18.114 ( 0.292 -0.000 0.209) 0.359 ======================= Grid point 421 (208/306) ======================= q-point: ( 0.20 0.10 -0.64) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.228 ( -2.071 3.395 0.924) 4.082 1.303 ( -3.594 -1.336 -8.238) 9.087 1.414 ( 4.628 1.504 4.420) 6.574 1.513 ( 5.372 -0.801 3.267) 6.339 1.811 ( 7.841 -2.305 -7.438) 11.050 2.175 ( -3.897 -1.956 -8.352) 9.422 2.277 ( 9.258 0.362 -0.716) 9.293 2.514 ( 3.455 -0.078 6.350) 7.230 2.764 ( -4.690 1.533 2.937) 5.742 2.897 ( -0.694 -1.503 4.712) 4.995 3.048 ( 0.837 2.206 -0.583) 2.430 3.118 ( 1.276 -2.868 -1.489) 3.474 3.365 ( -3.017 -1.612 1.489) 3.731 3.423 ( -1.481 -1.244 0.069) 1.935 3.880 ( 0.614 -0.624 1.623) 1.844 4.030 ( 7.099 0.962 0.502) 7.182 5.741 ( -11.780 10.324 -1.283) 15.716 5.934 ( -7.302 -5.117 -2.447) 9.246 8.633 ( -3.296 1.738 23.247) 23.544 9.014 ( 5.059 -2.477 -20.340) 21.105 10.210 ( -2.307 6.570 -11.683) 13.601 10.766 ( 10.357 -7.383 18.707) 22.621 14.120 ( 9.819 -0.245 4.584) 10.839 14.240 ( 12.596 -5.403 3.127) 14.058 15.508 ( 2.678 0.345 -0.155) 2.704 15.864 ( 2.739 -0.197 -2.298) 3.581 17.156 ( 1.460 0.143 1.091) 1.828 17.224 ( -1.008 -1.046 -7.253) 7.397 17.908 ( -4.584 2.758 -1.808) 5.647 18.107 ( -2.608 -0.749 0.861) 2.846 ======================= Grid point 422 (209/306) ======================= q-point: ( 0.30 0.10 -0.64) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.170 ( 0.090 2.439 -2.126) 3.237 1.237 ( 0.362 -3.434 -5.784) 6.736 1.419 ( 2.424 6.607 0.944) 7.100 1.651 ( 7.668 1.079 1.867) 7.965 1.817 ( 2.650 0.846 -5.413) 6.086 2.124 ( 1.215 -5.556 -5.496) 7.909 2.368 ( 5.119 -1.703 -0.372) 5.408 2.588 ( 1.935 0.943 2.727) 3.474 2.737 ( -2.098 0.187 2.661) 3.393 2.972 ( 1.052 -1.171 3.904) 4.209 3.023 ( 0.420 1.355 -0.696) 1.580 3.170 ( 1.979 -3.590 -0.533) 4.133 3.347 ( -3.894 0.465 1.423) 4.172 3.438 ( -2.774 -3.298 2.366) 4.916 3.921 ( 1.025 -1.313 1.705) 2.384 4.125 ( 8.576 0.726 1.048) 8.670 5.413 ( -14.784 12.279 -1.708) 19.294 5.877 ( -7.613 -5.062 -2.342) 9.437 8.676 ( 2.378 6.842 -4.106) 8.326 9.092 ( 3.020 -8.420 12.243) 15.163 9.950 ( -3.466 7.297 -13.087) 15.380 11.160 ( 8.855 -6.384 14.348) 18.029 14.323 ( 10.086 -0.894 7.584) 12.651 14.539 ( 14.541 -7.779 4.915) 17.208 15.536 ( 4.368 1.749 -0.918) 4.794 15.814 ( -4.276 1.625 -3.468) 5.740 17.078 ( -1.955 1.171 -8.694) 8.988 17.261 ( 5.015 -5.208 -1.951) 7.488 17.784 ( -4.790 6.271 0.054) 7.892 18.098 ( -3.392 -2.159 1.622) 4.336 ======================= Grid point 423 (210/306) ======================= q-point: (-0.60 0.10 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.122 ( 0.952 1.849 -3.168) 3.790 1.250 ( 0.251 -2.191 -1.425) 2.626 1.373 ( 3.011 4.942 -0.208) 5.791 1.631 ( -0.366 6.302 -4.043) 7.496 1.813 ( 5.266 1.847 -0.521) 5.604 2.175 ( 3.443 -2.879 -2.494) 5.135 2.447 ( 2.885 -2.712 0.082) 3.960 2.623 ( 1.680 0.125 2.073) 2.671 2.762 ( -0.196 -1.897 1.117) 2.210 2.997 ( -1.219 0.084 0.302) 1.258 3.041 ( 2.667 -1.128 0.269) 2.908 3.192 ( -1.860 0.799 -0.949) 2.236 3.337 ( -0.341 -0.851 3.225) 3.353 3.468 ( -3.062 -2.718 2.508) 4.801 3.971 ( 1.153 -1.401 1.599) 2.419 4.247 ( 8.393 -1.052 0.843) 8.501 5.067 ( -13.130 10.522 -1.808) 16.923 5.825 ( -7.344 -5.526 -1.874) 9.380 8.567 ( 5.397 6.148 -7.797) 11.302 9.394 ( 0.083 -3.584 18.686) 19.027 9.689 ( -2.462 2.989 -11.781) 12.401 11.436 ( 4.914 -4.157 8.136) 10.374 14.535 ( 7.639 -0.204 8.541) 11.460 14.880 ( 13.760 -8.113 6.297) 17.169 15.533 ( 0.279 3.366 -1.704) 3.783 15.661 ( -4.587 3.929 -4.736) 7.675 16.937 ( -1.923 1.337 -9.170) 9.465 17.382 ( 5.720 -7.915 -3.914) 10.521 17.638 ( -5.588 8.713 2.085) 10.558 18.118 ( -1.586 -3.073 1.820) 3.908 ======================= Grid point 424 (211/306) ======================= q-point: (-0.50 0.10 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.076 ( 0.827 2.900 -2.053) 3.648 1.217 ( -4.067 3.652 3.429) 6.452 1.397 ( 4.272 1.250 -2.547) 5.128 1.490 ( -1.391 5.431 -1.048) 5.703 1.852 ( 6.701 2.280 -1.799) 7.303 2.208 ( 2.182 -0.226 -1.108) 2.457 2.476 ( -0.570 1.509 0.635) 1.733 2.681 ( 1.680 -1.338 1.632) 2.698 2.770 ( -2.228 -0.215 0.255) 2.253 2.988 ( -0.094 0.171 0.312) 0.367 3.056 ( -1.651 1.599 -0.267) 2.314 3.166 ( 1.265 -1.214 0.567) 1.843 3.379 ( -1.431 -2.338 0.421) 2.773 3.488 ( -0.844 -0.616 2.129) 2.371 4.009 ( 0.474 -0.218 1.142) 1.256 4.321 ( 0.160 0.683 -1.732) 1.869 4.884 ( 0.825 0.434 0.614) 1.117 5.793 ( -6.840 -5.857 -0.668) 9.030 8.488 ( 5.651 5.744 -6.762) 10.520 9.376 ( -5.557 9.540 3.119) 11.473 9.757 ( 2.088 -9.560 5.191) 11.077 11.564 ( 0.474 -2.588 1.741) 3.156 14.678 ( 3.009 2.177 6.615) 7.586 15.178 ( 6.930 -4.548 4.664) 9.511 15.353 ( -10.314 4.415 -2.896) 11.587 15.611 ( 8.067 2.746 -3.087) 9.064 16.808 ( -1.011 1.998 -6.651) 7.017 17.451 ( -3.676 6.243 1.864) 7.481 17.531 ( 1.522 -5.259 -2.482) 6.011 18.171 ( 1.173 -3.377 0.696) 3.642 ======================= Grid point 425 (212/306) ======================= q-point: (-0.40 0.10 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.024 ( 0.811 6.693 2.086) 7.057 1.189 ( -3.892 0.201 5.986) 7.143 1.275 ( -1.236 11.019 -1.604) 11.204 1.522 ( 2.611 -2.080 0.264) 3.349 1.883 ( 7.243 2.647 -2.789) 8.200 2.214 ( 1.733 1.333 -0.933) 2.377 2.415 ( -4.524 4.446 1.317) 6.478 2.674 ( -1.862 1.231 -1.785) 2.858 2.766 ( -0.425 0.716 2.731) 2.855 2.980 ( -3.023 1.148 1.218) 3.455 3.024 ( 1.460 0.468 -0.068) 1.535 3.217 ( 1.580 -1.626 -0.210) 2.277 3.366 ( -3.197 -2.770 -1.989) 4.674 3.505 ( -0.572 -0.443 1.225) 1.422 4.006 ( -1.219 1.331 0.483) 1.868 4.218 ( -4.917 2.921 -2.661) 6.308 5.084 ( 14.305 -9.959 2.443) 17.601 5.785 ( -6.314 -6.208 0.766) 8.888 8.396 ( 2.303 4.950 -7.298) 9.113 9.291 ( -2.511 8.121 11.592) 14.375 9.896 ( 0.668 -6.771 -2.477) 7.241 11.559 ( -4.141 -1.926 -3.426) 5.710 14.680 ( -3.233 5.420 1.882) 6.586 15.000 ( -10.972 8.996 -7.140) 15.884 15.397 ( 0.834 -3.409 3.848) 5.208 15.703 ( 10.720 0.024 0.043) 10.720 16.735 ( 0.795 2.233 -0.728) 2.480 17.311 ( -4.912 9.187 4.021) 11.167 17.632 ( 3.052 -8.000 -2.415) 8.896 18.232 ( 2.372 -3.142 -1.619) 4.257 ======================= Grid point 426 (213/306) ======================= q-point: (-0.30 0.10 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.002 ( 1.904 7.572 7.516) 10.837 1.110 ( -0.565 10.637 -0.699) 10.675 1.256 ( -1.102 -1.792 9.269) 9.505 1.541 ( -0.229 1.885 -0.089) 1.901 1.903 ( 6.917 2.499 -4.060) 8.401 2.200 ( 2.305 3.764 -0.210) 4.419 2.301 ( -6.512 4.182 0.609) 7.763 2.621 ( -1.186 0.683 -1.807) 2.267 2.773 ( -0.384 0.757 1.628) 1.836 2.937 ( -3.079 0.085 0.176) 3.085 3.045 ( 1.143 -0.313 -0.063) 1.187 3.216 ( -1.621 0.182 -1.595) 2.281 3.354 ( -0.965 -2.822 -1.111) 3.183 3.516 ( -1.219 -1.427 0.837) 2.055 3.970 ( -1.927 1.408 0.196) 2.395 4.106 ( -2.660 3.478 -2.444) 5.015 5.447 ( 15.910 -12.091 1.710) 20.056 5.813 ( -4.969 -7.723 1.908) 9.380 8.282 ( -1.661 2.729 -4.300) 5.357 9.350 ( -0.819 8.349 19.522) 21.248 9.894 ( 2.289 -4.909 -12.909) 13.999 11.430 ( -9.455 -0.217 -7.217) 11.896 14.512 ( -9.124 7.527 -2.598) 12.111 14.673 ( -7.767 10.137 -8.748) 15.480 15.468 ( 1.845 -1.170 2.199) 3.100 15.794 ( 2.377 1.356 0.591) 2.800 16.769 ( 3.030 0.478 5.204) 6.041 17.227 ( 0.085 5.631 3.808) 6.799 17.745 ( 3.522 -5.952 -0.023) 6.916 18.261 ( 1.431 -2.350 -3.825) 4.712 ======================= Grid point 427 (214/306) ======================= q-point: (-0.20 0.10 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.985 ( -3.460 6.284 5.406) 8.982 1.074 ( 6.369 5.269 7.541) 11.189 1.352 ( -1.334 5.435 8.272) 9.987 1.529 ( 2.781 -1.627 2.943) 4.364 1.898 ( 5.865 2.168 -6.076) 8.719 2.158 ( -8.219 3.192 -2.012) 9.043 2.188 ( 3.937 4.742 0.445) 6.180 2.584 ( -1.124 -0.036 -1.991) 2.286 2.789 ( 0.006 -0.766 2.066) 2.203 2.908 ( -2.539 -1.362 -0.733) 2.973 3.050 ( -0.724 -0.545 -0.644) 1.112 3.157 ( -1.555 1.287 -2.625) 3.311 3.379 ( 0.201 -1.902 0.481) 1.972 3.526 ( -1.007 -0.737 0.658) 1.410 3.934 ( -1.575 0.801 -0.326) 1.797 4.003 ( -1.739 4.095 -2.716) 5.212 5.748 ( 6.949 -8.194 1.568) 10.858 5.915 ( 1.931 -11.052 0.105) 11.220 8.216 ( -4.295 0.045 2.805) 5.129 9.449 ( -0.513 7.786 16.267) 18.042 9.836 ( 5.511 -3.300 -13.548) 14.994 11.177 ( -13.247 2.897 -9.078) 16.318 14.256 ( -9.529 7.110 -4.308) 12.646 14.376 ( -4.176 10.090 -8.776) 14.009 15.533 ( 4.632 0.350 1.611) 4.916 15.741 ( -5.374 3.812 0.650) 6.621 16.878 ( 1.795 -1.201 6.908) 7.238 17.259 ( 5.521 0.914 1.758) 5.866 17.868 ( 4.840 -3.947 1.778) 6.493 18.240 ( -0.703 -1.443 -4.873) 5.131 ======================= Grid point 428 (215/306) ======================= q-point: (-0.10 0.10 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.984 ( -1.622 0.806 8.573) 8.762 1.202 ( 4.900 -0.074 7.497) 8.956 1.287 ( -3.507 9.114 7.214) 12.141 1.711 ( 9.631 -2.882 4.663) 11.081 1.872 ( 5.791 0.595 -7.226) 9.279 1.963 ( -10.494 2.486 -5.651) 12.175 2.194 ( 5.105 5.579 2.102) 7.849 2.541 ( -1.847 -0.147 -3.095) 3.607 2.831 ( -0.437 -1.508 2.749) 3.165 2.885 ( -2.955 -1.879 -1.294) 3.733 3.026 ( -2.161 0.360 0.067) 2.192 3.115 ( 1.469 0.741 -2.254) 2.790 3.403 ( -0.091 -0.773 0.563) 0.960 3.514 ( -0.832 1.430 -0.388) 1.699 3.897 ( -1.721 1.427 -1.052) 2.471 3.924 ( -0.050 1.365 -1.688) 2.171 5.877 ( -2.048 -6.511 2.576) 7.295 6.076 ( 5.077 -7.926 -3.901) 10.189 8.233 ( -6.483 -1.216 10.644) 12.522 9.475 ( 5.855 1.408 -7.848) 9.892 9.852 ( 1.999 2.453 8.016) 8.618 10.871 ( -11.238 4.002 -9.168) 15.045 14.043 ( -4.995 4.602 -3.752) 7.759 14.142 ( -0.574 8.537 -6.840) 10.954 15.606 ( 2.349 1.362 1.129) 2.941 15.627 ( -1.868 3.242 0.798) 3.826 16.982 ( 0.083 -1.378 6.845) 6.983 17.334 ( 5.060 -0.977 -1.778) 5.451 17.993 ( 5.410 -2.352 1.653) 6.126 18.179 ( -2.912 -1.004 -4.658) 5.584 ======================= Grid point 431 (216/306) ======================= q-point: ( 0.20 0.20 -0.64) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.186 ( 0.164 -0.000 -6.229) 6.231 1.208 ( -2.355 0.000 -1.616) 2.856 1.560 ( 1.636 -0.000 0.332) 1.670 1.621 ( 16.375 -0.000 1.212) 16.419 1.824 ( 6.440 -0.000 -4.575) 7.899 2.033 ( -2.989 0.000 -5.830) 6.551 2.357 ( 5.727 -0.000 -1.802) 6.004 2.602 ( 1.962 -0.000 3.180) 3.736 2.754 ( -4.233 0.000 3.111) 5.253 2.948 ( -0.214 0.000 6.558) 6.562 3.069 ( -0.021 0.000 -2.006) 2.006 3.089 ( 2.837 -0.000 -0.535) 2.887 3.348 ( -2.937 0.000 3.721) 4.741 3.393 ( -2.393 0.000 0.219) 2.403 3.905 ( 0.898 -0.000 1.724) 1.944 4.144 ( 8.692 -0.000 0.762) 8.725 5.665 ( -12.553 0.000 -3.876) 13.138 5.717 ( -12.523 0.000 -0.640) 12.539 8.829 ( 5.512 -0.000 -18.651) 19.448 8.917 ( -0.526 0.000 27.544) 27.549 10.063 ( -1.575 0.000 -16.921) 16.994 11.062 ( 8.976 -0.000 18.515) 20.576 14.331 ( 12.612 -0.000 7.091) 14.469 14.419 ( 13.958 -0.000 5.762) 15.101 15.567 ( 6.740 -0.000 -1.028) 6.817 15.825 ( -3.109 0.000 -4.165) 5.198 17.093 ( -3.001 0.000 -9.031) 9.516 17.197 ( 4.259 -0.000 -1.557) 4.535 17.876 ( -2.355 0.000 0.131) 2.358 18.058 ( -5.998 0.000 1.650) 6.221 ======================= Grid point 432 (217/306) ======================= q-point: ( 0.30 0.20 -0.64) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.160 ( -0.824 0.918 -1.958) 2.315 1.170 ( 3.228 -2.132 -3.468) 5.195 1.523 ( -0.982 4.225 -0.513) 4.368 1.768 ( 10.244 5.018 -7.272) 13.528 1.869 ( 7.151 2.339 1.416) 7.656 2.039 ( 5.654 -7.394 -1.964) 9.513 2.392 ( 2.513 -0.846 -1.023) 2.842 2.644 ( 1.374 0.728 1.959) 2.501 2.737 ( -2.423 -0.092 1.864) 3.059 2.988 ( -1.301 -0.555 1.331) 1.942 3.043 ( 0.809 0.939 -0.742) 1.444 3.162 ( 3.179 -2.145 1.150) 4.004 3.344 ( -2.894 1.155 2.889) 4.249 3.391 ( -3.101 -2.738 3.579) 5.470 3.941 ( 1.572 -0.763 1.374) 2.223 4.258 ( 8.837 0.865 1.045) 8.940 5.351 ( -14.668 11.727 -2.521) 18.948 5.632 ( -12.658 -9.699 -2.227) 16.102 8.708 ( 6.999 4.100 -11.508) 14.080 9.251 ( 1.549 -4.684 24.239) 24.736 9.823 ( -2.787 4.230 -16.066) 16.846 11.342 ( 4.843 -2.583 12.203) 13.381 14.559 ( 11.586 1.934 8.694) 14.614 14.706 ( 14.117 -5.281 7.306) 16.750 15.623 ( 6.009 3.178 -2.784) 7.345 15.706 ( -5.450 -0.144 -5.387) 7.665 16.957 ( -2.750 0.279 -8.195) 8.649 17.241 ( 5.477 -3.019 -4.769) 7.864 17.827 ( -2.564 5.967 1.957) 6.783 18.023 ( -5.710 -4.054 2.110) 7.314 ======================= Grid point 433 (218/306) ======================= q-point: ( 0.40 0.20 -0.64) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 552 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.129 ( 0.379 1.433 -0.349) 1.522 1.219 ( 2.447 -2.141 -0.676) 3.321 1.455 ( -0.486 3.517 0.328) 3.565 1.693 ( 4.403 8.332 -5.484) 10.903 1.916 ( 6.952 3.110 -1.508) 7.764 2.195 ( 6.981 -1.748 -0.076) 7.197 2.446 ( 2.856 -3.354 0.007) 4.405 2.668 ( 0.953 0.674 1.741) 2.096 2.741 ( -0.989 -1.477 0.620) 1.882 2.982 ( -0.553 -0.517 -0.341) 0.830 3.049 ( 0.723 -0.793 -0.335) 1.124 3.186 ( -1.253 1.219 0.523) 1.825 3.334 ( -3.130 -1.157 1.366) 3.606 3.448 ( -0.140 -2.072 4.184) 4.671 3.992 ( 2.513 -1.045 0.896) 2.865 4.354 ( 6.140 1.813 0.883) 6.463 5.017 ( -11.156 9.367 -1.758) 14.673 5.586 ( -11.648 -10.553 -1.221) 15.764 8.644 ( 8.270 5.989 -7.212) 12.501 9.542 ( 4.396 -4.419 -10.149) 11.910 9.597 ( -6.411 4.619 17.952) 19.614 11.494 ( -0.380 -2.619 4.339) 5.082 14.747 ( 7.976 3.279 8.209) 11.906 15.027 ( 11.226 -6.309 7.870) 15.092 15.479 ( -9.159 4.374 -5.104) 11.360 15.675 ( 7.547 2.082 -5.965) 9.842 16.851 ( -0.122 1.436 -5.421) 5.610 17.309 ( 5.381 -6.527 -5.428) 10.051 17.707 ( -5.980 8.774 3.092) 11.059 18.060 ( -2.033 -5.534 1.500) 6.083 ======================= Grid point 434 (219/306) ======================= q-point: (-0.50 0.20 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.136 ( 2.280 1.962 2.933) 4.201 1.228 ( -2.356 2.430 2.348) 4.119 1.466 ( 4.775 0.237 0.323) 4.792 1.569 ( 2.623 9.883 -3.907) 10.946 1.946 ( 7.454 2.815 -2.737) 8.425 2.250 ( 3.059 1.622 0.330) 3.478 2.489 ( 0.053 0.759 -0.174) 0.781 2.684 ( -0.656 -0.301 -0.353) 0.804 2.762 ( 0.003 -0.997 2.024) 2.256 2.990 ( -0.014 -0.679 0.492) 0.839 3.048 ( -1.262 0.717 -0.356) 1.494 3.172 ( -0.667 -1.017 1.012) 1.582 3.309 ( -3.953 -1.655 -0.589) 4.326 3.495 ( -0.065 -0.470 0.530) 0.712 4.036 ( 2.314 0.690 0.543) 2.475 4.325 ( -3.540 5.834 -0.259) 6.829 4.921 ( 5.104 -2.551 1.340) 5.861 5.573 ( -10.917 -10.731 0.276) 15.310 8.571 ( 6.341 8.580 -7.623) 13.112 9.424 ( 0.933 1.273 -2.801) 3.215 9.787 ( -2.021 -1.141 12.803) 13.012 11.500 ( -4.881 -2.529 -2.339) 5.975 14.826 ( 1.634 6.195 4.417) 7.782 15.216 ( -4.736 7.614 -4.674) 10.111 15.292 ( 0.667 -4.481 5.128) 6.842 15.699 ( 9.000 -0.510 -4.927) 10.273 16.804 ( 3.297 3.311 -1.274) 4.843 17.420 ( 5.548 -8.176 -3.423) 10.457 17.546 ( -7.361 8.906 3.322) 12.022 18.122 ( -0.565 -5.537 -0.306) 5.574 ======================= Grid point 435 (220/306) ======================= q-point: (-0.40 0.20 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 552 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.181 ( -3.081 4.911 4.566) 7.380 1.213 ( 5.329 1.304 6.362) 8.401 1.414 ( 2.871 11.837 -3.266) 12.610 1.553 ( 3.794 -0.623 1.062) 3.989 1.966 ( 7.628 2.977 -4.371) 9.282 2.260 ( 1.874 1.843 -0.036) 2.629 2.434 ( -3.599 4.790 1.168) 6.104 2.649 ( -1.133 1.193 -2.062) 2.638 2.790 ( -0.456 0.105 1.540) 1.609 2.969 ( -3.460 1.992 0.914) 4.096 3.028 ( -0.757 -0.920 -0.984) 1.545 3.175 ( -4.229 -2.983 -0.880) 5.250 3.302 ( 1.284 -1.602 -0.306) 2.075 3.476 ( -2.425 -0.991 -1.052) 2.823 4.031 ( -0.256 3.468 1.203) 3.679 4.210 ( -2.084 5.031 0.071) 5.446 5.160 ( 13.911 -10.392 1.879) 17.465 5.582 ( -10.750 -10.878 1.579) 15.375 8.428 ( 2.263 8.904 -6.757) 11.404 9.493 ( 4.086 0.874 10.304) 11.119 9.825 ( -2.279 0.968 -0.844) 2.616 11.397 ( -8.435 -2.202 -6.224) 10.712 14.717 ( -6.900 8.799 -0.675) 11.202 14.950 ( -3.225 11.969 -7.946) 14.724 15.411 ( 0.036 -3.367 4.896) 5.942 15.790 ( 6.288 -1.820 -1.403) 6.695 16.824 ( 5.327 3.756 2.845) 7.112 17.393 ( -5.131 7.571 2.994) 9.623 17.572 ( 6.094 -7.865 -0.742) 9.977 18.164 ( -1.094 -5.278 -2.629) 5.997 ======================= Grid point 436 (221/306) ======================= q-point: (-0.30 0.20 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.133 ( -3.783 4.718 4.822) 7.734 1.279 ( 2.940 10.465 -1.054) 10.921 1.370 ( 6.191 0.153 9.168) 11.064 1.595 ( 3.541 3.021 1.181) 4.802 1.963 ( 7.396 3.428 -6.018) 10.133 2.227 ( -4.178 2.462 -1.985) 5.240 2.334 ( -1.013 6.668 2.370) 7.149 2.595 ( -0.323 0.998 -3.298) 3.461 2.788 ( -0.721 0.065 0.830) 1.101 2.908 ( -3.207 1.736 0.269) 3.657 3.008 ( -3.022 -2.998 -1.980) 4.695 3.150 ( -2.164 -1.885 -1.651) 3.311 3.344 ( 1.615 -0.798 1.399) 2.281 3.468 ( -2.117 -3.226 0.140) 3.861 3.989 ( -1.339 3.905 1.672) 4.454 4.133 ( 0.183 5.897 -0.995) 5.983 5.498 ( 13.879 -11.632 0.546) 18.117 5.615 ( -9.605 -12.601 2.327) 16.014 8.298 ( -0.639 6.707 0.003) 6.737 9.666 ( -3.530 9.184 19.496) 21.838 9.732 ( 7.867 -5.233 -15.032) 17.754 11.212 ( -10.855 -0.137 -8.231) 13.623 14.468 ( -9.771 9.781 -2.591) 14.066 14.676 ( -0.351 13.743 -8.981) 16.421 15.507 ( 1.815 -2.525 4.243) 5.261 15.817 ( -1.286 1.664 -0.255) 2.119 16.894 ( 4.234 2.616 5.469) 7.394 17.315 ( 0.180 3.635 1.392) 3.896 17.744 ( 6.825 -6.012 1.447) 9.210 18.164 ( -2.613 -4.716 -4.544) 7.051 ======================= Grid point 437 (222/306) ======================= q-point: (-0.20 0.20 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 552 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.073 ( -2.972 5.218 4.648) 7.594 1.229 ( 1.487 3.411 2.120) 4.282 1.472 ( -2.774 4.197 6.549) 8.258 1.674 ( 11.302 1.187 5.010) 12.419 1.935 ( 6.245 4.122 -6.311) 9.789 2.047 ( -8.704 4.333 -4.793) 10.840 2.318 ( 4.233 4.436 1.341) 6.276 2.543 ( -0.526 0.470 -4.115) 4.175 2.808 ( 0.585 -1.092 1.820) 2.202 2.855 ( -3.123 0.316 -0.430) 3.168 2.993 ( -2.976 -2.817 -0.598) 4.141 3.127 ( 0.297 -0.182 -2.325) 2.351 3.391 ( 0.720 -0.603 2.611) 2.775 3.491 ( -1.518 -2.975 0.328) 3.356 3.941 ( -1.373 3.277 0.891) 3.663 4.039 ( 0.212 6.912 -1.839) 7.156 5.652 ( -8.629 -11.417 2.944) 14.611 5.820 ( 10.153 -12.030 -2.122) 15.884 8.260 ( -3.050 3.981 9.069) 10.363 9.521 ( 2.809 2.001 -16.955) 17.302 9.913 ( 3.145 2.131 16.808) 17.232 10.964 ( -9.594 2.926 -9.361) 13.720 14.216 ( -6.880 9.074 -2.042) 11.569 14.420 ( 2.048 13.603 -7.865) 15.846 15.611 ( 3.847 -1.469 3.323) 5.292 15.727 ( -5.283 4.334 0.023) 6.833 16.974 ( 1.761 1.333 6.698) 7.053 17.322 ( 3.607 0.245 -1.451) 3.895 17.912 ( 6.504 -4.156 2.025) 7.980 18.119 ( -4.220 -4.008 -5.383) 7.927 ======================= Grid point 438 (223/306) ======================= q-point: (-0.10 0.20 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.069 ( -1.327 1.156 7.115) 7.330 1.255 ( 1.153 -1.833 0.896) 2.344 1.423 ( -4.061 6.625 7.409) 10.736 1.789 ( -11.246 2.784 -5.471) 12.812 1.859 ( 7.798 -2.649 -4.436) 9.354 1.948 ( 13.146 6.771 0.736) 14.806 2.345 ( 5.272 3.766 2.060) 6.799 2.466 ( -1.730 0.843 -6.171) 6.465 2.813 ( -3.960 -1.153 -0.144) 4.126 2.855 ( 0.585 -0.442 2.627) 2.727 2.991 ( -1.741 -1.831 0.560) 2.588 3.123 ( 2.629 0.111 -1.756) 3.164 3.423 ( -0.510 0.931 2.811) 3.005 3.497 ( -1.529 -0.872 -0.527) 1.838 3.900 ( -0.730 2.117 0.101) 2.242 3.950 ( 1.036 4.754 -1.182) 5.008 5.712 ( -9.610 -12.010 2.202) 15.538 6.007 ( 5.596 -6.941 -3.619) 9.622 8.315 ( -5.201 1.947 16.518) 17.427 9.358 ( 7.646 -1.012 -23.634) 24.861 10.083 ( -3.268 2.746 19.645) 20.103 10.735 ( -1.701 5.349 -8.344) 10.056 14.050 ( -1.528 6.766 -0.273) 6.941 14.238 ( 5.694 11.789 -4.832) 13.955 15.589 ( -5.584 3.753 0.509) 6.747 15.731 ( 6.436 -0.285 1.521) 6.620 17.051 ( 0.622 0.449 6.364) 6.410 17.338 ( 2.847 -0.552 -4.081) 5.007 18.027 ( -0.953 -3.411 -1.955) 4.046 18.060 ( 0.025 -2.494 -1.763) 3.054 ======================= Grid point 442 (224/306) ======================= q-point: ( 0.30 0.30 -0.64) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 305 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.147 ( -0.183 0.000 0.043) 0.188 1.187 ( 5.026 -0.000 -0.926) 5.110 1.503 ( -3.572 0.000 0.417) 3.596 1.813 ( 6.339 -0.000 -8.889) 10.918 1.994 ( 3.495 -0.000 -0.332) 3.511 2.124 ( 17.262 -0.000 1.496) 17.327 2.394 ( 0.687 -0.000 -0.426) 0.809 2.687 ( 1.382 -0.000 1.781) 2.254 2.718 ( -2.186 0.000 0.428) 2.228 2.974 ( -0.935 0.000 -0.361) 1.002 3.041 ( -0.021 0.000 -0.499) 0.500 3.198 ( 0.528 -0.000 0.967) 1.102 3.321 ( -4.380 0.000 1.241) 4.552 3.418 ( 0.536 -0.000 5.686) 5.711 3.975 ( 3.083 -0.000 0.671) 3.155 4.381 ( 7.933 -0.000 1.195) 8.023 5.292 ( -17.584 0.000 -2.306) 17.735 5.300 ( -10.748 0.000 -1.444) 10.845 8.730 ( 9.393 -0.000 -7.096) 11.772 9.458 ( 5.255 -0.000 1.481) 5.459 9.682 ( -7.310 0.000 5.650) 9.239 11.457 ( -0.479 0.000 5.808) 5.828 14.814 ( 9.788 -0.000 9.143) 13.394 14.920 ( 12.221 -0.000 8.074) 14.647 15.537 ( -8.299 0.000 -5.609) 10.017 15.701 ( 7.813 -0.000 -6.971) 10.471 16.871 ( 0.485 -0.000 -3.782) 3.813 17.221 ( 5.278 -0.000 -6.926) 8.708 17.899 ( 0.708 -0.000 2.204) 2.315 17.907 ( -9.557 0.000 2.515) 9.882 ======================= Grid point 443 (225/306) ======================= q-point: ( 0.40 0.30 -0.64) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.162 ( 0.891 0.541 2.635) 2.833 1.256 ( 4.434 0.093 1.694) 4.748 1.483 ( -0.099 0.894 2.300) 2.469 1.758 ( 4.601 4.163 -8.114) 10.214 2.024 ( 5.305 2.693 -0.344) 5.959 2.298 ( 8.261 2.530 -0.158) 8.641 2.437 ( 3.165 -4.079 -0.084) 5.164 2.687 ( -1.258 0.669 -0.021) 1.425 2.729 ( 0.601 -1.305 1.179) 1.859 2.968 ( -0.268 -0.674 0.203) 0.753 3.041 ( -0.077 -0.504 -0.102) 0.520 3.178 ( -3.401 0.619 0.232) 3.465 3.284 ( -4.518 -0.431 1.485) 4.775 3.482 ( 1.594 -0.413 1.426) 2.179 4.035 ( 5.563 -0.364 -0.059) 5.575 4.459 ( 3.795 3.440 1.066) 5.232 4.981 ( -10.496 7.094 0.162) 12.670 5.281 ( -11.431 -11.895 -0.137) 16.498 8.767 ( 9.969 5.717 -3.975) 12.160 9.366 ( 3.827 -3.467 -18.723) 19.422 9.820 ( -6.686 1.839 25.665) 26.585 11.450 ( -5.137 -1.208 -1.812) 5.579 14.972 ( 5.074 5.170 7.377) 10.339 15.155 ( 4.973 -4.880 6.598) 9.596 15.385 ( -2.917 4.106 -3.561) 6.168 15.676 ( 4.578 -1.000 -10.312) 11.327 16.888 ( 6.408 2.821 0.854) 7.054 17.242 ( 5.661 -4.971 -5.973) 9.615 17.753 ( -8.494 7.178 2.555) 11.411 17.973 ( -1.924 -6.001 1.044) 6.387 ======================= Grid point 444 (226/306) ======================= q-point: ( 0.50 0.30 -0.64) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.205 ( 0.307 0.595 3.988) 4.044 1.318 ( 3.392 3.035 5.196) 6.908 1.540 ( 5.073 0.166 2.788) 5.791 1.655 ( 3.353 6.838 -7.093) 10.407 2.052 ( 6.272 3.287 -1.196) 7.181 2.315 ( 2.706 3.185 -0.349) 4.193 2.490 ( 1.010 -0.385 -1.427) 1.790 2.666 ( -0.951 0.248 -0.390) 1.058 2.768 ( 0.234 -1.823 1.029) 2.106 2.975 ( -2.926 -0.875 1.094) 3.244 3.036 ( -1.176 0.654 -0.544) 1.451 3.120 ( -4.807 -0.854 -0.860) 4.957 3.264 ( -1.644 -1.141 1.432) 2.461 3.476 ( -1.129 0.497 -2.753) 3.017 4.106 ( 6.511 1.850 -0.288) 6.775 4.377 ( -4.217 8.613 1.974) 9.791 4.959 ( 4.470 -5.762 2.356) 7.663 5.296 ( -10.694 -11.454 1.276) 15.722 8.696 ( 6.224 12.115 -6.774) 15.212 9.369 ( 7.856 -8.999 -7.779) 14.255 9.932 ( -8.438 5.227 18.579) 21.064 11.338 ( -7.707 -2.218 -6.880) 10.566 14.933 ( -4.972 8.498 1.249) 9.925 15.230 ( 1.294 7.714 -3.845) 8.715 15.316 ( -0.605 -1.655 3.953) 4.328 15.701 ( 6.652 -5.439 -4.425) 9.665 16.946 ( 8.671 6.007 2.010) 10.739 17.368 ( 7.749 -8.412 -1.831) 11.583 17.582 ( -8.326 7.320 2.200) 11.303 18.017 ( -3.299 -6.202 -0.965) 7.091 ======================= Grid point 445 (227/306) ======================= q-point: (-0.40 0.30 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.219 ( -1.964 2.423 3.925) 5.013 1.406 ( 3.808 2.431 8.254) 9.410 1.522 ( 1.579 8.039 -5.469) 9.850 1.641 ( 7.785 1.370 1.829) 8.113 2.069 ( 7.476 4.457 -2.588) 9.080 2.285 ( -1.100 2.767 -1.108) 3.177 2.464 ( -0.944 2.718 0.171) 2.882 2.634 ( -0.295 2.030 -2.095) 2.932 2.785 ( -1.815 -0.389 0.196) 1.867 2.911 ( -7.913 -3.770 -2.721) 9.178 2.977 ( -2.453 3.041 0.100) 3.908 3.098 ( -0.745 -1.887 -0.736) 2.158 3.307 ( 0.758 -2.683 1.753) 3.294 3.417 ( -2.237 -0.297 -1.930) 2.969 4.120 ( 2.258 6.126 1.678) 6.741 4.278 ( -0.053 5.948 1.329) 6.095 5.193 ( 7.626 -13.059 1.655) 15.212 5.325 ( -7.988 -10.071 2.000) 13.009 8.536 ( 3.227 12.215 -3.228) 13.040 9.537 ( 10.012 -10.012 -8.514) 16.522 9.904 ( -9.441 8.827 15.877) 20.472 11.180 ( -8.358 -2.112 -8.283) 11.956 14.721 ( -8.975 10.393 -0.715) 13.750 15.027 ( 2.937 14.265 -9.111) 17.180 15.412 ( -1.943 -5.026 6.546) 8.479 15.803 ( 3.845 -2.927 -1.309) 5.006 17.001 ( 7.462 5.865 3.162) 10.004 17.431 ( -5.153 5.495 0.974) 7.596 17.576 ( 9.278 -7.552 1.242) 12.028 18.021 ( -5.075 -6.428 -3.014) 8.727 ======================= Grid point 446 (228/306) ======================= q-point: (-0.30 0.30 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.192 ( -2.653 4.235 3.935) 6.360 1.377 ( -0.346 7.469 -2.868) 8.008 1.510 ( 0.007 0.596 7.009) 7.035 1.736 ( 8.764 2.351 1.020) 9.131 2.071 ( 6.352 6.593 -2.136) 9.401 2.163 ( -6.459 4.441 -3.194) 8.465 2.419 ( 0.337 3.712 0.894) 3.833 2.572 ( 1.406 1.963 -4.497) 5.104 2.765 ( -1.640 -1.886 0.140) 2.504 2.862 ( -3.948 -3.330 -3.156) 6.053 2.935 ( -1.313 1.216 2.464) 3.045 3.104 ( 0.339 -1.422 -1.697) 2.240 3.365 ( 0.462 -2.096 1.745) 2.766 3.404 ( -1.503 -2.708 0.260) 3.108 4.069 ( -0.995 6.716 2.826) 7.354 4.220 ( 2.125 7.116 -0.973) 7.490 5.335 ( -12.998 -13.831 3.414) 19.284 5.521 ( 13.029 -11.577 -1.039) 17.460 8.434 ( 0.797 9.924 5.311) 11.283 9.532 ( 4.324 -2.293 -21.915) 22.454 9.965 ( -3.979 2.642 23.001) 23.491 11.004 ( -6.283 0.386 -8.659) 10.705 14.472 ( -7.914 11.287 -0.084) 13.785 14.785 ( 4.144 15.361 -8.902) 18.231 15.529 ( -0.620 -4.985 6.325) 8.077 15.810 ( -1.686 1.761 -1.288) 2.757 17.054 ( 4.476 4.971 5.048) 8.380 17.353 ( 0.572 2.217 -1.515) 2.745 17.791 ( 8.607 -5.582 2.202) 10.492 17.986 ( -6.497 -6.474 -4.549) 10.238 ======================= Grid point 447 (229/306) ======================= q-point: (-0.20 0.30 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.143 ( -2.597 4.398 3.897) 6.425 1.277 ( -0.833 3.561 -1.202) 3.850 1.538 ( -3.919 2.344 6.197) 7.697 1.817 ( 5.957 -0.413 -2.538) 6.488 1.880 ( -11.661 5.376 -3.399) 13.283 2.134 ( 11.652 6.896 -1.376) 13.609 2.412 ( 2.121 1.833 0.602) 2.867 2.520 ( 3.020 3.488 -4.620) 6.529 2.775 ( -2.877 -1.923 -0.201) 3.466 2.841 ( 0.764 -1.694 -0.145) 1.864 2.952 ( -1.021 -0.308 3.109) 3.287 3.110 ( 2.110 -1.142 -2.087) 3.180 3.410 ( -0.755 -2.287 1.710) 2.953 3.435 ( -0.673 -2.962 0.766) 3.133 3.999 ( -1.869 5.916 2.143) 6.564 4.129 ( 1.794 8.657 -1.713) 9.006 5.382 ( -12.971 -14.037 3.367) 19.407 5.788 ( 10.334 -10.438 -2.746) 14.942 8.425 ( -2.334 6.939 13.252) 15.140 9.342 ( 6.075 -0.383 -24.155) 24.911 10.121 ( -9.043 0.109 19.315) 21.327 10.853 ( 2.111 3.878 -6.874) 8.170 14.267 ( -4.118 10.465 1.610) 11.360 14.575 ( 6.644 15.031 -6.559) 17.695 15.649 ( -0.307 -3.415 4.808) 5.905 15.715 ( -3.585 3.078 -0.955) 4.821 17.101 ( 2.264 3.448 5.235) 6.665 17.340 ( 4.059 0.904 -3.678) 5.552 17.911 ( -6.394 -5.903 -3.902) 9.537 17.977 ( 5.222 -4.131 0.628) 6.688 ======================= Grid point 448 (230/306) ======================= q-point: (-0.10 0.30 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.128 ( -1.565 1.374 4.376) 4.847 1.242 ( -0.625 -1.232 -0.414) 1.442 1.508 ( -3.942 4.059 4.807) 7.425 1.631 ( -8.657 2.817 -5.630) 10.704 1.863 ( 5.500 -0.631 -5.853) 8.057 2.194 ( 8.724 4.124 1.132) 9.716 2.398 ( 0.297 3.070 -2.999) 4.302 2.482 ( 5.593 3.955 -1.034) 6.928 2.749 ( -3.384 -0.937 0.670) 3.575 2.893 ( 2.462 -0.451 1.496) 2.916 2.973 ( -0.940 -0.516 2.241) 2.484 3.148 ( 4.099 -0.540 -0.689) 4.192 3.426 ( -3.071 -2.235 0.078) 3.799 3.470 ( -0.182 -0.789 1.857) 2.026 3.936 ( -1.011 3.952 1.437) 4.325 4.037 ( 2.709 7.316 -0.783) 7.840 5.426 ( -13.077 -14.095 2.178) 19.350 5.957 ( 5.159 -6.199 -3.314) 8.719 8.483 ( -4.567 3.216 16.059) 17.003 9.191 ( 9.187 -0.139 -21.254) 23.155 10.126 ( -14.295 -1.628 7.715) 16.325 10.850 ( 11.039 6.768 2.808) 13.249 14.160 ( 1.049 8.100 3.731) 8.979 14.451 ( 9.951 13.065 -2.877) 16.673 15.579 ( -3.939 3.971 -0.470) 5.613 15.777 ( 1.242 -4.210 2.399) 5.002 17.137 ( 1.337 1.343 2.406) 3.063 17.331 ( 4.261 2.358 -4.227) 6.448 17.844 ( -7.680 -6.197 -4.291) 10.761 18.083 ( 3.066 -1.878 1.125) 3.767 ======================= Grid point 453 (231/306) ======================= q-point: ( 0.40 0.40 -0.64) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.215 ( 0.545 -0.000 4.208) 4.243 1.350 ( 4.782 -0.000 3.839) 6.132 1.548 ( 4.151 -0.000 4.406) 6.053 1.741 ( 3.256 -0.000 -8.072) 8.704 2.092 ( 4.013 -0.000 -0.345) 4.028 2.418 ( 0.964 -0.000 0.407) 1.046 2.425 ( 6.881 -0.000 -2.754) 7.411 2.670 ( -1.118 0.000 -0.065) 1.120 2.734 ( 0.107 -0.000 0.112) 0.154 2.963 ( -2.259 0.000 1.683) 2.817 3.037 ( 0.029 -0.000 -0.009) 0.030 3.118 ( -5.059 0.000 -1.409) 5.252 3.251 ( -4.130 0.000 2.539) 4.848 3.483 ( -0.176 0.000 -2.821) 2.826 4.125 ( 9.885 -0.000 -0.993) 9.935 4.535 ( 1.386 -0.000 0.251) 1.409 4.878 ( -15.033 0.000 5.004) 15.844 5.118 ( -2.087 0.000 0.340) 2.115 8.926 ( 10.366 -0.000 -0.310) 10.371 9.177 ( 5.175 -0.000 -17.964) 18.694 10.005 ( -9.915 0.000 23.416) 25.429 11.307 ( -7.251 0.000 -7.768) 10.626 15.105 ( -6.628 0.000 -0.766) 6.672 15.157 ( 1.397 -0.000 8.872) 8.982 15.483 ( 8.853 -0.000 3.322) 9.455 15.550 ( 0.914 -0.000 -13.801) 13.832 17.073 ( 12.484 -0.000 4.860) 13.397 17.211 ( 6.036 -0.000 -5.313) 8.041 17.702 ( -10.213 0.000 1.444) 10.315 17.910 ( -3.267 0.000 0.166) 3.271 ======================= Grid point 454 (232/306) ======================= q-point: ( 0.50 0.40 -0.64) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.258 ( -1.059 0.731 4.663) 4.838 1.450 ( 3.547 0.864 5.875) 6.916 1.662 ( 2.542 3.015 -2.096) 4.466 1.678 ( 6.914 1.327 -0.571) 7.064 2.131 ( 4.053 0.605 -0.427) 4.120 2.383 ( 1.113 4.480 -1.475) 4.846 2.468 ( 1.289 -1.814 -2.933) 3.681 2.671 ( 1.165 0.706 0.516) 1.456 2.740 ( -0.663 -2.151 -0.693) 2.355 2.885 ( -11.462 0.671 -1.527) 11.583 3.033 ( -0.298 1.162 -0.052) 1.201 3.065 ( -0.957 -0.608 -0.498) 1.238 3.246 ( -2.529 -1.561 2.867) 4.129 3.427 ( -1.583 0.484 -3.471) 3.845 4.238 ( 11.292 2.512 -1.303) 11.641 4.452 ( -4.589 7.778 1.124) 9.101 4.877 ( -7.378 -10.966 6.113) 14.562 5.153 ( 1.927 -3.615 0.626) 4.144 8.875 ( 6.244 14.613 -5.170) 16.711 9.241 ( 8.843 -13.637 -8.570) 18.374 10.069 ( -13.225 3.867 19.122) 23.570 11.130 ( -5.893 -1.369 -9.808) 11.524 14.954 ( -7.719 7.382 0.129) 10.682 15.273 ( -5.222 -5.306 7.507) 10.572 15.347 ( 4.812 10.321 -10.120) 15.234 15.680 ( 7.522 -6.253 -0.465) 9.793 17.171 ( 9.334 7.580 0.829) 12.053 17.379 ( 11.392 -8.091 1.932) 14.106 17.561 ( -8.718 4.123 0.487) 9.656 17.875 ( -6.476 -4.499 -1.478) 8.022 ======================= Grid point 455 (233/306) ======================= q-point: (-0.40 0.40 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 552 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.271 ( -2.353 1.942 4.663) 5.572 1.537 ( 1.078 1.513 6.719) 6.971 1.546 ( -1.049 5.495 -5.203) 7.640 1.783 ( 7.052 1.830 0.883) 7.338 2.180 ( 6.283 1.044 0.079) 6.369 2.287 ( -4.506 6.126 -1.970) 7.856 2.469 ( 0.346 -0.327 -1.068) 1.169 2.638 ( -2.709 2.716 -4.173) 5.668 2.730 ( -4.559 -1.050 -0.301) 4.688 2.753 ( -1.099 -3.169 -1.028) 3.508 3.000 ( -0.953 2.751 0.794) 3.018 3.072 ( 0.695 -0.991 -0.886) 1.500 3.284 ( -1.707 -3.315 2.474) 4.475 3.384 ( -0.287 0.080 -1.065) 1.106 4.253 ( 0.371 7.877 1.238) 7.983 4.366 ( 3.703 4.403 -0.592) 5.784 4.997 ( -9.825 -12.828 5.359) 17.024 5.282 ( 8.974 -7.253 -0.739) 11.562 8.729 ( 3.490 13.484 0.257) 13.930 9.379 ( 7.229 -9.779 -14.740) 19.109 10.048 ( -13.812 3.482 19.506) 24.153 10.994 ( -2.200 -0.877 -8.389) 8.717 14.750 ( -8.006 10.651 1.492) 13.408 15.134 ( 3.696 11.291 -9.517) 15.222 15.388 ( -3.535 -5.214 7.845) 10.061 15.796 ( 3.989 -2.771 -2.266) 5.360 17.204 ( 6.445 6.754 2.850) 9.761 17.423 ( -3.852 3.054 -1.435) 5.121 17.643 ( 11.488 -6.152 2.651) 13.299 17.821 ( -8.736 -6.272 -3.054) 11.180 ======================= Grid point 456 (234/306) ======================= q-point: (-0.30 -0.60 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.251 ( -3.178 3.517 3.848) 6.105 1.402 ( -2.706 5.747 -3.064) 7.053 1.576 ( -2.640 1.805 5.805) 6.628 1.817 ( 2.403 0.271 -3.285) 4.080 2.059 ( -10.966 8.461 -2.417) 14.060 2.252 ( 7.204 2.485 -0.188) 7.623 2.442 ( -1.244 0.561 -0.688) 1.529 2.609 ( 7.492 1.830 -2.286) 8.044 2.720 ( -2.171 -1.983 0.589) 2.999 2.772 ( 0.361 -2.391 -0.443) 2.458 2.981 ( 0.377 1.823 2.139) 2.835 3.080 ( 1.447 -0.730 -1.774) 2.402 3.325 ( -2.315 -3.612 1.443) 4.526 3.393 ( 0.983 -0.848 0.549) 1.409 4.153 ( -3.938 5.854 1.554) 7.224 4.342 ( 5.321 8.109 -1.650) 9.838 5.060 ( -12.255 -11.278 5.116) 17.423 5.517 ( 11.766 -10.994 -2.479) 16.293 8.639 ( -1.419 9.770 6.588) 11.869 9.323 ( 6.729 -1.687 -20.927) 22.047 10.095 ( -14.712 -1.778 20.306) 25.138 10.919 ( 4.366 1.468 -6.049) 7.603 14.545 ( -6.223 11.668 3.289) 13.627 14.945 ( 6.665 13.961 -7.898) 17.370 15.501 ( -4.265 -7.032 7.659) 11.238 15.792 ( -0.608 1.653 -3.274) 3.718 17.201 ( -0.533 4.434 2.520) 5.128 17.388 ( 6.633 2.793 -1.933) 7.452 17.747 ( -9.875 -7.030 -3.926) 12.742 17.865 ( 8.862 -4.790 1.863) 10.244 ======================= Grid point 457 (235/306) ======================= q-point: (-0.20 -0.60 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 552 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.192 ( -4.143 3.156 2.435) 5.749 1.289 ( -2.900 4.564 0.058) 5.408 1.565 ( -4.641 0.904 3.859) 6.103 1.700 ( -9.488 2.460 -6.005) 11.495 1.892 ( 1.996 3.983 -2.506) 5.112 2.276 ( 3.866 2.508 -1.800) 4.947 2.432 ( 0.100 -0.336 -0.345) 0.492 2.619 ( 4.869 5.218 -2.412) 7.533 2.746 ( 1.700 1.112 1.821) 2.728 2.837 ( 2.401 -3.777 2.303) 5.033 3.002 ( 1.265 1.941 2.470) 3.386 3.107 ( 3.903 -2.235 -1.163) 4.646 3.343 ( -3.605 -3.637 0.202) 5.125 3.431 ( 1.009 -1.632 1.000) 2.164 4.055 ( -3.652 4.564 1.214) 5.970 4.265 ( 4.374 10.469 -1.541) 11.451 5.097 ( -12.705 -11.656 4.227) 17.753 5.753 ( 9.618 -9.978 -3.384) 14.266 8.583 ( -5.839 4.300 6.717) 9.885 9.211 ( 10.083 1.993 -15.624) 18.702 10.096 ( -17.747 -0.991 12.096) 21.500 10.961 ( 11.072 2.216 0.653) 11.310 14.396 ( -2.708 10.642 5.256) 12.174 14.795 ( 9.231 14.269 -5.029) 17.723 15.616 ( -4.354 -7.506 6.019) 10.560 15.692 ( -3.222 3.836 -2.870) 5.774 17.160 ( -1.451 0.567 -1.720) 2.321 17.434 ( 9.750 5.437 -0.593) 11.179 17.669 ( -9.966 -7.733 -4.062) 13.253 18.019 ( 5.227 -3.187 1.293) 6.257 ======================= Grid point 458 (236/306) ======================= q-point: (-0.10 -0.60 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.161 ( -2.946 -0.071 3.540) 4.606 1.203 ( -3.643 1.583 -0.486) 4.001 1.487 ( -4.047 2.926 -4.538) 6.748 1.565 ( -2.574 -0.489 0.413) 2.652 1.851 ( 1.237 1.402 -4.254) 4.647 2.259 ( 1.428 1.693 -2.448) 3.301 2.434 ( 1.071 0.664 -0.103) 1.264 2.587 ( 2.944 3.885 -0.932) 4.963 2.762 ( 1.948 2.782 1.776) 3.833 2.935 ( 2.372 -1.959 2.716) 4.103 3.006 ( 1.410 2.662 1.175) 3.234 3.195 ( 4.924 -1.157 0.599) 5.093 3.329 ( -5.017 -3.733 -0.707) 6.293 3.475 ( 0.271 -1.765 1.425) 2.284 3.986 ( -1.693 3.445 1.557) 4.143 4.184 ( 5.397 9.607 -0.631) 11.037 5.120 ( -13.070 -11.973 2.260) 17.868 5.908 ( 4.754 -5.930 -3.280) 8.278 8.538 ( -4.302 -1.219 0.642) 4.518 9.196 ( 9.263 3.412 -3.576) 10.499 9.968 ( -14.534 0.474 2.680) 14.787 11.124 ( 11.776 2.925 7.023) 14.020 14.339 ( 1.474 8.007 6.960) 10.711 14.726 ( 11.870 12.402 -1.085) 17.201 15.574 ( -2.480 3.571 -1.853) 4.727 15.704 ( -5.579 -7.593 2.819) 9.835 17.111 ( -1.035 -1.480 -5.749) 6.026 17.462 ( 8.908 7.908 -0.805) 11.939 17.611 ( -8.665 -8.209 -2.892) 12.281 18.104 ( 1.694 -1.575 1.304) 2.655 ======================= Grid point 464 (237/306) ======================= q-point: (-0.50 -0.50 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 305 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.292 ( -2.877 0.000 5.177) 5.923 1.558 ( 2.296 -0.000 6.274) 6.681 1.621 ( -0.916 0.000 -5.805) 5.877 1.814 ( 5.728 -0.000 2.018) 6.074 2.181 ( 4.194 -0.000 0.737) 4.258 2.407 ( 0.858 -0.000 -6.036) 6.097 2.419 ( -0.415 0.000 1.265) 1.331 2.656 ( -10.945 0.000 -4.533) 11.847 2.721 ( 4.130 -0.000 0.726) 4.194 2.734 ( -5.193 0.000 -0.233) 5.198 3.047 ( -1.540 0.000 0.202) 1.553 3.054 ( 1.922 -0.000 -0.008) 1.922 3.235 ( -2.622 0.000 3.205) 4.141 3.387 ( -0.218 0.000 -1.761) 1.774 4.396 ( 12.705 -0.000 -1.662) 12.814 4.417 ( -7.607 0.000 -2.723) 8.079 4.794 ( -6.751 0.000 10.025) 12.086 5.188 ( 6.053 -0.000 -0.809) 6.107 9.037 ( -0.583 0.000 -5.059) 5.092 9.115 ( 12.742 -0.000 -7.438) 14.754 10.098 ( -17.765 0.000 17.277) 24.781 10.979 ( -0.026 0.000 -8.525) 8.525 14.922 ( -6.918 0.000 1.397) 7.057 15.200 ( -7.717 0.000 2.680) 8.169 15.393 ( 4.724 -0.000 -4.346) 6.419 15.730 ( 7.364 -0.000 -1.728) 7.564 17.330 ( 8.180 -0.000 0.144) 8.181 17.454 ( -6.239 0.000 0.382) 6.251 17.548 ( 11.523 -0.000 2.865) 11.873 17.726 ( -9.143 0.000 -2.338) 9.437 ======================= Grid point 465 (238/306) ======================= q-point: (-0.40 -0.50 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.300 ( -4.470 0.710 5.309) 6.976 1.517 ( -3.654 2.760 -4.419) 6.364 1.630 ( -0.663 1.752 5.722) 6.021 1.829 ( -0.910 0.544 -2.948) 3.132 2.239 ( -0.690 3.091 -0.910) 3.295 2.290 ( -0.834 3.215 -2.371) 4.080 2.449 ( -3.639 0.534 -1.360) 3.922 2.528 ( 0.795 -5.634 1.710) 5.941 2.705 ( -1.570 -0.367 -0.479) 1.682 2.775 ( 4.844 1.265 0.103) 5.007 3.018 ( -1.506 1.084 0.250) 1.872 3.083 ( 2.662 0.394 -0.208) 2.699 3.252 ( -2.327 -1.916 2.778) 4.099 3.384 ( 1.463 -0.027 -0.482) 1.541 4.261 ( -8.204 2.470 -2.236) 8.854 4.497 ( 9.001 3.699 -1.110) 9.794 4.865 ( -4.963 -3.932 7.971) 10.180 5.292 ( 8.780 -5.877 -2.759) 10.920 8.862 ( -5.205 6.796 -4.439) 9.643 9.252 ( 12.652 -3.309 -9.712) 16.290 10.058 ( -19.197 -0.878 19.254) 27.203 10.936 ( 5.083 0.166 -5.830) 7.736 14.809 ( -6.791 8.316 3.937) 11.436 15.155 ( -1.094 0.166 -2.045) 2.325 15.394 ( -0.776 0.919 2.613) 2.877 15.784 ( 4.597 -1.538 -4.930) 6.914 17.313 ( -6.074 4.139 -0.761) 7.389 17.444 ( 7.081 0.542 0.924) 7.162 17.600 ( -9.558 -3.551 -3.189) 10.683 17.760 ( 11.622 -3.014 2.242) 12.214 ======================= Grid point 466 (239/306) ======================= q-point: (-0.30 -0.50 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.268 ( -6.487 2.517 3.520) 7.798 1.390 ( -4.986 2.649 -0.671) 5.686 1.611 ( -4.254 3.188 2.421) 5.841 1.734 ( -6.614 0.451 -5.194) 8.422 2.054 ( -3.884 8.142 -1.113) 9.089 2.315 ( 2.942 0.447 -1.812) 3.484 2.400 ( -1.869 -1.777 -0.988) 2.761 2.678 ( -0.628 0.576 -1.131) 1.416 2.704 ( 4.459 -5.765 5.012) 8.845 2.819 ( 5.721 2.690 1.009) 6.402 3.009 ( 0.060 -0.691 1.217) 1.401 3.100 ( 2.383 0.759 -1.074) 2.722 3.272 ( -2.414 -1.627 1.802) 3.424 3.407 ( 2.120 -0.382 -0.087) 2.156 4.126 ( -6.746 1.071 -1.232) 6.940 4.507 ( 6.360 7.674 -1.412) 10.067 4.907 ( -6.787 -2.583 5.960) 9.395 5.488 ( 10.793 -10.797 -3.799) 15.732 8.671 ( -8.906 2.580 -3.249) 9.824 9.277 ( 10.594 2.708 -11.072) 15.561 10.079 ( -16.213 -0.292 21.066) 26.585 10.972 ( 8.577 -0.822 -3.016) 9.129 14.665 ( -5.607 10.648 6.274) 13.572 15.099 ( 6.463 8.030 -4.931) 11.426 15.428 ( -6.621 -5.503 6.663) 10.887 15.761 ( 0.783 1.087 -5.767) 5.920 17.182 ( -5.086 1.576 -3.180) 6.202 17.473 ( -10.030 -6.851 -3.107) 12.538 17.570 ( 9.761 4.157 1.146) 10.671 17.938 ( 7.725 -3.059 1.055) 8.375 ======================= Grid point 467 (240/306) ======================= q-point: (-0.20 -0.50 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.164 ( -8.565 1.928 2.402) 9.102 1.317 ( -4.380 3.601 2.037) 6.025 1.508 ( -7.967 0.731 -1.922) 8.228 1.588 ( -3.437 2.046 -3.360) 5.224 1.940 ( -0.451 5.683 -1.529) 5.903 2.300 ( 1.518 1.329 -2.884) 3.519 2.409 ( -0.830 -2.088 0.279) 2.264 2.648 ( -0.407 1.351 -0.164) 1.420 2.809 ( 0.145 -2.186 0.017) 2.191 2.897 ( 4.377 1.165 4.645) 6.487 3.059 ( 1.034 -0.171 1.301) 1.670 3.130 ( 4.268 -3.144 0.081) 5.301 3.266 ( -1.994 -0.064 0.566) 2.073 3.440 ( 1.827 -0.717 0.265) 1.980 4.042 ( -3.979 0.646 -0.042) 4.032 4.448 ( 5.778 10.252 -1.982) 11.934 4.907 ( -8.113 -3.829 4.189) 9.901 5.706 ( 9.040 -10.115 -3.740) 14.072 8.520 ( -6.920 -0.224 -3.201) 7.628 9.247 ( 5.169 0.516 -7.173) 8.857 10.069 ( -11.271 7.478 15.206) 20.352 11.117 ( 10.365 -3.408 2.766) 11.256 14.560 ( -3.241 9.629 7.843) 12.835 15.029 ( 9.736 11.320 -3.297) 15.290 15.492 ( -9.053 -8.789 5.539) 13.780 15.666 ( -1.685 3.240 -4.628) 5.895 17.078 ( -3.189 -0.923 -5.996) 6.854 17.399 ( -10.578 -8.495 -2.920) 13.878 17.653 ( 11.623 6.807 0.315) 13.474 18.051 ( 3.587 -2.508 0.827) 4.455 ======================= Grid point 468 (241/306) ======================= q-point: (-0.10 -0.50 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.101 ( -7.478 -2.786 3.711) 8.801 1.207 ( -3.884 5.121 -0.628) 6.458 1.428 ( -3.201 -3.226 -2.833) 5.355 1.514 ( -0.877 1.845 -1.988) 2.851 1.847 ( -1.609 3.621 -2.190) 4.527 2.266 ( 1.013 1.678 -2.929) 3.524 2.429 ( -0.782 -1.888 0.743) 2.174 2.638 ( 0.832 1.640 1.286) 2.244 2.817 ( -0.319 -0.156 -0.336) 0.489 2.965 ( 0.244 -0.647 2.983) 3.062 3.057 ( -0.703 -0.510 -0.726) 1.132 3.197 ( -1.110 -0.152 -0.388) 1.186 3.294 ( 4.615 -0.879 2.472) 5.309 3.474 ( 0.611 -1.032 0.860) 1.475 4.006 ( -1.503 0.796 0.991) 1.969 4.375 ( 6.280 9.541 -1.918) 11.582 4.895 ( -7.739 -4.657 2.097) 9.272 5.857 ( 4.484 -6.000 -2.890) 8.029 8.442 ( -1.775 -2.109 -3.799) 4.694 9.248 ( -0.310 -4.450 -2.427) 5.079 9.962 ( -6.175 12.183 8.591) 16.135 11.337 ( 9.757 -2.095 6.230) 11.764 14.525 ( -0.543 6.634 8.430) 10.741 15.012 ( 11.679 10.128 0.653) 15.473 15.520 ( -10.928 -8.087 1.772) 13.710 15.565 ( -1.306 1.756 -2.888) 3.623 16.987 ( -1.994 -2.153 -8.445) 8.941 17.366 ( -8.984 -9.391 -0.851) 13.024 17.678 ( 9.392 9.060 -2.152) 13.226 18.119 ( 1.561 -1.636 1.528) 2.729 ======================= Grid point 475 (242/306) ======================= q-point: (-0.40 -0.40 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.298 ( -6.453 0.000 6.060) 8.852 1.423 ( -7.365 0.000 -3.056) 7.974 1.667 ( -3.297 0.000 2.563) 4.175 1.734 ( -6.222 0.000 -5.087) 8.037 2.206 ( -4.597 0.000 -2.471) 5.219 2.292 ( 1.312 -0.000 0.488) 1.400 2.375 ( -2.115 0.000 -2.631) 3.376 2.608 ( 5.168 -0.000 5.909) 7.850 2.685 ( -1.003 0.000 -0.210) 1.025 2.854 ( 5.808 -0.000 1.548) 6.011 3.007 ( -1.304 0.000 0.195) 1.319 3.096 ( -1.505 0.000 -0.690) 1.656 3.262 ( 0.957 -0.000 2.965) 3.116 3.404 ( 2.579 -0.000 -0.742) 2.683 4.132 ( -8.222 0.000 -2.591) 8.620 4.593 ( 2.720 -0.000 0.345) 2.742 4.930 ( 3.600 -0.000 5.799) 6.826 5.312 ( 8.656 -0.000 -4.903) 9.948 8.703 ( -10.483 0.000 -7.077) 12.648 9.315 ( 10.236 -0.000 -10.551) 14.700 10.077 ( -13.752 0.000 26.944) 30.251 10.955 ( 6.597 -0.000 -5.388) 8.517 14.843 ( -6.304 0.000 6.243) 8.872 15.121 ( -3.299 0.000 3.186) 4.586 15.415 ( 0.421 -0.000 -0.481) 0.639 15.760 ( 3.891 -0.000 -7.642) 8.575 17.224 ( -6.949 0.000 -3.200) 7.651 17.359 ( -11.956 0.000 -3.090) 12.349 17.630 ( 10.117 -0.000 2.318) 10.379 17.893 ( 9.604 -0.000 0.648) 9.626 ======================= Grid point 476 (243/306) ======================= q-point: (-0.30 -0.40 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.240 ( -9.861 3.572 2.979) 10.903 1.316 ( -8.015 -2.268 2.414) 8.673 1.570 ( -8.183 2.212 -4.621) 9.655 1.625 ( -3.292 0.837 -1.287) 3.633 2.112 ( -1.930 7.022 0.318) 7.290 2.310 ( 0.389 -1.397 -2.448) 2.845 2.345 ( -1.859 -2.108 -0.155) 2.815 2.670 ( -0.536 0.517 -0.064) 0.748 2.709 ( -0.030 -3.478 1.744) 3.891 2.953 ( 3.812 2.389 3.969) 6.000 3.019 ( 2.728 -1.929 2.337) 4.078 3.054 ( -4.172 -2.443 -1.325) 5.012 3.309 ( 2.917 1.812 2.049) 3.999 3.430 ( 2.812 -0.286 -0.918) 2.972 4.033 ( -4.837 -0.666 -1.151) 5.016 4.589 ( -1.493 1.320 -0.288) 2.014 4.989 ( 5.175 8.120 3.093) 10.114 5.439 ( 10.037 -10.006 -4.892) 14.994 8.522 ( -9.269 0.228 -2.116) 9.510 9.236 ( 0.076 -0.715 -12.895) 12.915 10.276 ( -2.670 6.892 28.956) 29.884 10.993 ( 6.189 -4.801 -4.701) 9.135 14.788 ( -6.496 7.590 8.276) 12.973 15.155 ( -0.842 -3.320 2.653) 4.333 15.388 ( -1.808 2.402 0.112) 3.009 15.707 ( 1.466 0.140 -8.000) 8.134 17.084 ( -6.282 1.614 -4.596) 7.950 17.213 ( -11.202 -5.884 -3.479) 13.123 17.774 ( 11.090 2.647 2.118) 11.597 17.999 ( 5.777 -1.296 -0.572) 5.949 ======================= Grid point 477 (244/306) ======================= q-point: (-0.20 -0.40 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 552 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.098 ( -10.970 2.107 3.640) 11.748 1.284 ( -7.933 -1.931 2.989) 8.694 1.382 ( -8.137 2.673 -4.074) 9.484 1.575 ( 0.458 1.849 -1.349) 2.335 1.977 ( -4.805 7.075 -1.075) 8.620 2.287 ( 0.706 -0.327 -4.020) 4.094 2.363 ( -3.062 -3.562 1.426) 4.909 2.664 ( 0.149 0.558 0.886) 1.057 2.743 ( -3.375 -4.150 0.528) 5.375 2.971 ( -0.873 0.530 2.119) 2.353 3.016 ( -2.146 -1.354 -1.319) 2.860 3.165 ( 5.441 -2.451 3.616) 6.978 3.329 ( 3.216 3.057 1.150) 4.584 3.461 ( 2.306 -0.458 -0.276) 2.367 3.997 ( -2.039 -1.077 -0.065) 2.307 4.526 ( -3.065 1.722 -2.306) 4.204 4.963 ( 5.847 10.018 2.067) 11.782 5.648 ( 8.677 -10.585 -3.371) 14.096 8.426 ( -5.115 0.606 1.443) 5.349 9.114 ( -4.342 -5.338 -9.641) 11.844 10.348 ( -0.844 17.992 15.162) 23.544 11.184 ( 8.488 -10.378 4.611) 14.178 14.706 ( -5.860 7.651 8.593) 12.912 15.216 ( 5.201 1.220 1.060) 5.446 15.325 ( -8.331 -1.697 1.156) 8.581 15.622 ( -0.746 1.477 -5.913) 6.140 16.947 ( -4.546 -0.631 -6.668) 8.094 17.144 ( -9.507 -8.204 -1.669) 12.668 17.867 ( 10.084 5.823 -1.043) 11.691 18.065 ( 2.664 -2.297 0.378) 3.538 ======================= Grid point 478 (245/306) ======================= q-point: (-0.10 -0.40 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.017 ( -8.344 -1.447 4.003) 9.367 1.205 ( -7.459 3.326 2.029) 8.415 1.256 ( -7.001 -4.992 -3.189) 9.171 1.558 ( 2.870 3.089 -0.647) 4.266 1.831 ( -5.353 2.578 -0.875) 6.005 2.252 ( 0.454 -0.035 -4.014) 4.040 2.383 ( -3.464 -3.548 1.716) 5.247 2.681 ( 1.086 0.442 1.630) 2.008 2.744 ( -4.586 -3.505 0.180) 5.774 2.970 ( -1.144 -0.460 0.578) 1.362 3.006 ( -0.897 -0.793 0.085) 1.200 3.234 ( 2.524 1.747 -0.555) 3.119 3.382 ( 4.287 -0.026 3.128) 5.307 3.480 ( 0.292 0.090 -0.087) 0.318 3.996 ( -0.842 -1.006 0.427) 1.379 4.425 ( -4.447 1.265 -3.954) 6.084 4.958 ( 9.026 9.368 2.334) 13.217 5.811 ( 4.579 -6.218 -1.709) 7.909 8.398 ( -0.416 0.641 0.341) 0.837 9.069 ( -5.913 -9.337 -3.035) 11.461 10.206 ( -1.764 17.561 5.020) 18.350 11.464 ( 8.299 -5.201 5.889) 11.428 14.652 ( -4.651 4.349 7.307) 9.692 15.233 ( -5.792 0.062 -1.080) 5.892 15.304 ( 2.409 -1.800 3.155) 4.359 15.541 ( -0.477 1.279 -3.298) 3.569 16.839 ( -2.970 -1.923 -7.579) 8.364 17.145 ( -7.611 -9.636 1.274) 12.345 17.842 ( 4.644 7.855 -3.813) 9.890 18.146 ( 4.268 -1.797 1.250) 4.796 ======================= Grid point 486 (246/306) ======================= q-point: (-0.30 -0.30 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 305 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.148 ( -11.680 0.000 1.313) 11.753 1.234 ( -9.835 0.000 4.849) 10.965 1.428 ( -8.790 0.000 -2.584) 9.162 1.596 ( -0.173 0.000 -1.492) 1.502 2.166 ( 0.800 -0.000 -1.152) 1.403 2.188 ( -12.317 0.000 -1.944) 12.470 2.317 ( -0.163 0.000 -0.401) 0.433 2.672 ( 0.180 -0.000 0.170) 0.248 2.682 ( -2.109 0.000 1.512) 2.596 2.979 ( -1.810 0.000 -0.771) 1.968 3.000 ( -0.707 0.000 0.939) 1.176 3.130 ( 6.453 -0.000 5.379) 8.401 3.379 ( 2.295 -0.000 1.688) 2.849 3.448 ( 2.874 -0.000 -1.663) 3.320 3.979 ( -1.841 0.000 -0.419) 1.888 4.534 ( -6.038 0.000 -1.187) 6.154 5.199 ( 10.154 -0.000 2.369) 10.427 5.422 ( 10.137 -0.000 -5.289) 11.434 8.442 ( -6.880 0.000 5.773) 8.981 9.037 ( -5.204 0.000 -13.565) 14.529 10.727 ( 7.494 -0.000 31.830) 32.700 10.904 ( 1.870 -0.000 -10.608) 10.772 14.840 ( -9.125 0.000 8.884) 12.735 15.112 ( -6.688 0.000 4.794) 8.229 15.406 ( 2.801 -0.000 -2.601) 3.822 15.630 ( 0.870 -0.000 -8.407) 8.452 16.979 ( -6.892 0.000 -3.172) 7.586 16.992 ( -9.135 0.000 -4.188) 10.049 17.945 ( 10.108 -0.000 1.870) 10.280 18.029 ( 2.964 -0.000 -2.478) 3.863 ======================= Grid point 487 (247/306) ======================= q-point: (-0.20 -0.30 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.026 ( -10.788 1.159 4.265) 11.658 1.131 ( -11.977 -2.509 -1.238) 12.299 1.320 ( -7.977 2.556 3.693) 9.155 1.594 ( 2.346 0.178 -1.046) 2.575 1.922 ( -16.401 4.061 -0.925) 16.921 2.187 ( -0.903 -4.473 -4.493) 6.404 2.323 ( -0.962 -0.642 1.431) 1.840 2.682 ( 0.457 0.023 1.389) 1.463 2.694 ( -0.243 -0.755 0.879) 1.184 2.967 ( 0.740 0.134 -0.604) 0.965 2.999 ( -0.990 -0.100 0.689) 1.210 3.243 ( 3.750 -0.305 1.761) 4.154 3.404 ( 1.467 1.443 1.938) 2.827 3.471 ( 2.100 -0.947 -1.327) 2.658 3.968 ( -0.529 -0.790 -0.189) 0.969 4.428 ( -7.429 -0.294 -2.863) 7.967 5.251 ( 12.021 12.287 1.327) 17.241 5.600 ( 9.518 -10.078 -1.767) 13.975 8.457 ( -3.461 3.017 9.735) 10.764 8.864 ( -5.853 -6.025 -9.733) 12.856 10.653 ( -0.582 16.132 -5.363) 17.010 11.252 ( 10.113 -10.610 16.096) 21.770 14.768 ( -10.493 4.121 6.760) 13.144 15.082 ( -11.526 -5.583 0.996) 12.846 15.411 ( 6.552 4.178 0.141) 7.772 15.556 ( -0.434 -0.432 -5.703) 5.736 16.826 ( -5.322 1.609 -3.822) 6.747 16.935 ( -7.128 -6.946 -0.160) 9.954 17.988 ( 1.917 3.683 -3.435) 5.389 18.093 ( 6.958 -2.006 0.773) 7.282 ======================= Grid point 488 (248/306) ======================= q-point: (-0.10 -0.30 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.945 ( -9.468 0.104 3.765) 10.190 1.020 ( -11.484 -6.007 0.314) 12.964 1.221 ( -7.363 3.451 4.472) 9.280 1.609 ( 0.500 1.325 -0.725) 1.591 1.746 ( -8.584 -2.484 2.923) 9.402 2.171 ( -0.406 -3.339 -5.069) 6.083 2.331 ( -2.263 -1.089 1.457) 2.903 2.691 ( -0.895 0.644 -0.592) 1.251 2.711 ( 0.896 -0.275 1.875) 2.096 2.977 ( 0.757 0.215 0.983) 1.259 2.993 ( -0.533 -0.172 -0.210) 0.598 3.259 ( 0.776 0.825 -1.763) 2.095 3.452 ( 1.319 -0.767 3.225) 3.568 3.476 ( 0.921 0.435 -2.042) 2.282 3.975 ( -0.387 -1.216 -0.174) 1.288 4.298 ( -7.577 -0.283 -4.067) 8.605 5.287 ( 15.175 12.119 2.293) 19.556 5.793 ( 6.098 -5.517 0.337) 8.230 8.437 ( -1.298 4.899 0.477) 5.091 8.875 ( -4.783 -10.578 4.963) 12.626 10.366 ( -2.654 13.806 -8.123) 16.237 11.560 ( 5.791 -3.379 4.378) 8.007 14.657 ( -9.969 1.288 3.202) 10.550 14.962 ( -14.478 -5.670 -4.651) 16.230 15.466 ( 2.206 1.965 0.224) 2.962 15.546 ( 6.992 0.041 1.845) 7.231 16.729 ( -3.255 0.411 -1.734) 3.711 16.981 ( -4.184 -8.660 3.448) 10.218 17.901 ( -0.573 4.806 -3.335) 5.878 18.203 ( 6.578 -1.425 -0.464) 6.746 ======================= Grid point 497 (249/306) ======================= q-point: (-0.20 -0.20 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.935 ( -14.004 0.000 -0.812) 14.028 0.962 ( -9.289 0.000 6.082) 11.103 1.280 ( -11.118 0.000 4.812) 12.115 1.616 ( 2.963 -0.000 -0.871) 3.088 1.705 ( -18.778 0.000 4.916) 19.410 2.120 ( 1.945 -0.000 -5.654) 5.979 2.325 ( -0.542 0.000 0.391) 0.668 2.709 ( 1.359 -0.000 -0.539) 1.462 2.709 ( 1.299 -0.000 1.585) 2.049 2.983 ( 2.356 -0.000 -0.592) 2.430 2.990 ( -1.612 0.000 0.843) 1.819 3.269 ( 0.512 -0.000 -1.784) 1.856 3.443 ( -0.170 0.000 2.556) 2.562 3.474 ( 2.223 -0.000 -1.690) 2.793 3.958 ( 0.063 -0.000 -0.463) 0.467 4.294 ( -7.980 0.000 -3.407) 8.677 5.516 ( 11.077 -0.000 1.999) 11.256 5.649 ( 13.091 -0.000 0.654) 13.107 8.616 ( -2.086 0.000 18.287) 18.405 8.628 ( -4.955 0.000 -10.883) 11.957 10.579 ( -2.426 0.000 -17.188) 17.358 11.492 ( 7.754 -0.000 10.741) 13.247 14.684 ( -14.203 0.000 2.409) 14.406 14.881 ( -12.712 0.000 -4.440) 13.465 15.487 ( -0.935 0.000 -3.680) 3.797 15.547 ( 7.675 -0.000 3.822) 8.574 16.797 ( -1.339 0.000 -0.830) 1.575 16.804 ( -5.775 0.000 5.353) 7.874 17.962 ( -1.912 0.000 -3.116) 3.656 18.179 ( 7.050 -0.000 -0.454) 7.065 ======================= Grid point 498 (250/306) ======================= q-point: (-0.10 -0.20 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.803 ( -12.161 -3.229 4.632) 13.408 0.925 ( -7.122 0.914 6.067) 9.401 1.172 ( -10.996 -2.391 4.480) 12.112 1.592 ( -4.899 3.031 4.146) 7.097 1.699 ( -0.590 -4.813 5.544) 7.365 2.091 ( 1.830 -1.589 -5.655) 6.152 2.306 ( -2.033 -0.010 -1.155) 2.338 2.688 ( -0.010 1.565 -2.888) 3.285 2.747 ( 1.152 0.231 2.397) 2.670 2.978 ( -1.667 0.330 0.912) 1.929 3.011 ( 2.538 -0.084 0.091) 2.541 3.233 ( -1.125 -0.185 -3.239) 3.433 3.456 ( -0.928 0.516 0.126) 1.069 3.487 ( 1.663 -0.920 -0.336) 1.930 3.957 ( -0.001 -0.561 -0.640) 0.851 4.160 ( -7.237 -0.146 -3.715) 8.136 5.621 ( 12.728 7.277 2.215) 14.828 5.857 ( 10.853 -2.138 1.770) 11.203 8.434 ( -3.897 4.214 -6.329) 8.544 8.860 ( -1.427 -6.482 18.968) 20.095 10.308 ( -2.301 6.044 -17.493) 18.651 11.566 ( -3.454 -0.953 -3.542) 5.038 14.512 ( -13.488 -1.130 -1.823) 13.657 14.664 ( -13.430 -2.914 -7.866) 15.834 15.454 ( -0.190 -0.481 -1.288) 1.388 15.678 ( 4.976 -0.552 3.353) 6.025 16.763 ( 0.941 4.170 4.462) 6.180 16.924 ( 2.019 -6.343 7.230) 9.828 17.899 ( -1.469 2.007 -1.460) 2.884 18.249 ( 4.941 -1.004 -1.790) 5.350 ======================= Grid point 508 (251/306) ======================= q-point: (-0.10 -0.10 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 305 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.775 ( -2.008 0.000 11.242) 11.420 0.946 ( -5.384 0.000 8.303) 9.895 1.055 ( -8.183 0.000 4.989) 9.584 1.678 ( 1.869 -0.000 1.222) 2.233 1.704 ( -1.821 0.000 10.733) 10.886 2.048 ( 2.583 -0.000 -5.273) 5.871 2.241 ( -4.154 0.000 -3.719) 5.576 2.651 ( -1.164 0.000 -3.944) 4.112 2.792 ( 0.768 -0.000 2.978) 3.076 2.978 ( -1.029 0.000 1.479) 1.801 3.035 ( 1.255 -0.000 -0.412) 1.321 3.168 ( -1.467 0.000 -4.551) 4.781 3.456 ( -0.979 0.000 0.396) 1.056 3.482 ( 1.237 -0.000 -1.631) 2.047 3.945 ( 0.049 -0.000 -1.031) 1.032 4.037 ( -6.093 0.000 -3.239) 6.901 5.806 ( 7.418 -0.000 2.504) 7.829 6.025 ( 13.186 -0.000 -0.135) 13.187 8.344 ( -4.662 0.000 -3.526) 5.846 9.046 ( 0.042 -0.000 21.511) 21.511 10.114 ( -0.603 0.000 -19.578) 19.587 11.370 ( -14.092 0.000 -8.636) 16.527 14.299 ( -12.068 0.000 -4.886) 13.019 14.396 ( -11.386 0.000 -8.931) 14.471 15.451 ( 1.697 -0.000 0.160) 1.705 15.708 ( -2.843 0.000 1.393) 3.166 16.858 ( 1.616 -0.000 4.382) 4.670 17.071 ( 10.978 -0.000 7.947) 13.553 17.899 ( 0.563 -0.000 0.836) 1.008 18.263 ( 2.257 -0.000 -2.530) 3.391 ======================= Grid point 509 (252/306) ======================= q-point: ( 0.00 0.00 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.246 ( -1.885 0.000 8.813) 9.012 1.314 ( 0.363 -0.000 8.386) 8.393 1.345 ( 0.724 -0.000 4.987) 5.039 1.570 ( 4.515 -0.000 -11.359) 12.223 1.826 ( 11.177 -0.000 -3.354) 11.669 1.832 ( -12.410 0.000 -3.480) 12.888 2.251 ( 4.077 -0.000 9.835) 10.647 2.440 ( -3.886 0.000 -7.643) 8.575 2.900 ( 0.413 -0.000 1.015) 1.096 2.903 ( -2.929 0.000 0.302) 2.945 3.032 ( -0.768 0.000 1.537) 1.718 3.066 ( 1.830 -0.000 -1.826) 2.585 3.421 ( -0.881 0.000 -0.652) 1.096 3.426 ( 0.748 -0.000 -0.884) 1.158 3.874 ( -1.814 0.000 0.487) 1.878 3.893 ( 1.143 -0.000 -1.241) 1.687 6.012 ( -0.283 0.000 2.902) 2.916 6.084 ( 1.470 -0.000 -4.075) 4.332 8.594 ( -7.266 0.000 20.710) 21.948 9.068 ( 7.085 -0.000 -23.892) 24.921 10.175 ( 3.084 -0.000 20.478) 20.709 10.557 ( -6.584 0.000 -15.890) 17.200 13.927 ( 0.172 -0.000 -1.785) 1.793 13.932 ( -2.248 0.000 -2.327) 3.235 15.595 ( -6.961 0.000 0.580) 6.985 15.600 ( 7.402 -0.000 0.209) 7.405 17.145 ( -1.628 0.000 6.890) 7.079 17.274 ( 3.463 -0.000 -5.187) 6.237 18.057 ( 3.611 -0.000 2.149) 4.202 18.114 ( -2.919 0.000 -3.277) 4.389 ======================= Grid point 510 (253/306) ======================= q-point: ( 0.10 0.00 -0.55) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.255 ( -1.649 4.778 0.615) 5.092 1.325 ( 3.309 3.083 -2.542) 5.188 1.435 ( -4.535 -3.875 6.800) 9.046 1.518 ( -1.214 -6.460 -8.670) 10.880 1.699 ( -3.322 -0.153 -0.499) 3.363 1.979 ( 13.570 -0.588 1.243) 13.640 2.295 ( -4.226 -0.559 -8.974) 9.935 2.410 ( 4.050 -0.198 8.459) 9.381 2.866 ( -3.270 1.494 1.090) 3.757 2.909 ( 0.048 0.641 1.440) 1.577 3.036 ( -0.401 0.721 0.863) 1.194 3.075 ( 2.291 -0.977 -1.772) 3.056 3.419 ( -1.496 -2.125 0.545) 2.655 3.439 ( 0.119 -1.797 -0.162) 1.808 3.873 ( -0.303 -0.349 1.240) 1.323 3.906 ( 2.887 0.257 -0.398) 2.926 5.968 ( -6.168 6.019 0.540) 8.635 6.037 ( -0.594 0.665 -1.829) 2.035 8.739 ( -7.055 1.578 21.142) 22.344 8.893 ( 6.900 -0.100 -20.607) 21.732 10.310 ( -4.975 1.076 -12.643) 13.629 10.501 ( 8.689 -5.206 16.160) 19.072 13.948 ( 2.876 -2.578 1.858) 4.286 13.992 ( 6.339 -4.255 0.881) 7.686 15.534 ( -4.612 -1.174 0.002) 4.759 15.707 ( 8.273 -1.444 -0.561) 8.417 17.180 ( -2.761 0.511 4.831) 5.588 17.232 ( 1.462 0.333 -7.110) 7.267 18.026 ( -4.337 1.457 -2.930) 5.433 18.111 ( 1.868 0.489 2.242) 2.959 ======================= Grid point 511 (254/306) ======================= q-point: ( 0.20 0.00 -0.55) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 552 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.156 ( 0.371 3.360 -5.034) 6.064 1.263 ( -1.098 -0.621 -7.664) 7.767 1.456 ( -4.588 -1.574 1.275) 5.015 1.525 ( 0.773 -2.522 0.723) 2.735 1.727 ( 3.542 -1.365 -0.025) 3.796 2.167 ( 7.617 -1.155 -0.173) 7.706 2.180 ( -0.521 -4.307 -4.891) 6.538 2.523 ( 2.858 0.811 4.818) 5.661 2.810 ( -3.372 2.128 1.067) 4.128 2.927 ( 1.705 0.878 1.677) 2.548 3.030 ( -0.635 0.697 1.167) 1.501 3.114 ( 2.817 -2.392 -0.676) 3.757 3.414 ( -1.562 -0.746 -1.398) 2.225 3.482 ( -1.058 -3.215 2.446) 4.176 3.900 ( 0.537 -1.252 1.565) 2.075 3.955 ( 4.667 -0.313 0.790) 4.743 5.752 ( -11.648 10.278 -0.342) 15.538 5.996 ( -1.597 1.248 -1.385) 2.454 8.644 ( 1.898 4.591 -14.498) 15.326 9.016 ( 0.717 -4.096 19.414) 19.854 10.075 ( -5.281 1.620 -15.091) 16.070 10.884 ( 11.242 -5.878 16.101) 20.498 14.098 ( 6.434 -4.724 5.822) 9.879 14.198 ( 11.432 -7.264 3.060) 13.887 15.505 ( -2.065 -1.277 -0.645) 2.512 15.806 ( 5.106 -1.422 -1.227) 5.440 17.127 ( -1.375 1.656 -6.958) 7.283 17.207 ( -0.282 -1.956 0.130) 1.980 17.907 ( -5.040 3.807 -1.998) 6.624 18.143 ( -0.049 0.243 2.472) 2.484 ======================= Grid point 512 (255/306) ======================= q-point: ( 0.30 0.00 -0.55) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.084 ( 0.806 0.583 -5.407) 5.498 1.211 ( 1.758 -4.281 -6.478) 7.961 1.398 ( -4.270 3.425 1.722) 5.738 1.577 ( 3.388 0.266 -0.916) 3.520 1.766 ( 0.903 -0.572 -0.858) 1.371 2.141 ( -1.011 -4.396 -2.939) 5.384 2.332 ( 6.633 -4.521 0.078) 8.028 2.576 ( 1.847 1.017 2.521) 3.286 2.775 ( -1.389 0.276 1.317) 1.934 2.965 ( 3.028 0.060 0.863) 3.149 3.027 ( -0.923 0.403 1.063) 1.464 3.182 ( 2.357 -2.617 0.468) 3.554 3.374 ( -1.941 1.385 -0.595) 2.457 3.522 ( -1.148 -1.434 1.583) 2.425 3.948 ( 0.683 -2.182 1.595) 2.787 4.049 ( 6.210 -1.957 1.584) 6.701 5.436 ( -15.039 12.173 -0.830) 19.366 5.941 ( -1.685 1.045 -1.870) 2.726 8.473 ( 3.367 4.169 -11.705) 12.873 9.323 ( 2.398 -4.559 21.370) 21.982 9.816 ( -5.865 1.369 -15.126) 16.281 11.238 ( 9.764 -3.961 12.281) 16.181 14.329 ( 7.290 -5.374 8.270) 12.264 14.505 ( 14.511 -8.668 4.806) 17.573 15.494 ( -0.179 -0.681 -1.232) 1.419 15.811 ( -2.500 1.113 -2.128) 3.467 16.994 ( -1.761 1.906 -9.106) 9.468 17.261 ( 3.194 -5.769 -1.890) 6.860 17.767 ( -5.219 6.480 -0.228) 8.324 18.161 ( -1.286 -0.185 2.484) 2.803 ======================= Grid point 513 (256/306) ======================= q-point: ( 0.40 0.00 -0.55) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 552 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.039 ( 0.880 -0.555 -4.815) 4.926 1.261 ( 2.806 -4.171 -1.502) 5.247 1.328 ( -1.583 2.374 0.556) 2.907 1.552 ( -1.037 4.274 -1.478) 4.639 1.761 ( 0.081 -0.482 -0.928) 1.049 2.169 ( 0.536 -2.885 -0.938) 3.081 2.442 ( 3.211 -2.773 -0.164) 4.246 2.623 ( 2.374 -1.018 2.110) 3.335 2.789 ( 0.079 -1.309 0.295) 1.344 3.009 ( 0.003 -0.355 0.014) 0.356 3.026 ( 1.852 -0.889 0.060) 2.055 3.201 ( -2.144 0.574 -0.583) 2.295 3.359 ( 1.497 0.618 2.262) 2.782 3.525 ( -1.113 0.335 0.632) 1.323 3.996 ( 0.464 -1.802 1.152) 2.189 4.187 ( 7.279 -3.712 1.213) 8.261 5.091 ( -14.020 10.350 -1.564) 17.497 5.895 ( -1.152 0.440 -1.497) 1.940 8.377 ( 3.838 2.813 -6.214) 7.826 9.501 ( -4.892 8.722 3.713) 10.667 9.700 ( 1.885 -11.723 1.177) 11.932 11.476 ( 6.046 -1.352 7.039) 9.377 14.562 ( 5.120 -4.094 7.926) 10.286 14.859 ( 15.172 -8.343 6.047) 18.340 15.488 ( 0.838 -0.042 -1.442) 1.668 15.665 ( -9.937 4.351 -3.748) 11.477 16.851 ( -1.544 1.661 -8.426) 8.726 17.381 ( 5.531 -8.896 -3.643) 11.090 17.617 ( -5.153 8.630 1.884) 10.226 18.173 ( -1.089 -0.352 1.915) 2.231 ======================= Grid point 514 (257/306) ======================= q-point: (-0.50 0.00 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.007 ( -0.212 0.209 -2.525) 2.542 1.267 ( -2.434 1.401 3.648) 4.604 1.351 ( -0.577 0.875 -1.408) 1.755 1.466 ( -0.244 0.139 -0.089) 0.295 1.764 ( 1.527 -0.208 -1.427) 2.100 2.189 ( 0.280 -0.705 -0.764) 1.076 2.473 ( -0.323 0.766 0.662) 1.063 2.689 ( 1.347 -0.899 1.054) 1.932 2.790 ( -1.103 0.188 -0.468) 1.213 2.992 ( -0.755 0.339 0.025) 0.828 3.052 ( -0.525 0.831 -0.036) 0.984 3.170 ( 0.345 -0.765 0.052) 0.840 3.406 ( 1.375 -0.653 0.781) 1.711 3.511 ( -0.722 0.538 0.665) 1.120 4.021 ( -0.197 -0.168 0.583) 0.638 4.302 ( 1.752 -1.841 -1.076) 2.760 4.883 ( -1.692 1.007 -0.049) 1.970 5.871 ( -0.497 0.100 -0.442) 0.672 8.347 ( 1.971 0.973 -2.727) 3.503 9.349 ( -3.802 6.576 2.064) 7.871 9.888 ( 1.279 -7.903 0.843) 8.050 11.583 ( 2.077 -0.223 1.936) 2.848 14.701 ( 0.604 -1.145 3.914) 4.122 15.180 ( 8.365 -4.497 4.066) 10.331 15.416 ( -10.106 3.987 -2.517) 11.152 15.488 ( 2.839 0.586 -1.669) 3.346 16.746 ( -0.958 0.979 -4.078) 4.302 17.438 ( -4.504 7.528 2.423) 9.101 17.549 ( 3.924 -7.253 -2.969) 8.765 18.188 ( 0.652 -0.213 0.615) 0.921 ======================= Grid point 515 (258/306) ======================= q-point: (-0.40 0.00 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 552 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.974 ( -1.789 1.293 1.032) 2.436 1.221 ( -6.069 7.579 1.226) 9.787 1.293 ( -1.663 -1.582 5.058) 5.555 1.536 ( 1.461 -3.969 0.263) 4.238 1.770 ( 2.820 0.568 -1.822) 3.405 2.173 ( -0.164 1.864 -1.114) 2.178 2.431 ( -3.812 3.395 1.005) 5.203 2.666 ( -2.110 1.003 -1.914) 3.020 2.778 ( -0.191 1.137 1.374) 1.794 3.001 ( 1.413 0.621 0.721) 1.703 3.014 ( -2.652 0.827 0.865) 2.909 3.204 ( 1.903 -1.181 -0.730) 2.355 3.405 ( -1.555 -1.170 -2.054) 2.829 3.520 ( 0.665 0.100 1.181) 1.359 4.008 ( -1.003 1.385 -0.030) 1.710 4.229 ( -6.204 1.737 -3.000) 7.107 5.053 ( 13.775 -9.844 2.067) 17.057 5.872 ( 0.337 -0.273 0.776) 0.889 8.326 ( -1.787 -0.830 -1.180) 2.297 9.326 ( -0.119 5.761 11.918) 13.238 9.912 ( -0.857 -4.670 -10.591) 11.607 11.580 ( -2.158 -0.130 -2.955) 3.661 14.677 ( -4.640 2.426 -2.291) 5.715 14.998 ( -15.014 7.399 -6.926) 18.114 15.452 ( -0.649 -1.362 2.338) 2.783 15.587 ( 12.161 -2.117 3.057) 12.717 16.728 ( 0.150 -0.308 2.756) 2.777 17.296 ( -5.073 9.593 4.309) 11.675 17.668 ( 3.446 -8.470 -3.003) 9.624 18.206 ( 2.466 -0.001 -1.189) 2.738 ======================= Grid point 516 (259/306) ======================= q-point: (-0.30 0.00 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.970 ( -1.124 1.211 5.064) 5.327 1.088 ( -5.196 6.882 4.806) 9.872 1.363 ( -0.580 -0.972 5.573) 5.686 1.560 ( -2.867 -1.482 0.588) 3.281 1.784 ( 3.476 0.485 -2.235) 4.161 2.120 ( 0.848 4.856 -0.573) 4.963 2.333 ( -5.595 3.395 0.125) 6.546 2.620 ( -1.556 -0.493 -1.787) 2.420 2.780 ( 0.406 0.175 0.861) 0.968 2.973 ( -2.516 -0.136 -0.071) 2.521 3.033 ( 1.437 0.067 0.580) 1.552 3.201 ( -0.755 1.560 -1.401) 2.229 3.384 ( -0.589 -1.912 -1.655) 2.597 3.534 ( 0.490 0.635 0.431) 0.911 3.970 ( -1.142 1.628 -0.601) 2.077 4.098 ( -5.841 1.515 -3.074) 6.772 5.410 ( 16.204 -11.821 1.673) 20.128 5.907 ( 1.726 -1.379 1.559) 2.704 8.312 ( -4.139 -2.382 2.821) 5.546 9.430 ( 0.520 7.480 17.937) 19.441 9.787 ( 0.261 -4.854 -18.638) 19.262 11.455 ( -7.375 1.178 -8.393) 11.235 14.493 ( -8.312 5.029 -6.648) 11.772 14.633 ( -14.858 7.601 -7.410) 18.260 15.467 ( 0.297 0.334 1.171) 1.254 15.757 ( 5.096 -0.169 2.942) 5.887 16.815 ( 1.834 -1.911 7.555) 8.006 17.197 ( -1.499 6.522 4.195) 7.898 17.775 ( 2.953 -6.136 -0.931) 6.873 18.217 ( 2.619 0.094 -2.747) 3.797 ======================= Grid point 517 (260/306) ======================= q-point: (-0.20 0.00 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 552 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.025 ( -1.694 -0.937 6.360) 6.649 1.067 ( 1.367 3.720 10.415) 11.143 1.366 ( -3.424 7.346 6.567) 10.432 1.582 ( 0.983 -5.013 -0.775) 5.167 1.780 ( 1.979 0.068 -3.788) 4.274 2.088 ( 3.198 5.065 1.725) 6.234 2.207 ( -7.995 2.261 -1.873) 8.517 2.589 ( -1.741 -0.714 -1.902) 2.676 2.812 ( 1.420 -1.787 0.960) 2.476 2.951 ( -2.406 -1.879 -0.660) 3.124 3.049 ( 0.834 -0.061 -0.185) 0.857 3.127 ( -2.053 3.209 -2.260) 4.430 3.398 ( 0.412 -1.304 -0.160) 1.377 3.520 ( 0.475 2.409 -0.860) 2.602 3.931 ( -0.715 1.010 -1.285) 1.784 3.985 ( -4.939 0.816 -2.310) 5.513 5.736 ( 12.113 -8.867 1.110) 15.052 5.980 ( 3.525 -2.876 0.503) 4.577 8.357 ( -4.849 -3.024 9.449) 11.043 9.417 ( 0.131 5.721 -7.479) 9.418 9.771 ( 3.006 -3.113 4.980) 6.597 11.189 ( -11.468 3.170 -12.744) 17.435 14.238 ( -8.838 5.384 -7.054) 12.525 14.301 ( -11.798 6.029 -6.866) 14.923 15.486 ( 2.239 1.117 1.098) 2.733 15.774 ( -3.639 2.089 1.763) 4.551 16.955 ( 1.635 -1.909 8.249) 8.623 17.198 ( 3.901 1.925 2.044) 4.807 17.876 ( 3.598 -3.605 1.097) 5.210 18.206 ( 1.154 -0.057 -3.437) 3.626 ======================= Grid point 518 (261/306) ======================= q-point: (-0.10 0.00 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.117 ( -1.940 -4.279 9.460) 10.563 1.213 ( 5.643 0.375 9.589) 11.132 1.301 ( -3.438 8.035 8.767) 12.379 1.624 ( 4.974 -0.555 -7.298) 8.849 1.771 ( 3.682 -1.827 -4.830) 6.342 2.033 ( -11.257 1.368 -3.568) 11.888 2.124 ( 3.732 2.880 6.550) 8.070 2.541 ( -2.605 -0.437 -3.848) 4.667 2.867 ( 1.350 -1.647 1.179) 2.434 2.935 ( -2.832 -2.128 -1.454) 3.829 3.043 ( -1.901 1.866 1.235) 2.936 3.064 ( 1.662 0.497 -2.019) 2.662 3.414 ( 0.335 -0.771 -0.136) 0.852 3.471 ( 0.374 3.370 -1.879) 3.877 3.903 ( -0.173 0.171 -1.585) 1.604 3.909 ( -3.480 0.140 -0.776) 3.568 5.937 ( 4.707 -3.687 2.382) 6.436 6.061 ( 4.579 -3.107 -2.717) 6.164 8.464 ( -5.930 -1.878 15.928) 17.099 9.240 ( 5.091 0.720 -21.032) 21.652 9.948 ( 1.347 0.869 17.703) 17.775 10.852 ( -10.846 2.658 -14.866) 18.593 14.021 ( -5.735 3.373 -4.809) 8.210 14.056 ( -7.222 3.308 -5.325) 9.563 15.525 ( 4.821 1.115 0.821) 5.016 15.689 ( -7.459 1.687 1.124) 7.730 17.070 ( -0.079 -0.830 7.847) 7.892 17.256 ( 5.369 -0.254 -1.991) 5.732 17.975 ( 4.235 -1.471 2.038) 4.925 18.172 ( -0.950 -0.309 -3.442) 3.584 ======================= Grid point 520 (262/306) ======================= q-point: ( 0.10 0.10 -0.55) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 305 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.247 ( -3.925 0.000 -10.165) 10.897 1.262 ( -0.722 0.000 -6.207) 6.249 1.355 ( 4.805 -0.000 -5.003) 6.937 1.516 ( 0.066 -0.000 7.574) 7.574 1.715 ( 1.505 -0.000 3.311) 3.637 2.126 ( 1.795 -0.000 -4.130) 4.503 2.154 ( 5.236 -0.000 -3.440) 6.266 2.535 ( 3.027 -0.000 5.429) 6.215 2.851 ( -3.250 0.000 1.235) 3.477 2.943 ( 0.190 -0.000 4.586) 4.590 3.049 ( 0.591 -0.000 -0.453) 0.744 3.060 ( 1.061 -0.000 -2.355) 2.583 3.398 ( -1.609 0.000 1.916) 2.502 3.427 ( -0.512 0.000 0.363) 0.628 3.888 ( 0.289 -0.000 1.701) 1.725 3.961 ( 5.489 -0.000 0.405) 5.504 5.924 ( -7.131 0.000 -3.758) 8.060 5.970 ( -7.731 0.000 1.920) 7.966 8.723 ( 5.434 -0.000 -20.249) 20.965 8.946 ( -4.685 0.000 25.122) 25.555 10.110 ( -0.754 0.000 -17.692) 17.708 10.793 ( 9.938 -0.000 19.518) 21.902 14.044 ( 8.750 -0.000 4.794) 9.977 14.100 ( 10.362 -0.000 4.349) 11.238 15.491 ( -0.759 0.000 -0.612) 0.975 15.780 ( 6.368 -0.000 -1.709) 6.593 17.151 ( -0.592 0.000 -8.477) 8.498 17.184 ( -2.891 0.000 1.785) 3.398 17.956 ( -3.823 0.000 -2.048) 4.337 18.143 ( -1.107 0.000 2.440) 2.679 ======================= Grid point 521 (263/306) ======================= q-point: ( 0.20 0.10 -0.55) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.120 ( 0.379 -2.153 -9.076) 9.335 1.161 ( 1.626 4.017 -5.843) 7.275 1.419 ( 7.571 -1.910 -4.755) 9.142 1.580 ( 1.114 0.020 3.609) 3.777 1.768 ( 2.059 0.850 1.954) 2.963 2.034 ( -2.544 -2.983 -4.836) 6.226 2.271 ( 7.325 -0.952 0.247) 7.391 2.601 ( 1.906 0.568 2.283) 3.028 2.809 ( -3.037 1.793 0.952) 3.653 2.995 ( 1.652 2.022 3.081) 4.039 3.030 ( -0.954 0.213 -0.415) 1.062 3.094 ( 2.116 -4.036 0.102) 4.559 3.395 ( -1.330 0.939 1.234) 2.043 3.449 ( -1.686 -3.217 2.270) 4.284 3.915 ( 0.632 -0.561 1.557) 1.772 4.047 ( 7.348 0.630 1.324) 7.493 5.705 ( -12.667 8.791 -1.987) 15.546 5.903 ( -8.608 -3.854 -0.925) 9.477 8.575 ( 5.241 3.033 -14.393) 15.615 9.200 ( -0.540 -3.657 22.188) 22.493 9.895 ( -1.433 2.941 -15.622) 15.961 11.140 ( 9.634 -2.895 16.266) 19.125 14.250 ( 11.411 -1.029 7.680) 13.793 14.337 ( 13.784 -4.355 6.253) 15.750 15.492 ( 2.402 0.228 -1.363) 2.771 15.808 ( 0.667 -0.640 -2.979) 3.119 17.033 ( -2.079 0.961 -8.716) 9.012 17.167 ( -0.317 -1.847 -2.229) 2.912 17.885 ( -2.810 2.736 -0.529) 3.957 18.145 ( -3.441 -0.717 2.577) 4.358 ======================= Grid point 522 (264/306) ======================= q-point: ( 0.30 0.10 -0.55) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.086 ( 3.837 3.172 -4.828) 6.935 1.124 ( 4.292 -4.537 -4.782) 7.866 1.433 ( 2.397 4.336 -1.161) 5.089 1.621 ( 2.828 0.570 -1.878) 3.442 1.782 ( 2.545 2.126 -0.459) 3.348 2.060 ( 2.096 -5.862 -0.524) 6.248 2.361 ( 4.507 -2.324 -0.215) 5.076 2.633 ( 1.551 0.967 1.714) 2.505 2.772 ( -1.566 0.278 0.413) 1.643 3.003 ( 0.688 0.417 -0.992) 1.278 3.020 ( -0.167 -0.049 0.481) 0.512 3.177 ( 1.449 -2.280 1.390) 3.038 3.380 ( -1.254 1.018 1.960) 2.540 3.489 ( -2.093 -2.794 1.881) 3.966 3.952 ( 0.933 -1.466 1.198) 2.111 4.156 ( 8.150 0.489 2.113) 8.434 5.373 ( -15.657 11.683 -2.051) 19.642 5.837 ( -8.015 -4.967 -1.606) 9.565 8.476 ( 6.042 4.323 -8.178) 11.049 9.457 ( 2.463 -7.631 2.649) 8.445 9.700 ( -3.033 6.812 2.843) 7.981 11.421 ( 5.601 -2.556 10.303) 12.003 14.496 ( 10.566 -1.070 8.652) 13.698 14.668 ( 15.553 -6.731 7.391) 18.488 15.505 ( 3.703 1.179 -1.969) 4.356 15.729 ( -6.578 1.000 -4.705) 8.149 16.894 ( -1.943 1.684 -8.217) 8.609 17.193 ( 3.510 -5.742 -4.675) 8.195 17.803 ( -2.762 6.066 1.538) 6.840 18.141 ( -3.920 -1.993 2.210) 4.922 ======================= Grid point 523 (265/306) ======================= q-point: ( 0.40 0.10 -0.55) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.058 ( 4.214 3.233 -2.132) 5.724 1.218 ( 4.255 -5.655 -1.256) 7.187 1.377 ( 1.577 5.217 -1.023) 5.545 1.573 ( -1.839 4.337 -1.532) 4.954 1.791 ( 4.517 2.383 -0.917) 5.189 2.160 ( 3.475 -2.308 0.634) 4.219 2.444 ( 3.368 -3.056 -0.530) 4.579 2.665 ( 1.744 -0.200 1.824) 2.531 2.769 ( -0.446 -1.316 -0.345) 1.431 2.989 ( -0.748 -0.493 -0.858) 1.241 3.039 ( 1.848 -0.809 -0.489) 2.076 3.191 ( -1.294 1.201 0.759) 1.921 3.390 ( -1.241 -0.527 1.965) 2.383 3.504 ( -1.283 -1.230 0.585) 1.871 3.996 ( 1.057 -1.617 0.738) 2.068 4.275 ( 6.734 0.090 2.139) 7.066 5.028 ( -12.425 9.639 -1.798) 15.828 5.798 ( -6.859 -5.855 -0.749) 9.049 8.428 ( 5.557 5.002 -4.289) 8.619 9.404 ( 0.667 -2.800 -14.348) 14.634 9.813 ( -0.753 2.370 19.156) 19.316 11.557 ( 0.457 -1.618 3.221) 3.633 14.697 ( 7.000 0.827 6.275) 9.437 15.027 ( 14.128 -6.892 7.535) 17.432 15.499 ( -3.994 2.402 -1.640) 4.941 15.537 ( -3.084 2.781 -6.679) 7.865 16.781 ( -0.321 1.753 -5.298) 5.589 17.289 ( 5.326 -8.882 -4.784) 11.408 17.694 ( -4.484 8.606 3.199) 10.218 18.150 ( -2.223 -2.732 1.117) 3.695 ======================= Grid point 524 (266/306) ======================= q-point: ( 0.50 0.10 -0.55) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.061 ( 4.786 4.457 0.861) 6.596 1.272 ( -2.354 -0.314 1.329) 2.721 1.366 ( 3.069 2.141 -0.847) 3.837 1.485 ( -0.020 2.714 0.121) 2.717 1.807 ( 4.951 2.567 -1.500) 5.775 2.205 ( 2.039 0.962 0.449) 2.299 2.478 ( 0.098 0.196 -0.544) 0.587 2.690 ( -1.019 0.311 -0.621) 1.233 2.786 ( 0.474 -0.772 1.107) 1.430 2.996 ( 1.158 -0.733 0.513) 1.463 3.049 ( -0.998 0.625 -0.355) 1.230 3.178 ( 1.071 -0.003 0.510) 1.186 3.373 ( -4.119 -1.203 -0.829) 4.371 3.510 ( -0.250 -0.717 -0.099) 0.766 4.025 ( 0.487 -0.183 0.345) 0.625 4.303 ( -2.575 3.866 0.309) 4.655 4.899 ( 3.987 -1.610 0.826) 4.379 5.792 ( -6.011 -6.168 0.505) 8.628 8.376 ( 2.317 4.805 -3.281) 6.262 9.365 ( 4.030 -3.238 -3.584) 6.290 9.907 ( -2.682 4.509 8.031) 9.593 11.557 ( -3.768 -1.671 -2.421) 4.780 14.761 ( 1.769 4.311 0.546) 4.692 15.173 ( -9.414 6.287 -4.931) 12.347 15.379 ( 2.179 -4.340 5.173) 7.095 15.554 ( 9.249 -0.348 -1.887) 9.446 16.740 ( 1.477 1.287 0.407) 2.001 17.425 ( 5.257 -8.487 -2.954) 10.411 17.553 ( -6.057 8.521 3.275) 10.955 18.173 ( -0.224 -2.692 -0.528) 2.752 ======================= Grid point 525 (267/306) ======================= q-point: (-0.40 0.10 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.082 ( 6.155 7.000 3.412) 9.926 1.244 ( -4.325 2.781 1.661) 5.404 1.325 ( 0.122 2.183 2.935) 3.659 1.530 ( 2.740 -1.521 0.588) 3.188 1.815 ( 4.747 2.335 -2.540) 5.868 2.208 ( 1.762 2.456 0.061) 3.023 2.435 ( -3.435 3.492 0.537) 4.927 2.632 ( -2.251 1.594 -2.206) 3.532 2.799 ( -0.189 0.765 0.574) 0.975 2.996 ( -3.641 1.865 0.286) 4.101 3.027 ( 1.054 -0.494 0.010) 1.164 3.215 ( 0.974 -0.596 0.019) 1.141 3.327 ( -2.755 -2.507 -1.508) 4.019 3.513 ( -1.044 -1.777 -0.351) 2.091 4.016 ( -0.675 1.888 0.330) 2.032 4.181 ( -4.507 5.247 -0.942) 6.980 5.127 ( 14.335 -10.213 1.591) 17.673 5.810 ( -5.424 -6.483 1.573) 8.598 8.313 ( -0.855 2.836 0.135) 2.965 9.493 ( 7.588 -4.511 3.200) 9.389 9.810 ( -4.595 8.462 -1.489) 9.743 11.457 ( -7.450 -1.157 -6.501) 9.955 14.651 ( -3.139 7.543 -4.763) 9.457 14.847 ( -12.880 9.422 -6.844) 17.364 15.468 ( 0.580 -0.531 3.078) 3.177 15.718 ( 9.364 -2.937 1.220) 9.889 16.793 ( 2.628 0.251 5.901) 6.464 17.388 ( -5.409 8.598 3.262) 10.669 17.592 ( 5.393 -8.434 -1.375) 10.105 18.191 ( 0.334 -2.325 -2.291) 3.281 ======================= Grid point 526 (268/306) ======================= q-point: (-0.30 0.10 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.102 ( 3.986 6.850 2.380) 8.275 1.176 ( -2.212 4.381 6.421) 8.082 1.408 ( 4.115 -2.553 4.578) 6.664 1.554 ( 0.057 2.108 1.495) 2.585 1.805 ( 3.248 2.009 -3.918) 5.472 2.195 ( 1.650 3.018 -0.134) 3.442 2.315 ( -6.473 6.576 0.735) 9.256 2.572 ( -1.439 -0.199 -2.781) 3.138 2.792 ( 0.462 0.085 -0.018) 0.471 2.935 ( -3.308 0.638 -0.378) 3.390 3.035 ( -0.060 -1.042 -1.011) 1.453 3.180 ( -3.340 0.614 -1.874) 3.879 3.359 ( 1.341 -1.999 1.578) 2.878 3.523 ( -0.972 -2.108 -0.195) 2.329 3.976 ( -1.277 2.785 0.199) 3.070 4.060 ( -2.321 5.207 -2.011) 6.045 5.468 ( 14.899 -12.060 0.310) 19.171 5.852 ( -4.627 -7.371 1.966) 8.922 8.312 ( -2.370 0.244 7.447) 7.819 9.534 ( -0.762 0.521 -20.344) 20.365 9.755 ( 5.596 4.814 18.434) 19.857 11.251 ( -10.739 1.276 -10.354) 14.972 14.423 ( -5.819 9.265 -6.190) 12.571 14.503 ( -10.643 10.034 -6.460) 15.990 15.513 ( 2.711 0.865 2.184) 3.587 15.811 ( 0.554 0.272 0.727) 0.953 16.913 ( 2.481 -0.979 8.284) 8.703 17.283 ( -1.472 4.995 1.484) 5.414 17.752 ( 5.924 -6.350 0.738) 8.715 18.184 ( -0.576 -1.970 -3.547) 4.099 ======================= Grid point 527 (269/306) ======================= q-point: (-0.20 0.10 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.092 ( -0.605 2.429 5.469) 6.015 1.221 ( 1.466 0.444 4.853) 5.089 1.496 ( -1.397 6.159 6.396) 8.988 1.595 ( 9.501 -0.923 2.482) 9.863 1.758 ( 2.212 1.678 -6.150) 6.748 2.094 ( -10.660 3.372 -3.191) 11.627 2.227 ( 3.452 5.147 3.131) 6.943 2.524 ( -2.050 -0.740 -4.070) 4.617 2.821 ( 1.918 -1.557 0.681) 2.563 2.893 ( -2.788 -0.908 -0.476) 2.970 3.037 ( -0.399 -1.265 -0.565) 1.442 3.107 ( -2.246 1.300 -2.060) 3.313 3.412 ( 0.930 -0.188 2.490) 2.664 3.524 ( -0.583 -0.194 -0.905) 1.094 3.928 ( -1.119 2.247 -0.395) 2.541 3.953 ( -1.422 4.339 -1.974) 4.974 5.766 ( 10.060 -9.731 0.006) 13.996 5.916 ( -2.960 -8.314 0.441) 8.836 8.410 ( -3.734 -1.391 15.361) 15.869 9.270 ( 1.488 1.590 -22.966) 23.069 9.998 ( 6.090 3.197 18.987) 20.194 10.944 ( -11.476 3.781 -13.620) 18.207 14.175 ( -6.352 8.743 -3.574) 11.383 14.213 ( -5.037 9.267 -6.050) 12.159 15.566 ( 5.197 1.775 1.457) 5.682 15.755 ( -6.018 3.009 0.415) 6.741 17.039 ( 0.431 -1.210 8.331) 8.430 17.258 ( 2.789 0.892 -1.838) 3.457 17.906 ( 5.764 -4.072 2.006) 7.337 18.148 ( -2.177 -1.825 -3.939) 4.856 ======================= Grid point 528 (270/306) ======================= q-point: (-0.10 0.10 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.164 ( -0.520 -2.338 8.181) 8.525 1.273 ( 0.702 -3.238 -1.145) 3.506 1.465 ( -3.374 7.001 9.505) 12.278 1.660 ( 6.327 5.442 -8.846) 12.161 1.797 ( 11.724 -1.443 1.249) 11.878 1.860 ( -12.903 2.320 -4.408) 13.831 2.285 ( 4.295 2.466 6.739) 8.363 2.436 ( -3.444 -0.134 -6.918) 7.729 2.873 ( -0.282 -1.438 0.968) 1.756 2.877 ( -1.034 -1.837 0.299) 2.129 3.036 ( -2.193 -0.313 1.021) 2.439 3.070 ( 2.151 0.309 -2.083) 3.010 3.436 ( -0.027 1.647 2.394) 2.906 3.487 ( -0.369 2.337 -2.150) 3.197 3.885 ( -1.262 1.607 -0.005) 2.044 3.896 ( 0.627 0.994 -0.992) 1.538 5.931 ( -2.296 -6.449 2.788) 7.391 5.997 ( 3.288 -6.855 -3.609) 8.416 8.570 ( -6.107 -1.278 20.991) 21.899 9.052 ( 6.010 -0.910 -24.434) 25.179 10.231 ( 3.700 3.998 20.394) 21.109 10.611 ( -6.782 3.820 -15.863) 17.670 13.998 ( -3.364 5.986 -0.390) 6.878 14.031 ( 1.371 7.434 -3.633) 8.387 15.627 ( 0.962 2.197 0.830) 2.538 15.636 ( -0.756 2.780 0.025) 2.881 17.131 ( -1.527 -0.887 7.211) 7.424 17.262 ( 3.291 -0.700 -5.152) 6.154 18.031 ( 4.271 -2.057 2.298) 5.269 18.092 ( -3.540 -1.791 -3.631) 5.378 ======================= Grid point 531 (271/306) ======================= q-point: ( 0.20 0.20 -0.55) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.058 ( 5.110 -0.000 -5.885) 7.794 1.145 ( 0.814 -0.000 -3.612) 3.703 1.515 ( 17.382 -0.000 -7.609) 18.975 1.590 ( -3.100 0.000 1.773) 3.572 1.833 ( 4.258 -0.000 1.411) 4.485 1.957 ( -0.476 0.000 -1.193) 1.285 2.335 ( 4.301 -0.000 -0.382) 4.318 2.645 ( 1.713 -0.000 1.575) 2.327 2.786 ( -3.015 0.000 -0.192) 3.021 3.006 ( -1.617 0.000 -0.678) 1.753 3.032 ( 0.731 -0.000 -1.488) 1.658 3.130 ( 3.290 -0.000 4.383) 5.480 3.407 ( -2.523 0.000 1.162) 2.777 3.432 ( -0.968 0.000 3.687) 3.812 3.933 ( 0.753 -0.000 0.992) 1.245 4.169 ( 8.448 -0.000 1.834) 8.645 5.601 ( -12.155 0.000 -2.466) 12.402 5.695 ( -14.499 0.000 -1.336) 14.560 8.540 ( 6.772 -0.000 -8.770) 11.081 9.355 ( 2.555 -0.000 3.403) 4.256 9.793 ( -2.487 0.000 2.034) 3.212 11.383 ( 5.736 -0.000 12.229) 13.507 14.500 ( 13.651 -0.000 8.679) 16.176 14.564 ( 14.523 -0.000 8.096) 16.627 15.525 ( 5.583 -0.000 -2.905) 6.294 15.735 ( -5.221 0.000 -4.518) 6.904 16.919 ( -2.580 0.000 -7.125) 7.578 17.118 ( 2.385 -0.000 -5.964) 6.423 17.888 ( -0.326 0.000 0.950) 1.004 18.105 ( -6.327 0.000 2.603) 6.841 ======================= Grid point 532 (272/306) ======================= q-point: ( 0.30 0.20 -0.55) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.110 ( 7.073 -2.440 -2.053) 7.759 1.125 ( 2.363 1.555 -1.323) 3.123 1.519 ( 0.683 5.057 -1.239) 5.251 1.626 ( 5.866 -0.132 -5.253) 7.875 1.884 ( 6.694 5.204 0.577) 8.499 2.042 ( 6.805 -6.719 1.377) 9.662 2.378 ( 2.621 -1.407 -0.484) 3.014 2.679 ( 1.462 0.682 1.396) 2.134 2.747 ( -1.907 -0.370 -0.807) 2.103 2.978 ( -1.040 -0.230 -1.212) 1.613 3.030 ( 0.940 -0.050 -0.629) 1.132 3.202 ( 0.980 -0.112 2.200) 2.412 3.384 ( -3.115 -0.001 1.775) 3.586 3.468 ( -0.649 -1.139 2.259) 2.612 3.960 ( 1.349 -0.975 0.457) 1.726 4.292 ( 8.155 0.698 2.395) 8.528 5.305 ( -14.594 11.898 -1.825) 18.917 5.595 ( -12.628 -10.136 -1.233) 16.240 8.548 ( 7.842 3.488 -3.244) 9.175 9.299 ( 3.060 -3.429 -18.958) 19.507 9.907 ( -2.618 3.023 23.203) 23.545 11.520 ( -0.174 -1.027 4.526) 4.645 14.739 ( 11.711 2.382 7.997) 14.379 14.873 ( 14.367 -4.951 8.428) 17.377 15.547 ( 4.528 1.230 -4.254) 6.333 15.584 ( -7.964 0.893 -6.118) 10.082 16.826 ( -0.403 1.542 -4.105) 4.404 17.116 ( 4.822 -4.375 -6.895) 9.484 17.872 ( -1.207 5.242 2.361) 5.875 18.067 ( -6.094 -3.373 1.884) 7.215 ======================= Grid point 533 (273/306) ======================= q-point: ( 0.40 0.20 -0.55) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 552 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.141 ( 4.038 1.978 1.186) 4.650 1.222 ( 5.327 -2.619 1.158) 6.048 1.455 ( 2.331 4.929 -1.369) 5.621 1.591 ( 1.451 3.717 -3.699) 5.441 1.903 ( 5.700 5.168 0.708) 7.727 2.205 ( 6.063 -1.543 0.733) 6.299 2.437 ( 3.042 -3.088 -1.038) 4.457 2.690 ( -0.194 0.256 0.223) 0.391 2.749 ( 0.754 -1.779 0.269) 1.951 2.972 ( 0.783 -0.931 -0.292) 1.251 3.040 ( 0.818 -0.608 -0.623) 1.195 3.203 ( -1.623 1.134 0.873) 2.164 3.356 ( -4.630 -0.173 0.807) 4.703 3.488 ( -0.093 -0.941 -0.314) 0.996 4.001 ( 2.232 -1.433 0.065) 2.654 4.389 ( 4.403 2.547 2.637) 5.730 4.994 ( -9.041 8.789 -0.434) 12.616 5.577 ( -10.845 -10.972 0.260) 15.429 8.542 ( 6.320 7.869 -2.773) 10.467 9.215 ( 5.168 -7.543 -14.572) 17.203 10.065 ( -3.729 6.442 20.518) 21.826 11.508 ( -5.014 -2.036 -3.297) 6.337 14.882 ( 7.213 5.289 3.697) 9.679 15.192 ( 10.696 -5.258 7.698) 14.189 15.366 ( -9.771 4.046 -5.828) 12.075 15.549 ( 4.915 -0.432 -4.755) 6.852 16.792 ( 3.373 2.849 -0.362) 4.430 17.201 ( 6.238 -8.364 -4.578) 11.394 17.771 ( -5.990 8.110 3.041) 10.531 18.080 ( -2.715 -4.691 0.422) 5.437 ======================= Grid point 534 (274/306) ======================= q-point: ( 0.50 0.20 -0.55) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.203 ( 5.349 1.373 2.904) 6.239 1.289 ( 1.336 3.166 3.679) 5.034 1.439 ( 5.394 3.844 -3.017) 7.278 1.529 ( 1.392 2.835 0.097) 3.160 1.909 ( 5.317 5.279 -0.560) 7.513 2.254 ( 2.455 1.355 0.098) 2.806 2.469 ( 0.799 -0.516 -1.646) 1.901 2.669 ( -1.631 0.869 -0.879) 2.046 2.793 ( 0.631 -1.517 0.938) 1.892 3.009 ( 0.797 -0.914 0.990) 1.566 3.036 ( -1.289 0.577 -0.738) 1.594 3.183 ( -2.145 -1.375 -0.102) 2.550 3.293 ( -3.377 0.326 -0.894) 3.509 3.476 ( -1.724 -1.065 -1.753) 2.679 4.043 ( 2.578 0.000 0.115) 2.580 4.347 ( -3.980 7.664 2.156) 8.901 4.951 ( 6.774 -3.156 1.290) 7.583 5.593 ( -10.123 -10.893 1.573) 14.953 8.456 ( 3.170 8.572 -3.045) 9.633 9.305 ( 8.765 -9.666 -6.442) 14.552 10.077 ( -5.531 11.335 12.465) 17.733 11.399 ( -7.794 -3.391 -7.341) 11.232 14.853 ( 1.128 8.650 -2.193) 8.995 15.084 ( -8.606 9.504 -6.428) 14.343 15.420 ( 1.369 -3.716 6.339) 7.474 15.628 ( 9.518 -4.098 -1.939) 10.543 16.830 ( 5.220 2.784 3.548) 6.898 17.366 ( 7.625 -9.294 -1.564) 12.123 17.608 ( -8.047 8.481 2.546) 11.965 18.106 ( -1.928 -4.409 -1.234) 4.968 ======================= Grid point 535 (275/306) ======================= q-point: (-0.40 0.20 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 552 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.245 ( -1.297 1.571 1.679) 2.640 1.315 ( 7.156 8.781 0.930) 11.366 1.410 ( 3.094 2.669 4.619) 6.167 1.576 ( 4.395 0.175 1.274) 4.579 1.892 ( 4.991 5.224 -2.438) 7.625 2.252 ( 0.670 1.840 -0.543) 2.032 2.446 ( -1.258 2.407 -0.096) 2.718 2.605 ( -2.643 2.846 -1.741) 4.257 2.802 ( -0.936 0.412 -0.277) 1.059 2.973 ( -3.412 1.281 -1.971) 4.143 3.003 ( -3.124 -0.517 0.103) 3.168 3.147 ( -4.699 -2.774 -1.746) 5.729 3.313 ( 3.266 -1.456 1.191) 3.769 3.455 ( -2.163 -2.537 -0.840) 3.438 4.057 ( 1.445 3.075 1.026) 3.549 4.221 ( -2.601 7.660 0.802) 8.129 5.184 ( 13.286 -10.118 0.293) 16.703 5.624 ( -10.013 -10.890 2.484) 15.001 8.389 ( 1.683 6.077 3.259) 7.098 9.435 ( 6.006 -7.033 -11.820) 15.008 9.990 ( -1.655 12.010 12.677) 17.541 11.237 ( -9.891 -2.492 -9.217) 13.748 14.675 ( -4.166 10.787 -3.716) 12.146 14.779 ( -6.283 12.049 -7.130) 15.346 15.514 ( 0.744 -1.084 5.019) 5.189 15.770 ( 5.731 -3.546 -1.162) 6.839 16.921 ( 4.848 1.768 6.296) 8.141 17.436 ( -6.469 7.064 1.136) 9.646 17.572 ( 8.404 -8.081 0.707) 11.680 18.107 ( -2.822 -4.138 -2.780) 5.728 ======================= Grid point 536 (276/306) ======================= q-point: (-0.30 0.20 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.203 ( -2.158 4.662 2.321) 5.637 1.263 ( 1.958 4.436 -0.946) 4.940 1.552 ( 5.466 0.550 7.973) 9.682 1.634 ( 5.370 2.166 2.354) 6.251 1.854 ( 5.991 5.904 -3.946) 9.291 2.183 ( -6.815 3.490 -2.096) 7.938 2.373 ( -0.994 6.122 1.660) 6.420 2.521 ( -1.644 0.868 -3.557) 4.013 2.789 ( 0.449 -1.077 -0.485) 1.264 2.895 ( -3.566 0.363 -1.884) 4.049 2.992 ( -1.844 -1.989 0.849) 2.842 3.108 ( -2.314 -1.127 -2.378) 3.504 3.385 ( 1.980 -1.703 2.114) 3.360 3.467 ( -1.389 -3.493 -0.237) 3.766 4.026 ( -0.267 5.351 1.716) 5.626 4.108 ( -0.355 7.461 -1.374) 7.594 5.489 ( 13.424 -11.988 -1.404) 18.052 5.668 ( -9.788 -11.468 2.722) 15.321 8.431 ( 0.369 3.389 12.409) 12.869 9.302 ( -0.069 0.422 -22.063) 22.068 10.103 ( 6.233 5.328 18.727) 20.443 11.003 ( -10.884 0.626 -11.999) 16.212 14.431 ( -7.640 11.594 -0.960) 13.918 14.495 ( -0.770 13.091 -7.726) 15.221 15.592 ( 3.023 0.041 3.951) 4.975 15.802 ( -1.459 0.290 -1.515) 2.123 17.032 ( 2.936 0.916 7.450) 8.059 17.313 ( -2.163 3.571 -1.575) 4.462 17.779 ( 8.090 -6.067 2.020) 10.312 18.077 ( -4.267 -3.973 -3.752) 6.933 ======================= Grid point 537 (277/306) ======================= q-point: (-0.20 0.20 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 552 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.166 ( -1.414 2.444 4.286) 5.133 1.235 ( 0.527 0.770 -1.775) 2.005 1.605 ( -3.009 3.607 6.497) 8.018 1.725 ( 4.709 -0.252 -3.307) 5.760 1.861 ( 13.569 6.990 2.176) 15.418 1.951 ( -12.712 5.120 -4.808) 14.524 2.359 ( 3.209 3.351 3.082) 5.570 2.445 ( -1.957 1.086 -4.919) 5.404 2.827 ( 0.433 -2.105 0.716) 2.265 2.846 ( -1.375 -0.931 -0.862) 1.871 3.013 ( -1.791 -1.280 2.356) 3.224 3.072 ( 0.918 -0.296 -2.972) 3.125 3.448 ( 0.918 -1.194 2.503) 2.921 3.485 ( -1.157 -2.419 -0.995) 2.860 3.965 ( -1.179 5.390 1.447) 5.704 4.000 ( 0.672 6.880 -1.866) 7.160 5.710 ( -8.427 -11.079 2.762) 14.191 5.768 ( 8.942 -11.147 -2.803) 14.562 8.570 ( -2.882 1.741 20.070) 20.350 9.044 ( 3.344 0.423 -24.720) 24.949 10.336 ( 3.029 3.951 20.290) 20.892 10.709 ( -5.761 3.490 -15.413) 16.820 14.209 ( -5.373 10.760 1.545) 12.126 14.281 ( 3.645 12.384 -5.341) 13.970 15.673 ( 4.653 0.962 2.618) 5.425 15.715 ( -5.111 2.998 -1.313) 6.069 17.123 ( -0.057 0.667 7.260) 7.290 17.254 ( 1.918 0.346 -5.060) 5.422 17.956 ( 5.990 -3.980 2.498) 7.613 18.022 ( -5.231 -3.952 -3.935) 7.647 ======================= Grid point 538 (278/306) ======================= q-point: (-0.10 0.20 -0.55) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.176 ( -2.234 -0.855 0.171) 2.398 1.244 ( 2.865 -2.242 0.183) 3.642 1.557 ( -5.963 4.815 4.047) 8.667 1.668 ( -10.460 4.402 -5.713) 12.706 1.715 ( 5.090 1.724 -4.737) 7.163 2.024 ( 13.508 3.566 3.734) 14.461 2.329 ( -3.046 2.432 -6.365) 7.464 2.423 ( 3.732 0.966 5.037) 6.343 2.819 ( -3.454 -1.899 0.535) 3.977 2.885 ( 1.919 -1.064 0.540) 2.259 3.017 ( -1.782 -0.709 1.588) 2.490 3.092 ( 3.932 0.090 -0.833) 4.020 3.463 ( -1.626 0.079 -1.723) 2.370 3.488 ( 0.226 0.857 2.140) 2.316 3.910 ( -0.416 3.305 0.947) 3.463 3.935 ( 1.873 3.847 -0.150) 4.282 5.750 ( -10.486 -11.213 1.407) 15.416 5.944 ( 5.116 -6.642 -2.311) 8.697 8.697 ( -7.375 -1.106 10.036) 12.504 8.898 ( 9.258 0.681 -9.880) 13.557 10.316 ( -12.752 1.543 -6.400) 14.351 10.658 ( 13.364 6.299 9.390) 17.506 14.085 ( 0.248 8.306 3.645) 9.074 14.175 ( 7.699 10.162 -1.124) 12.798 15.588 ( -5.521 3.032 -0.615) 6.329 15.753 ( 6.462 1.482 0.611) 6.658 17.164 ( -2.218 -0.526 2.367) 3.286 17.227 ( 2.759 0.396 -4.640) 5.412 17.957 ( -6.030 -4.021 -3.107) 7.886 18.083 ( 3.427 -1.965 2.355) 4.599 ======================= Grid point 542 (279/306) ======================= q-point: ( 0.30 0.30 -0.55) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 305 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.165 ( 2.978 -0.000 1.186) 3.205 1.187 ( 7.976 -0.000 1.143) 8.057 1.528 ( -2.193 0.000 1.604) 2.717 1.638 ( 6.356 -0.000 -7.994) 10.212 2.009 ( 2.036 -0.000 2.009) 2.860 2.147 ( 15.361 -0.000 0.735) 15.378 2.387 ( 1.569 -0.000 -0.599) 1.679 2.707 ( -1.623 0.000 -1.201) 2.019 2.714 ( 1.359 -0.000 0.706) 1.532 2.960 ( 0.242 -0.000 -0.488) 0.545 3.032 ( 0.565 -0.000 -0.464) 0.731 3.217 ( -1.821 0.000 0.621) 1.924 3.357 ( -4.130 0.000 2.119) 4.642 3.474 ( 0.188 -0.000 -0.327) 0.377 3.979 ( 2.686 -0.000 -0.147) 2.690 4.420 ( 6.944 -0.000 2.573) 7.405 5.275 ( -16.380 0.000 0.889) 16.405 5.276 ( -9.787 0.000 -1.144) 9.853 8.676 ( 9.185 -0.000 1.815) 9.363 9.086 ( 3.856 -0.000 -21.588) 21.930 10.155 ( -4.277 0.000 24.574) 24.943 11.478 ( -5.415 0.000 -4.388) 6.970 14.988 ( 10.556 -0.000 6.525) 12.410 15.079 ( 10.534 -0.000 6.619) 12.441 15.432 ( -6.702 0.000 -4.180) 7.898 15.536 ( 2.276 -0.000 -7.494) 7.832 16.849 ( 4.709 -0.000 1.285) 4.882 17.073 ( 5.833 -0.000 -6.867) 9.010 17.941 ( 0.294 -0.000 1.927) 1.949 17.951 ( -9.549 0.000 1.582) 9.679 ======================= Grid point 543 (280/306) ======================= q-point: ( 0.40 0.30 -0.55) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.225 ( 3.492 0.623 2.816) 4.528 1.313 ( 6.864 -0.297 3.769) 7.836 1.529 ( 2.761 2.686 1.356) 4.084 1.607 ( 3.504 2.024 -5.804) 7.076 2.035 ( 3.314 3.398 1.559) 4.997 2.289 ( 6.824 1.919 -0.612) 7.115 2.421 ( 2.574 -2.855 -1.559) 4.148 2.679 ( -0.935 0.187 -0.505) 1.079 2.742 ( 0.763 -1.779 -0.020) 1.936 2.983 ( 1.767 -0.794 1.343) 2.358 3.034 ( 0.279 -0.238 -0.669) 0.763 3.167 ( -5.036 -0.064 -1.616) 5.290 3.323 ( -4.008 1.173 2.057) 4.656 3.456 ( -0.595 -0.531 -3.101) 3.202 4.027 ( 4.994 -0.731 -0.510) 5.073 4.497 ( 2.175 3.215 2.476) 4.604 5.010 ( -6.895 7.961 2.033) 10.726 5.294 ( -10.975 -12.669 1.388) 16.819 8.714 ( 6.726 11.571 -3.173) 13.755 9.036 ( 7.860 -11.652 -10.415) 17.493 10.304 ( -7.137 5.690 20.482) 22.423 11.316 ( -7.495 -2.464 -11.404) 13.867 15.066 ( 3.413 8.376 0.620) 9.066 15.241 ( -1.071 -3.029 -1.592) 3.586 15.348 ( 2.980 4.079 2.466) 5.621 15.512 ( 3.186 -5.522 -3.560) 7.302 16.931 ( 8.500 5.110 2.819) 10.310 17.147 ( 7.641 -7.678 -2.518) 11.121 17.794 ( -9.063 6.059 1.311) 10.980 17.987 ( -2.957 -4.717 0.321) 5.577 ======================= Grid point 544 (281/306) ======================= q-point: ( 0.50 0.30 -0.55) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.282 ( 1.709 1.472 3.059) 3.801 1.440 ( 5.669 0.796 6.162) 8.410 1.516 ( 4.319 5.533 -5.032) 8.637 1.603 ( 4.857 1.972 2.273) 5.713 2.040 ( 4.583 5.329 -0.053) 7.029 2.298 ( 1.931 2.410 -1.112) 3.282 2.448 ( 1.277 -1.431 -2.369) 3.049 2.660 ( -0.777 1.167 -0.162) 1.411 2.775 ( -0.236 -2.804 -0.085) 2.815 2.976 ( -6.497 0.874 -2.537) 7.029 3.033 ( -1.357 0.621 1.255) 1.949 3.086 ( -3.263 -1.612 -2.137) 4.220 3.298 ( 0.132 0.431 1.399) 1.470 3.414 ( -1.972 -0.924 -2.330) 3.189 4.102 ( 6.563 0.524 -0.068) 6.585 4.426 ( -4.257 8.251 2.431) 9.597 5.007 ( 5.818 -3.534 1.634) 7.000 5.334 ( -10.818 -12.071 2.513) 16.402 8.602 ( 5.620 10.725 -2.122) 12.293 9.212 ( 7.725 -10.727 -6.079) 14.550 10.287 ( -7.417 10.931 14.032) 19.272 11.138 ( -7.611 -5.002 -11.887) 14.975 14.935 ( -4.122 9.847 -0.898) 10.713 15.072 ( -0.481 10.997 -8.663) 14.008 15.450 ( -1.562 -3.920 7.698) 8.779 15.647 ( 8.032 -6.180 -2.290) 10.390 17.003 ( 7.919 4.857 3.575) 9.954 17.363 ( 10.289 -8.580 1.286) 13.459 17.609 ( -9.271 6.498 0.417) 11.330 17.992 ( -4.718 -4.872 -1.441) 6.934 ======================= Grid point 545 (282/306) ======================= q-point: ( 0.60 0.30 -0.55) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.293 ( -0.216 3.320 2.857) 4.385 1.421 ( 1.256 6.339 -4.152) 7.681 1.570 ( 3.536 0.757 7.390) 8.227 1.678 ( 6.778 2.098 1.394) 7.231 2.027 ( 7.892 7.086 -1.313) 10.687 2.258 ( -2.284 2.674 -1.244) 3.730 2.454 ( 1.132 0.007 -0.961) 1.486 2.598 ( -4.045 4.630 -1.144) 6.254 2.777 ( -2.698 0.157 -0.862) 2.837 2.836 ( -6.226 -4.434 -3.886) 8.575 2.998 ( -2.235 2.054 1.647) 3.454 3.071 ( -0.469 -1.340 -1.797) 2.290 3.341 ( 1.736 -1.831 1.253) 2.818 3.393 ( -1.698 -2.003 -0.419) 2.659 4.154 ( 4.478 4.243 1.494) 6.347 4.296 ( -2.743 7.620 0.526) 8.116 5.210 ( 10.761 -9.993 -0.631) 14.699 5.374 ( -11.138 -11.682 3.065) 16.430 8.576 ( 4.811 8.054 6.850) 11.616 9.260 ( 1.516 -4.239 -15.071) 15.729 10.262 ( -0.868 7.461 15.678) 17.385 10.970 ( -7.781 -3.151 -11.602) 14.321 14.726 ( -7.579 11.910 1.361) 14.183 14.831 ( 2.485 13.538 -9.047) 16.471 15.556 ( -1.160 -3.054 7.105) 7.820 15.758 ( 4.153 -3.811 -3.610) 6.694 17.090 ( 6.544 3.718 5.209) 9.153 17.426 ( -7.017 5.297 -1.403) 8.903 17.614 ( 10.468 -7.159 2.369) 12.901 17.960 ( -6.499 -5.233 -2.844) 8.815 ======================= Grid point 546 (283/306) ======================= q-point: (-0.30 0.30 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.262 ( -1.761 4.678 2.874) 5.766 1.317 ( 0.509 5.339 -2.655) 5.984 1.647 ( -1.776 0.683 5.666) 5.977 1.730 ( 4.673 0.777 -2.108) 5.185 2.055 ( 10.241 7.944 0.877) 12.991 2.099 ( -9.630 6.220 -2.885) 11.821 2.440 ( -0.487 2.934 1.451) 3.309 2.489 ( 0.756 2.257 -3.314) 4.080 2.772 ( 0.056 -2.297 0.848) 2.449 2.805 ( -2.178 -2.766 -2.281) 4.195 2.993 ( -0.664 0.163 3.096) 3.171 3.056 ( 0.415 -0.744 -2.843) 2.968 3.396 ( 0.385 -2.586 1.094) 2.834 3.408 ( -0.630 -2.862 -0.088) 2.932 4.129 ( -1.077 7.106 2.955) 7.771 4.186 ( 1.421 7.342 -2.312) 7.827 5.410 ( -12.308 -12.662 3.680) 18.037 5.479 ( 12.263 -11.566 -2.871) 17.100 8.661 ( 0.695 5.473 16.110) 17.028 9.065 ( 1.104 0.917 -22.122) 22.168 10.410 ( -1.834 2.031 19.747) 19.935 10.766 ( -1.797 1.090 -14.493) 14.645 14.506 ( -6.707 12.881 3.539) 14.947 14.617 ( 5.362 14.290 -7.028) 16.804 15.656 ( 0.297 -2.519 5.757) 6.290 15.757 ( -1.121 0.009 -3.842) 4.002 17.174 ( 3.050 3.468 6.143) 7.685 17.289 ( -1.240 2.497 -4.561) 5.346 17.839 ( 8.427 -5.431 2.567) 10.349 17.902 ( -7.648 -5.628 -3.570) 10.145 ======================= Grid point 547 (284/306) ======================= q-point: (-0.20 -0.70 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.217 ( -2.039 3.352 3.108) 5.005 1.247 ( 0.317 3.096 -1.757) 3.574 1.636 ( -4.392 1.393 2.275) 5.138 1.713 ( -3.543 0.468 -6.453) 7.376 1.825 ( -6.534 6.802 -1.434) 9.541 2.144 ( 10.496 5.199 1.647) 11.828 2.412 ( -0.169 3.176 -1.734) 3.622 2.465 ( 4.125 3.236 0.889) 5.318 2.778 ( -2.524 -1.476 0.447) 2.958 2.853 ( 3.278 -1.926 1.515) 4.092 3.008 ( -1.395 0.186 1.111) 1.793 3.074 ( 4.016 -1.533 -0.370) 4.315 3.418 ( -2.141 -3.021 -0.825) 3.793 3.456 ( 1.040 -2.681 0.947) 3.027 4.039 ( -2.404 6.229 1.178) 6.780 4.096 ( 2.452 8.373 -0.946) 8.776 5.445 ( -12.824 -12.787 2.711) 18.312 5.727 ( 9.802 -10.530 -3.017) 14.699 8.699 ( -8.537 1.198 0.144) 8.622 8.943 ( 10.673 3.017 -1.041) 11.140 10.366 ( -16.839 2.135 -1.905) 17.080 10.777 ( 15.348 3.038 5.183) 16.482 14.340 ( -2.672 11.953 5.362) 13.370 14.471 ( 8.302 13.399 -3.278) 16.100 15.664 ( -4.133 2.598 -2.754) 5.605 15.749 ( 1.423 -2.096 3.498) 4.319 17.161 ( -2.921 0.411 -2.524) 3.883 17.273 ( 6.039 3.454 0.097) 6.958 17.832 ( -8.324 -5.974 -3.226) 10.742 18.012 ( 5.541 -3.688 2.434) 7.087 ======================= Grid point 548 (285/306) ======================= q-point: (-0.10 0.30 -0.55) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.155 ( -1.570 3.421 -1.952) 4.241 1.248 ( 0.955 -1.376 0.238) 1.692 1.484 ( -10.047 2.319 -4.601) 11.291 1.589 ( -1.886 1.539 -0.671) 2.525 1.774 ( 2.686 2.304 -1.431) 3.817 2.202 ( 2.996 1.777 -0.494) 3.518 2.337 ( 4.176 7.330 -1.873) 8.641 2.512 ( 2.886 0.432 2.797) 4.042 2.775 ( -1.872 -0.627 1.382) 2.410 2.919 ( 3.171 0.225 1.107) 3.366 3.010 ( -0.504 -0.751 1.370) 1.641 3.148 ( 4.551 0.097 0.876) 4.636 3.402 ( -2.694 -2.012 -2.047) 3.937 3.507 ( 0.419 -1.676 1.343) 2.188 3.967 ( -0.566 4.151 1.229) 4.366 4.032 ( 3.186 6.331 0.462) 7.102 5.460 ( -13.731 -12.717 1.063) 18.745 5.897 ( 4.748 -6.592 -2.461) 8.488 8.552 ( -1.299 -2.361 -12.472) 12.760 9.113 ( 5.197 3.563 16.773) 17.917 10.076 ( -11.459 2.109 -11.059) 16.064 11.014 ( 12.700 3.788 11.611) 17.620 14.274 ( 2.501 9.283 7.021) 11.905 14.431 ( 11.662 11.151 1.023) 16.168 15.555 ( -3.423 2.547 -1.724) 4.602 15.812 ( 0.652 -1.552 0.840) 1.882 17.084 ( -1.766 -1.502 -7.225) 7.588 17.291 ( 4.299 4.927 0.209) 6.542 17.779 ( -7.391 -6.368 -2.073) 9.974 18.120 ( 1.973 -1.782 2.515) 3.660 ======================= Grid point 553 (286/306) ======================= q-point: ( 0.40 0.40 -0.55) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.303 ( 2.049 -0.000 3.905) 4.410 1.442 ( 6.329 -0.000 4.364) 7.687 1.598 ( 3.217 -0.000 -5.265) 6.170 1.631 ( 6.117 -0.000 3.385) 6.991 2.101 ( 2.161 -0.000 1.403) 2.576 2.365 ( 3.665 -0.000 -2.896) 4.671 2.404 ( 1.798 -0.000 -1.663) 2.449 2.672 ( 0.110 -0.000 0.287) 0.307 2.725 ( -0.452 0.000 -0.882) 0.991 2.995 ( -5.742 0.000 0.034) 5.742 3.029 ( 0.420 -0.000 -0.686) 0.805 3.071 ( -2.191 0.000 -2.283) 3.164 3.312 ( -3.861 0.000 3.185) 5.005 3.402 ( -0.495 0.000 -4.230) 4.259 4.103 ( 9.026 -0.000 -0.818) 9.063 4.549 ( -1.786 0.000 1.090) 2.093 5.020 ( -11.616 0.000 7.958) 14.080 5.108 ( -0.600 0.000 -1.565) 1.676 8.845 ( 9.612 -0.000 -13.195) 16.325 8.971 ( 5.473 -0.000 4.596) 7.146 10.446 ( -11.494 0.000 18.874) 22.099 11.054 ( -4.801 0.000 -16.838) 17.509 15.095 ( -6.810 0.000 0.260) 6.815 15.234 ( 7.403 -0.000 -9.706) 12.207 15.388 ( -5.876 0.000 6.740) 8.941 15.523 ( 9.037 -0.000 -0.219) 9.040 17.140 ( 7.168 -0.000 -1.271) 7.280 17.179 ( 13.138 -0.000 5.239) 14.144 17.712 ( -10.325 0.000 -0.567) 10.341 17.909 ( -5.169 0.000 -0.205) 5.173 ======================= Grid point 554 (287/306) ======================= q-point: ( 0.50 0.40 -0.55) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.354 ( 0.004 1.322 4.369) 4.564 1.521 ( 3.511 1.398 -4.102) 5.577 1.600 ( 2.402 1.679 5.278) 6.037 1.737 ( 6.925 1.898 1.615) 7.359 2.138 ( 3.743 1.565 1.232) 4.240 2.330 ( 0.541 2.757 -3.000) 4.110 2.424 ( 1.981 -1.527 -1.222) 2.784 2.676 ( -0.061 1.612 -0.317) 1.644 2.715 ( -1.718 -2.961 -1.814) 3.874 2.825 ( -10.996 1.400 -3.471) 11.616 3.031 ( 0.604 0.216 -0.302) 0.709 3.063 ( -0.980 0.564 0.444) 1.215 3.307 ( -2.056 -0.645 2.693) 3.449 3.365 ( 0.063 -0.563 -2.409) 2.475 4.219 ( 10.707 1.153 -0.352) 10.775 4.463 ( -6.610 4.833 0.289) 8.193 5.021 ( -3.757 -4.861 6.304) 8.803 5.143 ( -0.381 -5.634 -1.085) 5.750 8.801 ( 9.384 9.067 -1.871) 13.182 9.101 ( 1.455 -7.682 -4.033) 8.797 10.437 ( -11.880 5.348 15.379) 20.155 10.872 ( -0.622 -3.608 -14.608) 15.060 14.978 ( -6.836 7.056 2.414) 10.117 15.117 ( 3.561 8.042 -10.252) 13.508 15.459 ( -3.816 -3.733 9.173) 10.613 15.639 ( 7.446 -4.508 -4.076) 9.612 17.201 ( 8.428 4.524 2.493) 9.885 17.444 ( 12.611 -5.735 3.731) 14.347 17.548 ( -9.467 3.715 -1.692) 10.309 17.840 ( -8.066 -3.648 -1.793) 9.032 ======================= Grid point 555 (288/306) ======================= q-point: (-0.40 -0.60 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 552 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.365 ( -1.660 3.060 4.285) 5.521 1.450 ( 0.225 4.425 -4.136) 6.061 1.672 ( -0.240 1.490 5.882) 6.072 1.765 ( 3.010 2.043 -2.831) 4.609 2.196 ( 6.336 2.583 1.402) 6.985 2.237 ( -4.742 4.671 -2.491) 7.107 2.477 ( 2.265 -0.138 2.008) 3.030 2.546 ( -4.974 1.571 -4.295) 6.757 2.729 ( -0.069 -0.856 0.127) 0.868 2.737 ( -1.025 -1.505 -0.630) 1.927 3.021 ( -0.720 1.671 1.202) 2.181 3.048 ( 0.701 0.170 -1.342) 1.524 3.332 ( -1.859 -2.205 2.016) 3.519 3.364 ( 1.307 -1.043 -1.129) 2.017 4.287 ( -0.032 5.299 2.047) 5.681 4.333 ( 1.509 4.208 -2.246) 5.002 5.123 ( -9.250 -9.665 6.204) 14.747 5.232 ( 8.831 -7.768 -4.030) 12.433 8.820 ( 2.176 6.945 8.503) 11.192 9.064 ( 1.728 -1.517 -14.449) 14.631 10.443 ( -10.598 0.795 17.900) 20.817 10.769 ( 4.743 -0.554 -13.451) 14.273 14.814 ( -7.051 11.321 4.878) 14.201 14.949 ( 5.744 11.638 -8.013) 15.252 15.558 ( -4.246 -4.905 8.157) 10.422 15.709 ( 4.186 -3.612 -6.107) 8.238 17.283 ( 6.148 4.884 4.433) 9.017 17.370 ( -5.251 3.670 -3.628) 7.363 17.699 ( 10.913 -5.562 2.796) 12.564 17.759 ( -9.827 -5.523 -2.996) 11.664 ======================= Grid point 556 (289/306) ======================= q-point: (-0.30 -0.60 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.316 ( -4.032 4.533 1.709) 6.303 1.366 ( 0.160 4.906 -0.024) 4.909 1.659 ( -4.617 1.349 1.375) 5.003 1.725 ( -1.175 0.692 -5.105) 5.284 2.021 ( -9.506 8.322 -0.866) 12.664 2.246 ( 4.639 2.785 -0.114) 5.411 2.438 ( -2.370 -0.396 0.311) 2.423 2.587 ( 8.324 4.714 -0.057) 9.567 2.746 ( 1.229 -1.425 1.975) 2.728 2.778 ( 2.136 -3.212 1.227) 4.048 3.028 ( 0.491 0.037 2.294) 2.346 3.038 ( 1.933 0.505 -2.144) 2.931 3.347 ( -2.572 -2.392 0.600) 3.563 3.395 ( 1.731 -1.880 -0.264) 2.569 4.172 ( -5.817 3.949 0.005) 7.031 4.310 ( 5.386 8.353 -1.106) 10.001 5.159 ( -11.658 -9.512 4.054) 15.583 5.449 ( 11.638 -11.471 -3.804) 16.778 8.747 ( -10.699 2.432 -3.328) 11.466 9.032 ( 11.181 3.631 0.280) 11.759 10.415 ( -16.303 1.928 6.102) 17.514 10.805 ( 14.589 -0.615 -0.700) 14.619 14.650 ( -5.130 12.700 6.760) 15.274 14.808 ( 8.141 13.171 -5.100) 16.302 15.650 ( -4.267 -5.443 6.341) 9.383 15.695 ( 0.253 -0.585 -5.775) 5.810 17.193 ( -5.797 2.291 -3.767) 7.284 17.384 ( 9.310 5.128 1.915) 10.800 17.672 ( -10.449 -6.743 -3.262) 12.857 17.907 ( 7.751 -4.668 2.282) 9.332 ======================= Grid point 557 (290/306) ======================= q-point: (-0.20 -0.60 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 552 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.243 ( -3.443 1.623 2.107) 4.351 1.297 ( -1.726 6.696 0.658) 6.946 1.550 ( -8.330 2.108 -7.015) 11.093 1.603 ( -4.640 0.446 -1.081) 4.785 1.867 ( -1.253 5.747 0.083) 5.883 2.250 ( 1.382 1.858 -0.571) 2.386 2.435 ( -0.117 0.175 0.627) 0.661 2.590 ( 4.131 4.787 -0.334) 6.332 2.783 ( 1.737 1.401 1.471) 2.673 2.903 ( 4.073 -2.194 3.849) 6.018 3.022 ( 1.744 2.026 -0.665) 2.754 3.109 ( 4.921 -3.021 1.541) 5.976 3.337 ( -3.885 -2.544 -0.828) 4.717 3.443 ( 1.480 -2.510 0.382) 2.939 4.068 ( -3.378 3.246 -0.002) 4.685 4.239 ( 4.018 9.711 -1.008) 10.557 5.165 ( -12.634 -10.278 2.215) 16.436 5.684 ( 9.520 -10.419 -3.214) 14.475 8.540 ( -5.162 1.385 -9.225) 10.661 9.174 ( 5.077 0.957 10.317) 11.538 10.185 ( -11.416 6.806 -3.947) 13.865 11.046 ( 12.828 -1.474 7.912) 15.143 14.536 ( -1.691 11.599 7.961) 14.169 14.728 ( 10.599 12.533 -1.181) 16.456 15.613 ( -2.026 1.680 -4.383) 5.112 15.721 ( -4.943 -5.508 3.746) 8.295 17.064 ( -3.552 0.004 -6.758) 7.635 17.440 ( 8.701 6.743 0.578) 11.023 17.603 ( -9.728 -7.734 -2.326) 12.644 18.055 ( 4.078 -3.427 2.199) 5.763 ======================= Grid point 558 (291/306) ======================= q-point: (-0.10 -0.60 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.157 ( -4.351 6.026 -3.275) 8.123 1.245 ( -1.517 -1.793 2.809) 3.661 1.380 ( -2.066 3.112 -4.229) 5.643 1.552 ( -2.689 -1.710 -1.465) 3.507 1.801 ( -0.876 2.813 -0.894) 3.079 2.219 ( -0.506 2.297 -1.212) 2.646 2.438 ( 1.875 1.806 0.198) 2.611 2.592 ( 3.109 2.797 1.327) 4.388 2.794 ( 0.748 1.470 0.995) 1.926 2.984 ( 2.844 0.466 1.691) 3.342 3.020 ( 0.888 0.827 0.438) 1.290 3.211 ( 2.739 -0.450 0.624) 2.845 3.315 ( -1.972 -3.069 -0.364) 3.666 3.498 ( 0.789 -2.454 0.939) 2.743 4.012 ( -0.857 2.472 0.818) 2.741 4.175 ( 5.212 7.914 -0.177) 9.477 5.144 ( -13.667 -10.637 0.088) 17.319 5.850 ( 4.809 -6.314 -2.323) 8.270 8.408 ( 0.269 -0.656 -8.254) 8.285 9.344 ( 0.013 -3.116 12.325) 12.713 9.914 ( -5.698 9.442 -6.755) 12.932 11.295 ( 10.221 0.086 8.812) 13.495 14.504 ( 2.048 8.513 8.444) 12.164 14.744 ( 13.329 10.412 2.922) 17.164 15.527 ( -1.547 1.723 -2.590) 3.474 15.735 ( -7.234 -5.069 0.087) 8.833 16.952 ( -2.286 -1.306 -8.643) 9.035 17.440 ( 7.075 8.250 -1.690) 10.999 17.580 ( -7.476 -8.414 -0.290) 11.260 18.142 ( 0.957 -1.804 2.258) 3.045 ======================= Grid point 564 (292/306) ======================= q-point: (-0.50 -0.50 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 305 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.402 ( -2.188 0.000 5.206) 5.647 1.505 ( 0.801 -0.000 -4.950) 5.014 1.700 ( 0.665 -0.000 6.239) 6.274 1.801 ( 1.803 -0.000 -3.118) 3.602 2.217 ( 4.003 -0.000 2.762) 4.863 2.294 ( -1.733 0.000 -4.696) 5.006 2.465 ( 4.788 -0.000 3.366) 5.853 2.554 ( -9.709 0.000 -4.994) 10.918 2.728 ( 3.616 -0.000 0.069) 3.617 2.730 ( -3.553 0.000 -0.140) 3.556 3.051 ( -2.181 0.000 0.129) 2.184 3.053 ( 2.417 -0.000 -0.070) 2.418 3.300 ( -2.717 0.000 2.910) 3.982 3.351 ( 1.842 -0.000 -1.987) 2.709 4.370 ( 12.024 -0.000 -0.577) 12.038 4.376 ( -10.152 0.000 -1.196) 10.222 4.991 ( -6.625 0.000 8.484) 10.764 5.131 ( 6.269 -0.000 -4.856) 7.929 8.966 ( -9.244 0.000 -1.427) 9.354 8.990 ( 14.408 -0.000 -3.893) 14.925 10.453 ( -16.221 0.000 16.430) 23.088 10.758 ( 8.956 -0.000 -12.888) 15.694 14.985 ( -5.925 0.000 4.727) 7.579 15.111 ( 3.244 -0.000 -7.080) 7.788 15.477 ( -4.666 0.000 8.100) 9.348 15.638 ( 6.469 -0.000 -6.715) 9.324 17.366 ( 8.904 -0.000 2.954) 9.381 17.429 ( -9.229 0.000 -2.567) 9.579 17.611 ( 12.613 -0.000 3.119) 12.993 17.673 ( -10.676 0.000 -2.831) 11.045 ======================= Grid point 565 (293/306) ======================= q-point: (-0.40 -0.50 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.408 ( -4.310 2.256 4.012) 6.306 1.442 ( -1.593 1.202 -2.210) 2.978 1.714 ( -3.886 2.458 -0.378) 4.614 1.742 ( -2.372 0.280 -2.852) 3.720 2.185 ( -4.646 3.861 -3.159) 6.817 2.282 ( 2.176 0.397 1.350) 2.592 2.420 ( -5.264 -0.432 -0.891) 5.356 2.614 ( 7.399 -2.139 5.127) 9.252 2.698 ( -1.712 -0.173 -0.164) 1.728 2.780 ( 5.714 1.168 0.816) 5.889 3.024 ( -1.406 0.305 0.313) 1.472 3.075 ( 2.352 1.021 -0.533) 2.619 3.307 ( -2.244 -0.796 2.387) 3.371 3.363 ( 2.537 -0.772 -1.568) 3.081 4.226 ( -9.892 0.742 -1.057) 9.976 4.474 ( 8.985 4.058 -0.860) 9.897 5.016 ( -6.041 -1.872 5.706) 8.518 5.203 ( 9.120 -7.130 -5.477) 12.807 8.799 ( -12.315 1.334 -1.579) 12.487 9.098 ( 10.669 1.477 -4.026) 11.499 10.459 ( -12.860 1.300 17.413) 21.686 10.770 ( 12.128 -1.381 -9.130) 15.244 14.926 ( -5.741 8.196 7.354) 12.418 15.063 ( 5.794 5.794 -4.879) 9.537 15.517 ( -6.424 -3.882 7.032) 10.285 15.644 ( 4.390 -2.644 -8.250) 9.712 17.266 ( -8.146 2.986 -3.291) 9.279 17.487 ( 3.255 0.780 2.147) 3.977 17.532 ( -5.219 -2.125 -2.917) 6.346 17.802 ( 9.829 -3.104 1.921) 10.485 ======================= Grid point 566 (294/306) ======================= q-point: (-0.30 -0.50 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.315 ( -5.743 3.436 0.334) 6.701 1.414 ( -3.010 1.901 3.165) 4.763 1.584 ( -6.388 1.744 -5.831) 8.824 1.646 ( -5.709 2.292 -1.992) 6.467 2.043 ( -3.158 7.391 -0.249) 8.041 2.286 ( 0.111 1.196 -0.416) 1.272 2.406 ( -1.540 -1.959 1.402) 2.859 2.662 ( 0.214 1.387 -0.420) 1.465 2.766 ( 1.070 -4.125 1.010) 4.380 2.887 ( 8.864 2.133 5.096) 10.445 3.039 ( 1.821 -2.034 1.589) 3.159 3.072 ( 1.179 1.070 -1.429) 2.139 3.303 ( -2.169 0.220 0.934) 2.372 3.398 ( 2.587 -1.392 -0.457) 2.973 4.106 ( -6.883 0.017 -0.583) 6.907 4.472 ( 5.783 8.040 -1.949) 10.094 5.001 ( -7.065 -2.130 2.576) 7.815 5.403 ( 10.980 -11.791 -4.048) 16.612 8.608 ( -9.240 3.554 -2.314) 10.167 9.153 ( 2.506 -2.296 -1.003) 3.544 10.405 ( -5.478 10.533 6.157) 13.374 10.940 ( 10.936 -6.907 3.486) 13.396 14.824 ( -4.842 11.133 8.600) 14.878 15.014 ( 8.577 9.516 -2.492) 13.051 15.557 ( -7.905 -6.320 4.251) 10.977 15.623 ( 1.202 -1.660 -6.446) 6.764 17.093 ( -6.631 2.506 -4.883) 8.607 17.410 ( -11.409 -7.494 -2.890) 13.953 17.599 ( 10.554 5.602 1.267) 12.016 17.962 ( 6.075 -3.743 1.353) 7.263 ======================= Grid point 567 (295/306) ======================= q-point: (-0.20 -0.50 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.221 ( -6.684 0.968 1.783) 6.985 1.345 ( -5.502 7.197 0.407) 9.068 1.421 ( -4.904 -0.852 -3.954) 6.357 1.546 ( -2.870 2.070 -1.292) 3.767 1.917 ( -2.414 6.542 -0.918) 7.033 2.261 ( -0.702 1.045 -0.898) 1.547 2.431 ( -1.029 -1.513 1.732) 2.520 2.653 ( 1.161 1.435 0.605) 1.943 2.805 ( -0.210 -1.686 -0.342) 1.733 2.982 ( 1.904 0.497 3.143) 3.708 3.052 ( -0.492 0.003 -1.437) 1.519 3.161 ( 5.350 -3.047 1.990) 6.471 3.277 ( -0.167 1.179 0.578) 1.324 3.448 ( 2.109 -1.473 0.727) 2.674 4.043 ( -3.314 -0.172 0.098) 3.320 4.400 ( 4.938 9.196 -2.649) 10.769 4.959 ( -7.723 -3.244 0.862) 8.422 5.638 ( 9.356 -10.641 -2.783) 14.440 8.451 ( -3.798 4.096 -2.314) 6.046 9.206 ( -4.354 -7.351 2.300) 8.847 10.229 ( -1.018 15.065 -0.652) 15.113 11.226 ( 10.077 -5.823 8.002) 14.124 14.735 ( -3.043 9.959 8.318) 13.327 15.002 ( 10.763 10.022 1.064) 14.745 15.542 ( -3.655 -3.247 -4.362) 6.551 15.593 ( -7.129 -3.718 1.256) 8.138 16.940 ( -4.681 0.599 -6.659) 8.162 17.359 ( -9.524 -9.005 -0.905) 13.139 17.646 ( 9.690 7.773 -1.074) 12.468 18.076 ( 2.828 -3.390 1.496) 4.661 ======================= Grid point 568 (296/306) ======================= q-point: (-0.10 -0.50 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.108 ( -6.296 3.344 -2.982) 7.727 1.246 ( -2.684 1.109 3.953) 4.905 1.369 ( -2.593 -1.865 -1.972) 3.754 1.490 ( -0.710 2.128 -0.486) 2.295 1.810 ( -2.057 3.594 -1.423) 4.379 2.222 ( -0.906 1.461 -1.335) 2.177 2.455 ( -0.693 -1.164 1.498) 2.020 2.667 ( 1.903 1.401 1.396) 2.745 2.806 ( -0.842 -0.675 -0.753) 1.316 3.003 ( -1.592 -0.551 0.410) 1.734 3.043 ( -0.061 -0.927 -0.102) 0.935 3.188 ( -0.875 0.874 -0.460) 1.319 3.344 ( 5.384 -0.622 2.066) 5.800 3.494 ( 0.403 -1.397 1.077) 1.809 4.022 ( -1.052 -0.006 0.559) 1.191 4.331 ( 4.713 6.941 -2.101) 8.649 4.912 ( -6.321 -3.015 -0.194) 7.005 5.812 ( 5.067 -6.219 -1.517) 8.164 8.366 ( 0.277 2.230 -2.236) 3.170 9.277 ( -6.762 -9.614 3.887) 12.380 10.025 ( 1.298 14.476 -2.182) 14.697 11.468 ( 7.360 -2.315 5.923) 9.727 14.691 ( -1.108 6.276 6.715) 9.258 15.066 ( 12.598 8.260 4.390) 15.691 15.488 ( -2.331 -2.905 -4.665) 5.970 15.536 ( -10.506 -3.312 0.259) 11.018 16.820 ( -2.670 -0.688 -6.770) 7.310 17.375 ( -7.304 -9.688 1.607) 12.239 17.622 ( 7.303 9.190 -3.139) 12.151 18.151 ( 1.279 -2.088 1.464) 2.853 ======================= Grid point 575 (297/306) ======================= q-point: (-0.40 -0.40 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.369 ( -5.019 0.000 -2.583) 5.645 1.423 ( -5.902 0.000 5.489) 8.060 1.615 ( -5.455 0.000 -5.720) 7.904 1.680 ( -5.987 0.000 -1.151) 6.096 2.148 ( -0.422 0.000 -2.931) 2.961 2.315 ( -0.722 0.000 1.789) 1.929 2.366 ( -3.224 0.000 1.386) 3.509 2.679 ( -0.751 0.000 -0.319) 0.816 2.694 ( 1.697 -0.000 2.439) 2.971 2.923 ( 9.447 -0.000 4.899) 10.642 3.014 ( -0.836 0.000 0.593) 1.025 3.074 ( -2.026 0.000 -1.301) 2.408 3.325 ( 0.403 -0.000 3.252) 3.277 3.372 ( 3.264 -0.000 -2.340) 4.016 4.099 ( -8.344 0.000 -0.617) 8.367 4.576 ( 4.132 -0.000 -1.365) 4.352 5.045 ( 0.410 -0.000 4.601) 4.619 5.182 ( 9.372 -0.000 -7.397) 11.939 8.665 ( -11.541 0.000 3.620) 12.096 9.110 ( 1.782 -0.000 -8.662) 8.843 10.622 ( -2.482 0.000 24.515) 24.640 10.771 ( 10.111 -0.000 -12.397) 15.997 15.011 ( -5.776 0.000 9.884) 11.447 15.120 ( 4.605 -0.000 -1.770) 4.933 15.471 ( -6.839 0.000 4.128) 7.989 15.578 ( 3.927 -0.000 -9.577) 10.350 17.158 ( -7.499 0.000 -2.619) 7.943 17.281 ( -12.926 0.000 -4.447) 13.669 17.681 ( 10.573 -0.000 2.254) 10.811 17.903 ( 7.299 -0.000 0.382) 7.309 ======================= Grid point 576 (298/306) ======================= q-point: (-0.30 -0.40 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.261 ( -7.392 1.442 -0.475) 7.547 1.380 ( -7.895 -1.023 0.045) 7.961 1.488 ( -5.942 3.314 0.071) 6.804 1.594 ( -2.831 0.943 -1.781) 3.475 2.084 ( -0.962 5.129 -2.637) 5.847 2.280 ( -3.729 1.020 -0.072) 3.867 2.377 ( -2.425 -2.585 2.350) 4.253 2.671 ( 0.146 0.294 0.185) 0.376 2.732 ( -0.902 -2.629 0.776) 2.885 3.003 ( -0.643 0.742 0.820) 1.280 3.025 ( -2.986 -1.219 -0.975) 3.369 3.102 ( 6.961 -1.224 4.498) 8.378 3.345 ( 2.273 3.178 0.819) 3.991 3.410 ( 2.772 -1.886 -0.001) 3.352 4.021 ( -4.562 -0.884 -0.037) 4.647 4.553 ( -0.800 2.505 -2.639) 3.725 5.032 ( 3.869 8.632 0.513) 9.473 5.345 ( 10.821 -12.261 -3.732) 16.774 8.581 ( -7.545 4.977 6.988) 11.425 9.022 ( -5.106 -6.073 -6.948) 10.546 10.608 ( 4.288 14.300 -4.669) 15.642 11.013 ( 7.624 -10.584 13.618) 18.857 14.974 ( -6.747 8.473 8.699) 13.893 15.174 ( 5.714 1.193 1.134) 5.947 15.417 ( -8.410 -1.858 0.298) 8.618 15.543 ( 1.996 -2.558 -6.714) 7.457 16.996 ( -7.725 4.152 -3.619) 9.487 17.149 ( -10.150 -7.615 -2.269) 12.890 17.803 ( 10.247 4.365 0.523) 11.150 17.991 ( 4.003 -2.940 -0.205) 4.971 ======================= Grid point 577 (299/306) ======================= q-point: (-0.20 -0.40 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 552 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.152 ( -7.730 1.270 0.846) 7.880 1.271 ( -7.932 -2.633 -3.389) 9.019 1.384 ( -6.004 5.999 4.205) 9.472 1.559 ( 0.906 1.617 -0.059) 1.854 1.940 ( -4.537 6.720 -2.317) 8.433 2.228 ( -3.385 -1.411 -1.733) 4.056 2.402 ( -2.876 -2.816 2.125) 4.552 2.682 ( 0.858 0.096 0.768) 1.156 2.751 ( -2.442 -2.835 0.159) 3.745 2.977 ( -2.368 -1.209 -0.732) 2.758 3.021 ( -0.771 -0.265 1.177) 1.432 3.210 ( 3.352 0.143 0.573) 3.403 3.357 ( 4.579 1.898 1.016) 5.060 3.464 ( 1.292 -1.318 0.961) 2.080 3.999 ( -1.988 -1.481 0.174) 2.485 4.458 ( -3.166 2.595 -3.758) 5.557 4.989 ( 6.616 8.965 0.461) 11.152 5.596 ( 9.699 -10.996 -1.690) 14.759 8.491 ( -3.406 7.652 3.269) 8.991 9.023 ( -7.356 -10.880 2.326) 13.338 10.389 ( 2.049 13.998 -9.353) 16.959 11.360 ( 8.511 -6.010 10.130) 14.531 14.863 ( -6.836 7.429 5.393) 11.446 15.255 ( 9.752 5.863 3.511) 11.908 15.318 ( -12.376 -6.772 -3.060) 14.436 15.524 ( -0.841 -0.855 -2.499) 2.772 16.831 ( -5.174 1.953 -4.015) 6.834 17.138 ( -7.922 -9.122 1.321) 12.154 17.829 ( 7.214 7.180 -2.467) 10.473 18.078 ( 3.100 -3.678 0.542) 4.840 ======================= Grid point 578 (300/306) ======================= q-point: (-0.10 -0.40 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.044 ( -6.379 2.418 -0.298) 6.828 1.211 ( -6.789 -6.197 -0.826) 9.229 1.300 ( -5.018 3.926 5.796) 8.614 1.557 ( 2.613 3.395 0.292) 4.294 1.802 ( -3.177 2.909 -1.657) 4.615 2.189 ( -2.219 -1.460 -2.132) 3.406 2.421 ( -3.373 -3.088 1.661) 4.865 2.692 ( -0.397 -0.251 -0.582) 0.748 2.755 ( -1.772 -2.026 0.835) 2.819 2.973 ( -0.002 -0.877 0.403) 0.965 3.024 ( -1.779 -0.647 0.967) 2.126 3.214 ( 1.577 1.747 -1.200) 2.642 3.416 ( 3.825 0.174 -0.246) 3.837 3.492 ( -0.335 -0.881 1.266) 1.579 4.002 ( -1.020 -1.535 0.094) 1.846 4.339 ( -5.216 1.050 -3.927) 6.613 4.995 ( 10.752 9.255 1.498) 14.266 5.793 ( 5.801 -6.112 -0.236) 8.430 8.394 ( -2.036 4.758 -0.257) 5.182 9.142 ( -5.041 -9.591 9.483) 14.399 10.134 ( 0.431 11.024 -10.788) 15.431 11.562 ( 4.309 -1.907 2.714) 5.438 14.753 ( -6.072 3.051 1.434) 6.945 15.168 ( -13.143 -5.122 -5.462) 15.126 15.396 ( 9.093 2.487 5.830) 11.084 15.493 ( -0.135 0.527 -0.864) 1.021 16.739 ( -2.163 0.626 -1.515) 2.714 17.198 ( -6.077 -9.816 3.739) 12.135 17.765 ( 3.997 8.149 -3.617) 9.771 18.161 ( 3.321 -2.227 0.085) 4.000 ======================= Grid point 586 (301/306) ======================= q-point: (-0.30 -0.30 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 305 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.173 ( -7.572 0.000 0.625) 7.598 1.234 ( -10.039 0.000 -2.969) 10.469 1.485 ( -6.458 0.000 6.568) 9.211 1.562 ( 0.594 -0.000 -1.670) 1.773 2.082 ( 0.998 -0.000 -4.808) 4.910 2.161 ( -14.366 0.000 -0.816) 14.390 2.358 ( -1.913 0.000 2.315) 3.003 2.682 ( 0.671 -0.000 0.893) 1.117 2.711 ( -1.313 0.000 0.962) 1.628 2.962 ( -1.406 0.000 -0.618) 1.536 3.019 ( -0.712 0.000 0.848) 1.108 3.209 ( 4.423 -0.000 1.880) 4.805 3.405 ( 3.536 -0.000 -2.377) 4.260 3.428 ( 0.994 -0.000 3.043) 3.202 3.976 ( -2.034 0.000 0.031) 2.035 4.483 ( -6.038 0.000 -3.196) 6.832 5.246 ( 9.368 -0.000 1.875) 9.554 5.326 ( 13.166 -0.000 -3.810) 13.706 8.681 ( -5.261 0.000 16.579) 17.394 8.795 ( -7.051 0.000 -9.315) 11.683 10.603 ( 3.155 -0.000 -18.425) 18.693 11.251 ( 8.687 -0.000 18.162) 20.132 15.006 ( -11.597 0.000 5.426) 12.803 15.159 ( -6.630 0.000 -0.615) 6.658 15.382 ( 2.690 -0.000 0.443) 2.726 15.487 ( 2.046 -0.000 -3.815) 4.329 16.906 ( -7.643 0.000 -3.855) 8.561 16.969 ( -6.977 0.000 2.512) 7.415 17.967 ( 9.748 -0.000 0.159) 9.749 17.982 ( 0.914 -0.000 -2.101) 2.291 ======================= Grid point 587 (302/306) ======================= q-point: (-0.20 -0.30 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.093 ( -8.008 0.241 1.333) 8.121 1.097 ( -8.864 -1.545 -0.030) 8.998 1.431 ( -7.918 4.990 5.970) 11.101 1.583 ( 2.062 -1.012 0.081) 2.298 1.905 ( -10.626 5.057 -1.067) 11.816 2.089 ( -3.686 -5.797 -3.626) 7.768 2.361 ( -2.364 -1.166 1.417) 2.993 2.697 ( -0.226 0.621 -0.123) 0.672 2.718 ( 0.226 -0.939 1.497) 1.782 2.960 ( 0.909 -0.194 0.297) 0.975 3.016 ( -1.251 -0.106 0.759) 1.467 3.241 ( 1.081 0.504 -1.368) 1.815 3.420 ( 3.499 0.233 -1.434) 3.789 3.470 ( 0.111 -0.765 1.482) 1.671 3.965 ( -0.893 -1.029 -0.164) 1.372 4.356 ( -7.536 0.354 -3.623) 8.369 5.276 ( 13.459 12.183 1.178) 18.192 5.583 ( 11.527 -10.371 -0.048) 15.506 8.559 ( -5.645 7.306 -2.346) 9.526 8.903 ( -4.149 -8.673 15.729) 18.435 10.367 ( 0.416 6.117 -19.479) 20.421 11.506 ( 6.074 -1.877 6.473) 9.073 14.842 ( -12.016 3.603 -0.747) 12.567 15.028 ( -14.030 -4.909 -5.818) 15.962 15.461 ( 5.644 2.113 4.015) 7.242 15.495 ( 2.124 -0.550 0.833) 2.347 16.787 ( -2.949 3.062 -0.111) 4.253 16.984 ( -5.792 -6.742 4.990) 10.194 17.924 ( 0.741 4.290 -2.749) 5.149 18.094 ( 6.697 -2.539 -0.687) 7.195 ======================= Grid point 588 (303/306) ======================= q-point: (-0.10 -0.30 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.003 ( -8.116 1.909 3.040) 8.874 1.048 ( -6.954 -4.663 2.431) 8.718 1.349 ( -6.297 2.245 6.329) 9.206 1.604 ( -0.340 1.141 0.228) 1.212 1.778 ( -2.250 1.254 0.168) 2.581 2.085 ( -1.830 -5.073 -2.751) 6.054 2.354 ( -3.702 -1.949 0.630) 4.231 2.665 ( -1.452 0.757 -1.481) 2.207 2.755 ( 0.822 -0.359 1.797) 2.008 2.986 ( 1.050 -0.197 0.538) 1.196 3.009 ( -1.022 -0.075 1.082) 1.490 3.217 ( -0.284 -0.042 -2.191) 2.209 3.427 ( 0.865 0.647 -2.486) 2.710 3.499 ( 0.938 -1.395 1.036) 1.974 3.969 ( -0.716 -1.509 -0.456) 1.731 4.216 ( -7.613 0.245 -3.627) 8.437 5.331 ( 15.909 11.753 2.035) 19.884 5.809 ( 7.612 -5.144 1.099) 9.252 8.402 ( -4.967 4.544 -0.699) 6.768 9.151 ( -1.967 -7.192 18.208) 19.676 10.069 ( -0.627 6.557 -19.147) 20.248 11.567 ( -0.992 -0.952 -3.578) 3.834 14.645 ( -10.778 -0.176 -4.612) 11.724 14.828 ( -15.833 -5.920 -7.652) 18.555 15.468 ( -1.954 0.189 1.097) 2.249 15.628 ( 9.154 1.011 4.839) 10.404 16.761 ( 0.080 2.399 4.375) 4.991 17.081 ( -3.153 -7.558 5.733) 9.996 17.843 ( 0.833 5.365 -2.339) 5.912 18.181 ( 4.981 -1.640 -1.607) 5.485 ======================= Grid point 597 (304/306) ======================= q-point: (-0.20 -0.20 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.959 ( -10.080 0.000 3.250) 10.591 1.069 ( -4.853 0.000 4.146) 6.383 1.378 ( -15.552 0.000 5.402) 16.463 1.609 ( 3.554 -0.000 -0.130) 3.556 1.810 ( -8.595 0.000 3.796) 9.396 1.997 ( 1.361 -0.000 -4.837) 5.025 2.333 ( -2.891 0.000 0.097) 2.892 2.680 ( -1.097 0.000 -1.789) 2.098 2.754 ( 1.857 -0.000 2.395) 3.031 2.985 ( 1.958 -0.000 0.782) 2.109 3.008 ( -1.345 0.000 0.936) 1.639 3.214 ( -1.320 0.000 -3.412) 3.658 3.438 ( 2.570 -0.000 -1.731) 3.099 3.474 ( -0.233 0.000 -0.114) 0.260 3.948 ( -0.336 0.000 -0.507) 0.609 4.222 ( -8.067 0.000 -3.246) 8.696 5.557 ( 11.587 -0.000 1.945) 11.749 5.668 ( 15.139 -0.000 1.158) 15.183 8.479 ( -6.358 0.000 -2.701) 6.908 9.043 ( -1.966 0.000 21.745) 21.834 10.164 ( -0.432 0.000 -22.304) 22.308 11.551 ( -0.675 0.000 -3.567) 3.630 14.654 ( -14.746 0.000 -5.233) 15.647 14.740 ( -14.347 0.000 -8.401) 16.626 15.468 ( -2.657 0.000 1.707) 3.158 15.640 ( 7.223 -0.000 4.698) 8.616 16.815 ( 0.935 -0.000 2.838) 2.988 16.962 ( -2.463 0.000 8.594) 8.940 17.914 ( -1.202 0.000 -1.677) 2.063 18.154 ( 6.613 -0.000 -1.923) 6.887 ======================= Grid point 598 (305/306) ======================= q-point: (-0.10 -0.20 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 550 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.940 ( -5.489 -2.860 8.114) 10.205 1.038 ( -4.767 3.909 5.567) 8.306 1.290 ( -10.347 -5.189 6.440) 13.246 1.630 ( 1.396 2.773 -0.001) 3.105 1.786 ( -0.406 0.636 1.145) 1.371 2.000 ( 1.480 -3.769 -1.760) 4.415 2.285 ( -5.052 -0.821 -0.964) 5.208 2.637 ( -1.647 0.553 -1.853) 2.540 2.797 ( 1.627 0.970 1.929) 2.704 2.995 ( -1.161 1.299 0.832) 1.931 3.024 ( 1.441 -0.599 0.906) 1.804 3.155 ( -2.008 -1.629 -4.204) 4.936 3.427 ( 0.644 1.806 -1.841) 2.658 3.486 ( 0.791 -2.601 -0.875) 2.856 3.941 ( -0.368 -0.670 -0.957) 1.225 4.090 ( -7.255 0.251 -2.829) 7.791 5.664 ( 12.878 7.651 1.984) 15.111 5.884 ( 10.402 -2.652 1.011) 10.782 8.388 ( -5.508 2.523 3.147) 6.827 9.271 ( -1.055 -4.069 17.045) 17.556 9.908 ( 0.274 3.396 -18.455) 18.767 11.418 ( -8.103 -1.225 -10.503) 13.322 14.413 ( -12.858 -1.435 -7.228) 14.820 14.491 ( -14.192 -3.469 -8.332) 16.819 15.459 ( -1.283 -0.245 1.423) 1.932 15.744 ( 1.786 -0.625 3.169) 3.691 16.872 ( 2.110 2.000 6.524) 7.142 17.077 ( 2.495 -2.959 6.387) 7.468 17.882 ( 0.721 2.342 -0.272) 2.466 18.202 ( 4.105 -0.680 -2.671) 4.945 ======================= Grid point 608 (306/306) ======================= q-point: (-0.10 -0.10 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.11e-04 2.11e-04 2.11e-04 2.11e-04 1.94e-05 1.94e-05 Number of triplets: 305 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.015 ( 2.365 -0.000 11.718) 11.955 1.107 ( -2.831 0.000 7.767) 8.266 1.198 ( -7.538 0.000 8.322) 11.229 1.660 ( 3.176 -0.000 -4.688) 5.662 1.795 ( 0.815 -0.000 -1.385) 1.607 2.004 ( 2.704 -0.000 2.930) 3.987 2.180 ( -8.088 0.000 -2.410) 8.439 2.598 ( -1.925 0.000 -1.708) 2.574 2.846 ( 1.443 -0.000 1.704) 2.233 3.014 ( -0.891 0.000 2.032) 2.218 3.026 ( -2.419 0.000 -1.059) 2.640 3.067 ( 0.802 -0.000 -4.383) 4.456 3.441 ( 0.214 -0.000 -1.756) 1.769 3.447 ( 1.003 -0.000 -1.555) 1.851 3.921 ( -0.261 0.000 -1.391) 1.415 3.983 ( -5.884 0.000 -1.822) 6.160 5.859 ( 7.512 -0.000 2.714) 7.988 6.007 ( 10.254 -0.000 -1.503) 10.363 8.406 ( -5.427 0.000 9.644) 11.066 9.338 ( 1.910 -0.000 -3.634) 4.105 9.821 ( 0.166 -0.000 1.227) 1.238 11.140 ( -11.986 0.000 -13.937) 18.382 14.170 ( -10.792 0.000 -6.884) 12.800 14.223 ( -11.218 0.000 -7.458) 13.471 15.470 ( 1.215 -0.000 1.282) 1.766 15.742 ( -4.813 0.000 1.866) 5.162 16.982 ( 1.389 -0.000 7.423) 7.552 17.178 ( 6.439 -0.000 2.555) 6.928 17.922 ( 2.566 -0.000 1.348) 2.899 18.203 ( 1.772 -0.000 -3.102) 3.573 =================== 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 3/33000 10.0 206.738 164.247 139.995 0.000 7.498 0.000 3/33000 20.0 56.223 43.287 38.876 0.000 3.030 0.000 3/33000 30.0 30.222 21.786 20.100 0.000 2.082 0.000 3/33000 40.0 20.802 14.487 13.447 0.000 1.537 0.000 3/33000 50.0 16.065 11.015 10.167 0.000 1.206 0.000 3/33000 60.0 13.213 9.000 8.239 0.000 0.987 0.000 3/33000 70.0 11.288 7.671 6.984 0.000 0.830 0.000 3/33000 80.0 9.888 6.718 6.109 0.000 0.713 0.000 3/33000 90.0 8.816 5.995 5.466 0.000 0.621 0.000 3/33000 100.0 7.967 5.425 4.972 0.000 0.548 0.000 3/33000 110.0 7.274 4.961 4.578 0.000 0.489 0.000 3/33000 120.0 6.697 4.577 4.253 0.000 0.441 0.000 3/33000 130.0 6.209 4.251 3.979 0.000 0.401 0.000 3/33000 140.0 5.790 3.972 3.742 0.000 0.367 0.000 3/33000 150.0 5.425 3.729 3.535 0.000 0.339 0.000 3/33000 160.0 5.105 3.515 3.351 0.000 0.314 0.000 3/33000 170.0 4.822 3.326 3.185 0.000 0.294 0.000 3/33000 180.0 4.569 3.156 3.036 0.000 0.275 0.000 3/33000 190.0 4.342 3.004 2.900 0.000 0.259 0.000 3/33000 200.0 4.137 2.866 2.776 0.000 0.245 0.000 3/33000 210.0 3.951 2.740 2.662 0.000 0.233 0.000 3/33000 220.0 3.781 2.625 2.557 0.000 0.221 0.000 3/33000 230.0 3.625 2.520 2.459 0.000 0.211 0.000 3/33000 240.0 3.481 2.422 2.369 0.000 0.202 0.000 3/33000 250.0 3.349 2.332 2.285 0.000 0.194 0.000 3/33000 260.0 3.226 2.249 2.206 0.000 0.186 0.000 3/33000 270.0 3.112 2.171 2.132 0.000 0.179 0.000 3/33000 280.0 3.006 2.098 2.063 0.000 0.172 0.000 3/33000 290.0 2.907 2.030 1.999 0.000 0.166 0.000 3/33000 300.0 2.814 1.967 1.938 0.000 0.161 0.000 3/33000 310.0 2.727 1.907 1.880 0.000 0.156 0.000 3/33000 320.0 2.645 1.851 1.826 0.000 0.151 0.000 3/33000 330.0 2.568 1.798 1.775 0.000 0.146 0.000 3/33000 340.0 2.495 1.748 1.727 0.000 0.142 0.000 3/33000 350.0 2.426 1.700 1.681 0.000 0.138 0.000 3/33000 360.0 2.361 1.655 1.637 0.000 0.134 0.000 3/33000 370.0 2.299 1.612 1.595 0.000 0.130 0.000 3/33000 380.0 2.241 1.572 1.556 0.000 0.127 0.000 3/33000 390.0 2.185 1.533 1.518 0.000 0.124 0.000 3/33000 400.0 2.132 1.497 1.482 0.000 0.121 0.000 3/33000 410.0 2.082 1.462 1.448 0.000 0.118 0.000 3/33000 420.0 2.034 1.428 1.415 0.000 0.115 0.000 3/33000 430.0 1.988 1.396 1.384 0.000 0.112 0.000 3/33000 440.0 1.944 1.366 1.354 0.000 0.110 0.000 3/33000 450.0 1.901 1.336 1.325 0.000 0.107 0.000 3/33000 460.0 1.861 1.308 1.298 0.000 0.105 0.000 3/33000 470.0 1.823 1.281 1.271 0.000 0.103 0.000 3/33000 480.0 1.785 1.256 1.246 0.000 0.101 0.000 3/33000 490.0 1.750 1.231 1.221 0.000 0.099 0.000 3/33000 500.0 1.716 1.207 1.198 0.000 0.097 0.000 3/33000 510.0 1.683 1.184 1.175 0.000 0.095 0.000 3/33000 520.0 1.651 1.162 1.154 0.000 0.093 0.000 3/33000 530.0 1.621 1.141 1.132 0.000 0.091 0.000 3/33000 540.0 1.591 1.120 1.112 0.000 0.090 0.000 3/33000 550.0 1.563 1.100 1.093 0.000 0.088 0.000 3/33000 560.0 1.535 1.081 1.074 0.000 0.086 0.000 3/33000 570.0 1.509 1.063 1.055 0.000 0.085 0.000 3/33000 580.0 1.483 1.045 1.038 0.000 0.084 0.000 3/33000 590.0 1.459 1.027 1.021 0.000 0.082 0.000 3/33000 600.0 1.435 1.011 1.004 0.000 0.081 0.000 3/33000 610.0 1.412 0.994 0.988 0.000 0.079 0.000 3/33000 620.0 1.389 0.979 0.973 0.000 0.078 0.000 3/33000 630.0 1.368 0.964 0.958 0.000 0.077 0.000 3/33000 640.0 1.347 0.949 0.943 0.000 0.076 0.000 3/33000 650.0 1.326 0.934 0.929 0.000 0.075 0.000 3/33000 660.0 1.306 0.921 0.915 0.000 0.074 0.000 3/33000 670.0 1.287 0.907 0.902 0.000 0.072 0.000 3/33000 680.0 1.268 0.894 0.889 0.000 0.071 0.000 3/33000 690.0 1.250 0.881 0.876 0.000 0.070 0.000 3/33000 700.0 1.233 0.869 0.864 0.000 0.069 0.000 3/33000 710.0 1.216 0.857 0.852 0.000 0.068 0.000 3/33000 720.0 1.199 0.845 0.840 0.000 0.067 0.000 3/33000 730.0 1.183 0.834 0.829 0.000 0.067 0.000 3/33000 740.0 1.167 0.823 0.818 0.000 0.066 0.000 3/33000 750.0 1.152 0.812 0.807 0.000 0.065 0.000 3/33000 760.0 1.137 0.801 0.797 0.000 0.064 0.000 3/33000 770.0 1.122 0.791 0.787 0.000 0.063 0.000 3/33000 780.0 1.108 0.781 0.777 0.000 0.062 0.000 3/33000 790.0 1.094 0.771 0.767 0.000 0.062 0.000 3/33000 800.0 1.080 0.762 0.758 0.000 0.061 0.000 3/33000 810.0 1.067 0.753 0.749 0.000 0.060 0.000 3/33000 820.0 1.054 0.744 0.740 0.000 0.059 0.000 3/33000 830.0 1.042 0.735 0.731 0.000 0.059 0.000 3/33000 840.0 1.029 0.726 0.722 0.000 0.058 0.000 3/33000 850.0 1.017 0.718 0.714 0.000 0.057 0.000 3/33000 860.0 1.006 0.710 0.706 0.000 0.057 0.000 3/33000 870.0 0.994 0.701 0.698 0.000 0.056 0.000 3/33000 880.0 0.983 0.694 0.690 0.000 0.055 0.000 3/33000 890.0 0.972 0.686 0.682 0.000 0.055 0.000 3/33000 900.0 0.961 0.678 0.675 0.000 0.054 0.000 3/33000 910.0 0.951 0.671 0.667 0.000 0.053 0.000 3/33000 920.0 0.941 0.664 0.660 0.000 0.053 0.000 3/33000 930.0 0.931 0.657 0.653 0.000 0.052 0.000 3/33000 940.0 0.921 0.650 0.646 0.000 0.052 0.000 3/33000 950.0 0.911 0.643 0.640 0.000 0.051 0.000 3/33000 960.0 0.902 0.636 0.633 0.000 0.051 0.000 3/33000 970.0 0.893 0.630 0.627 0.000 0.050 0.000 3/33000 980.0 0.884 0.624 0.620 0.000 0.050 0.000 3/33000 990.0 0.875 0.617 0.614 0.000 0.049 0.000 3/33000 1000.0 0.866 0.611 0.608 0.000 0.049 0.000 3/33000 Thermal conductivity related properties were written into "kappa-m101011.hdf5". Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-08 08:05:07]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|