----------------------------- ------- calculate fc2 ------- ----------------------------- _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1 -------------------------[time 2026-01-07 19:21:04]------------------------- Compiled with OpenMP support (max 128 threads). Running in phonopy.load mode. Python version 3.14.2 Spglib version 2.6.1 Crystal structure was read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". Unit of length: angstrom Settings: Supercell: [1 2 2] Primitive matrix: [0.5 0.5 0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/c (15) Number of symmetry operations in supercell: 32 ------------------------------ primitive cell ------------------------------ Lattice vectors: a 4.174910830016394 -2.491569055000000 0.000000000000000 b 4.174910830016394 2.491569055000000 0.000000000000000 c -2.551934273071737 0.000000000000000 5.551182061702927 Atomic positions (fractional): *1 Li 0.35700918815859 0.25010221249641 0.66565780371123 6.941 2 Li 0.74989778750359 0.64299081184141 0.83434219628877 6.941 3 Li 0.64299081184141 0.74989778750359 0.33434219628877 6.941 4 Li 0.25010221249641 0.35700918815859 0.16565780371123 6.941 *5 C 0.93366764748020 0.06633235251980 0.25000000000000 12.011 6 C 0.06633235251980 0.93366764748020 0.75000000000000 12.011 *7 O 0.67671331035604 0.32328668964396 0.25000000000000 15.999 8 O 0.32328668964396 0.67671331035604 0.75000000000000 15.999 *9 O 0.91756033513159 0.78789639212670 0.18752653838531 15.999 10 O 0.21210360787330 0.08243966486841 0.31247346161469 15.999 11 O 0.08243966486841 0.21210360787330 0.81247346161469 15.999 12 O 0.78789639212670 0.91756033513159 0.68752653838531 15.999 -------------------------------- unit cell --------------------------------- Lattice vectors: a 8.349821660032788 0.000000000000000 0.000000000000000 b 0.000000000000000 4.983138110000000 0.000000000000000 c -2.551934273071737 0.000000000000000 5.551182061702927 Atomic positions (fractional): *1 Li 0.30355570032750 0.94654651216891 0.66565780371123 6.941 > 1 2 Li 0.69644429967250 0.94654651216891 0.83434219628877 6.941 > 2 3 Li 0.69644429967250 0.05345348783109 0.33434219628877 6.941 > 3 4 Li 0.30355570032750 0.05345348783109 0.16565780371123 6.941 > 4 5 Li 0.80355570032750 0.44654651216891 0.66565780371123 6.941 > 1 6 Li 0.19644429967250 0.44654651216891 0.83434219628877 6.941 > 2 7 Li 0.19644429967250 0.55345348783109 0.33434219628877 6.941 > 3 8 Li 0.80355570032750 0.55345348783109 0.16565780371123 6.941 > 4 *9 C 0.50000000000000 0.56633235251980 0.25000000000000 12.011 > 5 10 C 0.50000000000000 0.43366764748020 0.75000000000000 12.011 > 6 11 C 0.00000000000000 0.06633235251980 0.25000000000000 12.011 > 5 12 C 0.00000000000000 0.93366764748020 0.75000000000000 12.011 > 6 *13 O 0.50000000000000 0.82328668964396 0.25000000000000 15.999 > 7 14 O 0.50000000000000 0.17671331035604 0.75000000000000 15.999 > 8 *15 O 0.85272836362915 0.93516802849756 0.18752653838531 15.999 > 9 16 O 0.14727163637085 0.93516802849756 0.31247346161469 15.999 > 10 17 O 0.14727163637085 0.06483197150244 0.81247346161469 15.999 > 11 18 O 0.85272836362915 0.06483197150244 0.68752653838531 15.999 > 12 19 O 0.00000000000000 0.32328668964396 0.25000000000000 15.999 > 7 20 O 0.00000000000000 0.67671331035604 0.75000000000000 15.999 > 8 21 O 0.35272836362915 0.43516802849756 0.18752653838531 15.999 > 9 22 O 0.64727163637085 0.43516802849756 0.31247346161469 15.999 > 10 23 O 0.64727163637085 0.56483197150244 0.81247346161469 15.999 > 11 24 O 0.35272836362915 0.56483197150244 0.68752653838531 15.999 > 12 -------------------------------- super cell -------------------------------- Lattice vectors: a 8.349821660032788 0.000000000000000 0.000000000000000 b 0.000000000000000 9.966276219999999 0.000000000000000 c -5.103868546143474 0.000000000000000 11.102364123405854 Atomic positions (fractional): *1 Li 0.30355570032750 0.47327325608445 0.33282890185562 6.941 > 1 2 Li 0.30355570032750 0.97327325608445 0.33282890185562 6.941 > 1 3 Li 0.30355570032750 0.47327325608445 0.83282890185562 6.941 > 1 4 Li 0.30355570032750 0.97327325608445 0.83282890185562 6.941 > 1 5 Li 0.69644429967250 0.47327325608445 0.41717109814438 6.941 > 2 6 Li 0.69644429967250 0.97327325608445 0.41717109814438 6.941 > 2 7 Li 0.69644429967250 0.47327325608445 0.91717109814438 6.941 > 2 8 Li 0.69644429967250 0.97327325608445 0.91717109814438 6.941 > 2 9 Li 0.69644429967250 0.02672674391555 0.16717109814438 6.941 > 3 10 Li 0.69644429967250 0.52672674391555 0.16717109814438 6.941 > 3 11 Li 0.69644429967250 0.02672674391555 0.66717109814438 6.941 > 3 12 Li 0.69644429967250 0.52672674391555 0.66717109814438 6.941 > 3 13 Li 0.30355570032750 0.02672674391555 0.08282890185562 6.941 > 4 14 Li 0.30355570032750 0.52672674391555 0.08282890185562 6.941 > 4 15 Li 0.30355570032750 0.02672674391555 0.58282890185562 6.941 > 4 16 Li 0.30355570032750 0.52672674391555 0.58282890185562 6.941 > 4 17 Li 0.80355570032750 0.22327325608445 0.33282890185562 6.941 > 1 18 Li 0.80355570032750 0.72327325608445 0.33282890185562 6.941 > 1 19 Li 0.80355570032750 0.22327325608445 0.83282890185562 6.941 > 1 20 Li 0.80355570032750 0.72327325608445 0.83282890185562 6.941 > 1 21 Li 0.19644429967250 0.22327325608445 0.41717109814438 6.941 > 2 22 Li 0.19644429967250 0.72327325608445 0.41717109814438 6.941 > 2 23 Li 0.19644429967250 0.22327325608445 0.91717109814438 6.941 > 2 24 Li 0.19644429967250 0.72327325608445 0.91717109814438 6.941 > 2 25 Li 0.19644429967250 0.27672674391555 0.16717109814438 6.941 > 3 26 Li 0.19644429967250 0.77672674391555 0.16717109814438 6.941 > 3 27 Li 0.19644429967250 0.27672674391555 0.66717109814438 6.941 > 3 28 Li 0.19644429967250 0.77672674391555 0.66717109814438 6.941 > 3 29 Li 0.80355570032750 0.27672674391555 0.08282890185562 6.941 > 4 30 Li 0.80355570032750 0.77672674391555 0.08282890185562 6.941 > 4 31 Li 0.80355570032750 0.27672674391555 0.58282890185562 6.941 > 4 32 Li 0.80355570032750 0.77672674391555 0.58282890185562 6.941 > 4 *33 C 0.50000000000000 0.28316617625990 0.12500000000000 12.011 > 5 34 C 0.50000000000000 0.78316617625990 0.12500000000000 12.011 > 5 35 C 0.50000000000000 0.28316617625990 0.62500000000000 12.011 > 5 36 C 0.50000000000000 0.78316617625990 0.62500000000000 12.011 > 5 37 C 0.50000000000000 0.21683382374010 0.37500000000000 12.011 > 6 38 C 0.50000000000000 0.71683382374010 0.37500000000000 12.011 > 6 39 C 0.50000000000000 0.21683382374010 0.87500000000000 12.011 > 6 40 C 0.50000000000000 0.71683382374010 0.87500000000000 12.011 > 6 41 C 0.00000000000000 0.03316617625990 0.12500000000000 12.011 > 5 42 C 0.00000000000000 0.53316617625990 0.12500000000000 12.011 > 5 43 C 0.00000000000000 0.03316617625990 0.62500000000000 12.011 > 5 44 C 0.00000000000000 0.53316617625990 0.62500000000000 12.011 > 5 45 C 0.00000000000000 0.46683382374010 0.37500000000000 12.011 > 6 46 C 0.00000000000000 0.96683382374010 0.37500000000000 12.011 > 6 47 C 0.00000000000000 0.46683382374010 0.87500000000000 12.011 > 6 48 C 0.00000000000000 0.96683382374010 0.87500000000000 12.011 > 6 *49 O 0.50000000000000 0.41164334482198 0.12500000000000 15.999 > 7 50 O 0.50000000000000 0.91164334482198 0.12500000000000 15.999 > 7 51 O 0.50000000000000 0.41164334482198 0.62500000000000 15.999 > 7 52 O 0.50000000000000 0.91164334482198 0.62500000000000 15.999 > 7 53 O 0.50000000000000 0.08835665517802 0.37500000000000 15.999 > 8 54 O 0.50000000000000 0.58835665517802 0.37500000000000 15.999 > 8 55 O 0.50000000000000 0.08835665517802 0.87500000000000 15.999 > 8 56 O 0.50000000000000 0.58835665517802 0.87500000000000 15.999 > 8 *57 O 0.85272836362915 0.46758401424878 0.09376326919265 15.999 > 9 58 O 0.85272836362915 0.96758401424878 0.09376326919265 15.999 > 9 59 O 0.85272836362915 0.46758401424878 0.59376326919265 15.999 > 9 60 O 0.85272836362915 0.96758401424878 0.59376326919265 15.999 > 9 61 O 0.14727163637085 0.46758401424878 0.15623673080735 15.999 > 10 62 O 0.14727163637085 0.96758401424878 0.15623673080735 15.999 > 10 63 O 0.14727163637085 0.46758401424878 0.65623673080735 15.999 > 10 64 O 0.14727163637085 0.96758401424878 0.65623673080735 15.999 > 10 65 O 0.14727163637085 0.03241598575122 0.40623673080735 15.999 > 11 66 O 0.14727163637085 0.53241598575122 0.40623673080735 15.999 > 11 67 O 0.14727163637085 0.03241598575122 0.90623673080735 15.999 > 11 68 O 0.14727163637085 0.53241598575122 0.90623673080735 15.999 > 11 69 O 0.85272836362915 0.03241598575122 0.34376326919265 15.999 > 12 70 O 0.85272836362915 0.53241598575122 0.34376326919265 15.999 > 12 71 O 0.85272836362915 0.03241598575122 0.84376326919265 15.999 > 12 72 O 0.85272836362915 0.53241598575122 0.84376326919265 15.999 > 12 73 O 0.00000000000000 0.16164334482198 0.12500000000000 15.999 > 7 74 O 0.00000000000000 0.66164334482198 0.12500000000000 15.999 > 7 75 O 0.00000000000000 0.16164334482198 0.62500000000000 15.999 > 7 76 O 0.00000000000000 0.66164334482198 0.62500000000000 15.999 > 7 77 O 0.00000000000000 0.33835665517802 0.37500000000000 15.999 > 8 78 O 0.00000000000000 0.83835665517802 0.37500000000000 15.999 > 8 79 O 0.00000000000000 0.33835665517802 0.87500000000000 15.999 > 8 80 O 0.00000000000000 0.83835665517802 0.87500000000000 15.999 > 8 81 O 0.35272836362915 0.21758401424878 0.09376326919265 15.999 > 9 82 O 0.35272836362915 0.71758401424878 0.09376326919265 15.999 > 9 83 O 0.35272836362915 0.21758401424878 0.59376326919265 15.999 > 9 84 O 0.35272836362915 0.71758401424878 0.59376326919265 15.999 > 9 85 O 0.64727163637085 0.21758401424878 0.15623673080735 15.999 > 10 86 O 0.64727163637085 0.71758401424878 0.15623673080735 15.999 > 10 87 O 0.64727163637085 0.21758401424878 0.65623673080735 15.999 > 10 88 O 0.64727163637085 0.71758401424878 0.65623673080735 15.999 > 10 89 O 0.64727163637085 0.28241598575122 0.40623673080735 15.999 > 11 90 O 0.64727163637085 0.78241598575122 0.40623673080735 15.999 > 11 91 O 0.64727163637085 0.28241598575122 0.90623673080735 15.999 > 11 92 O 0.64727163637085 0.78241598575122 0.90623673080735 15.999 > 11 93 O 0.35272836362915 0.28241598575122 0.34376326919265 15.999 > 12 94 O 0.35272836362915 0.78241598575122 0.34376326919265 15.999 > 12 95 O 0.35272836362915 0.28241598575122 0.84376326919265 15.999 > 12 96 O 0.35272836362915 0.78241598575122 0.84376326919265 15.999 > 12 ---------------------------------------------------------------------------- NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". --------------------------- Dielectric constant ---------------------------- 2.5709902 0.0000000 0.1457797 0.0000000 2.6135408 0.0000000 0.1457851 0.0000000 2.1869336 -------------------------- Born effective charges -------------------------- 1 Li 1.0861556 -0.1011054 0.0712792 0.0815575 1.0865979 -0.0468222 0.0405801 -0.0206012 0.9996841 2 Li 1.0861556 0.1011054 0.0712792 -0.0815575 1.0865979 0.0468222 0.0405801 0.0206012 0.9996841 3 Li 1.0861556 -0.1011054 0.0712792 0.0815575 1.0865979 -0.0468222 0.0405801 -0.0206012 0.9996841 4 Li 1.0861556 0.1011054 0.0712792 -0.0815575 1.0865979 0.0468222 0.0405801 0.0206012 0.9996841 5 C 2.6567927 0.0000000 0.6962956 0.0000000 2.7988725 0.0000000 0.7035624 0.0000000 0.6577623 6 C 2.6567927 0.0000000 0.6962956 0.0000000 2.7988725 0.0000000 0.7035624 0.0000000 0.6577623 7 O -1.0819794 0.0000000 -0.1290425 0.0000000 -2.2594034 0.0000000 -0.1329332 0.0000000 -0.7259883 8 O -1.0819794 0.0000000 -0.1290425 0.0000000 -2.2594034 0.0000000 -0.1329332 0.0000000 -0.7259883 9 O -1.8735623 -0.5287730 -0.3549058 -0.5380870 -1.3563324 -0.2084265 -0.3258948 -0.1844102 -0.9655711 10 O -1.8735623 0.5287730 -0.3549058 0.5380870 -1.3563324 0.2084265 -0.3258948 0.1844102 -0.9655711 11 O -1.8735623 -0.5287730 -0.3549058 -0.5380870 -1.3563324 -0.2084265 -0.3258948 -0.1844102 -0.9655711 12 O -1.8735623 0.5287730 -0.3549058 0.5380870 -1.3563324 0.2084265 -0.3258948 0.1844102 -0.9655711 ---------------------------------------------------------------------------- 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: 288/288 Permutation basis: 6336/6336 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 1376 Number of blocks in projector: 1376 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: 304 Use standard eigh solver. --- Eigsh_solver_block: 2 / 6 --- Block_size: 272 Use standard eigh solver. --- Eigsh_solver_block: 3 / 6 --- Block_size: 272 Use standard eigh solver. --- Eigsh_solver_block: 4 / 6 --- Block_size: 176 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 176 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 176 Use standard eigh solver. Tree of FC basis block matrices: - (1376, 1349), data: False |-- (176, 172), data: True |-- (176, 172), data: True |-- (176, 172), data: True |-- (272, 268), data: True |-- (272, 268), data: True |-- (304, 297), data: True ----- Solver_atoms: 1 -- 96 / 96 Time (Solver_compr_matrix_reshape): 0.003 Solver_block: 100 / 400 - Time: 1.464 Solver_block: 200 / 400 - Time: 1.475 Solver_block: 300 / 400 - Time: 1.478 Solver_block: 400 / 400 - Time: 1.479 Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 5.930 --------------------------------- Symfc end -------------------------------- Max drift of force constants: 0.00000000 (xx) 0.00000000 (xx) Permutation basis: 288/288 Permutation basis: 6336/6336 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 1376 Number of blocks in projector: 1376 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: 304 Use standard eigh solver. --- Eigsh_solver_block: 2 / 6 --- Block_size: 272 Use standard eigh solver. --- Eigsh_solver_block: 3 / 6 --- Block_size: 272 Use standard eigh solver. --- Eigsh_solver_block: 4 / 6 --- Block_size: 176 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 176 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 176 Use standard eigh solver. Tree of FC basis block matrices: - (1376, 1349), data: False |-- (176, 172), data: True |-- (176, 172), data: True |-- (176, 172), data: True |-- (272, 268), data: True |-- (272, 268), data: True |-- (304, 297), data: True Max drift after symmetrization by symfc projector: 0.00000000 (xx) 0.00000000 (xx) Force constants are written into "force_constants.hdf5". ---------------------------------------------------------------------------- One of the following run modes may be specified for phonon calculations. - Mesh sampling (MESH, --mesh) - Q-points (QPOINTS, --qpoints) - Band structure (BAND, --band) - Animation (ANIME, --anime) - Modulation (MODULATION, --modulation) - Characters of Irreps (IRREPS, --irreps) - Create displacements (CREATE_DISPLACEMENTS, -d) ---------------------------------------------------------------------------- Summary of calculation was written in "phonopy.yaml". -------------------------[time 2026-01-07 19:21:24]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate fc3 ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-07 19:21:25]------------------------- Compiled with OpenMP support (max 128 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: force constants HDF5 data compression filter: gzip Crystal structure was read from "phono3py_mlp_eval_fc3_disp.yaml.xz". Supercell (dim): [1 2 2] Primitive matrix: [0.5 0.5 0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/c (15) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 4.174910830016394 -2.491569055000000 0.000000000000000 b 4.174910830016394 2.491569055000000 0.000000000000000 c -2.551934273071737 0.000000000000000 5.551182061702927 Atomic positions (fractional): 1 Li 0.35700918815859 0.25010221249641 0.66565780371123 6.941 2 Li 0.74989778750359 0.64299081184141 0.83434219628877 6.941 3 Li 0.64299081184141 0.74989778750359 0.33434219628877 6.941 4 Li 0.25010221249641 0.35700918815859 0.16565780371123 6.941 5 C 0.93366764748020 0.06633235251980 0.25000000000000 12.011 6 C 0.06633235251980 0.93366764748020 0.75000000000000 12.011 7 O 0.67671331035604 0.32328668964396 0.25000000000000 15.999 8 O 0.32328668964396 0.67671331035604 0.75000000000000 15.999 9 O 0.91756033513159 0.78789639212670 0.18752653838531 15.999 10 O 0.21210360787330 0.08243966486841 0.31247346161469 15.999 11 O 0.08243966486841 0.21210360787330 0.81247346161469 15.999 12 O 0.78789639212670 0.91756033513159 0.68752653838531 15.999 -------------------------------- supercell --------------------------------- Lattice vectors: a 8.349821660032788 0.000000000000000 0.000000000000000 b 0.000000000000000 9.966276219999999 0.000000000000000 c -5.103868546143474 0.000000000000000 11.102364123405854 Atomic positions (fractional): 1 Li 0.30355570032750 0.47327325608445 0.33282890185562 6.941 > 1 2 Li 0.30355570032750 0.97327325608445 0.33282890185562 6.941 > 1 3 Li 0.30355570032750 0.47327325608445 0.83282890185562 6.941 > 1 4 Li 0.30355570032750 0.97327325608445 0.83282890185562 6.941 > 1 5 Li 0.69644429967250 0.47327325608445 0.41717109814438 6.941 > 5 6 Li 0.69644429967250 0.97327325608445 0.41717109814438 6.941 > 5 7 Li 0.69644429967250 0.47327325608445 0.91717109814438 6.941 > 5 8 Li 0.69644429967250 0.97327325608445 0.91717109814438 6.941 > 5 9 Li 0.69644429967250 0.02672674391555 0.16717109814438 6.941 > 9 10 Li 0.69644429967250 0.52672674391555 0.16717109814438 6.941 > 9 11 Li 0.69644429967250 0.02672674391555 0.66717109814438 6.941 > 9 12 Li 0.69644429967250 0.52672674391555 0.66717109814438 6.941 > 9 13 Li 0.30355570032750 0.02672674391555 0.08282890185562 6.941 > 13 14 Li 0.30355570032750 0.52672674391555 0.08282890185562 6.941 > 13 15 Li 0.30355570032750 0.02672674391555 0.58282890185562 6.941 > 13 16 Li 0.30355570032750 0.52672674391555 0.58282890185562 6.941 > 13 17 Li 0.80355570032750 0.22327325608445 0.33282890185562 6.941 > 1 18 Li 0.80355570032750 0.72327325608445 0.33282890185562 6.941 > 1 19 Li 0.80355570032750 0.22327325608445 0.83282890185562 6.941 > 1 20 Li 0.80355570032750 0.72327325608445 0.83282890185562 6.941 > 1 21 Li 0.19644429967250 0.22327325608445 0.41717109814438 6.941 > 5 22 Li 0.19644429967250 0.72327325608445 0.41717109814438 6.941 > 5 23 Li 0.19644429967250 0.22327325608445 0.91717109814438 6.941 > 5 24 Li 0.19644429967250 0.72327325608445 0.91717109814438 6.941 > 5 25 Li 0.19644429967250 0.27672674391555 0.16717109814438 6.941 > 9 26 Li 0.19644429967250 0.77672674391555 0.16717109814438 6.941 > 9 27 Li 0.19644429967250 0.27672674391555 0.66717109814438 6.941 > 9 28 Li 0.19644429967250 0.77672674391555 0.66717109814438 6.941 > 9 29 Li 0.80355570032750 0.27672674391555 0.08282890185562 6.941 > 13 30 Li 0.80355570032750 0.77672674391555 0.08282890185562 6.941 > 13 31 Li 0.80355570032750 0.27672674391555 0.58282890185562 6.941 > 13 32 Li 0.80355570032750 0.77672674391555 0.58282890185562 6.941 > 13 33 C 0.50000000000000 0.28316617625990 0.12500000000000 12.011 > 33 34 C 0.50000000000000 0.78316617625990 0.12500000000000 12.011 > 33 35 C 0.50000000000000 0.28316617625990 0.62500000000000 12.011 > 33 36 C 0.50000000000000 0.78316617625990 0.62500000000000 12.011 > 33 37 C 0.50000000000000 0.21683382374010 0.37500000000000 12.011 > 37 38 C 0.50000000000000 0.71683382374010 0.37500000000000 12.011 > 37 39 C 0.50000000000000 0.21683382374010 0.87500000000000 12.011 > 37 40 C 0.50000000000000 0.71683382374010 0.87500000000000 12.011 > 37 41 C 0.00000000000000 0.03316617625990 0.12500000000000 12.011 > 33 42 C 0.00000000000000 0.53316617625990 0.12500000000000 12.011 > 33 43 C 0.00000000000000 0.03316617625990 0.62500000000000 12.011 > 33 44 C 0.00000000000000 0.53316617625990 0.62500000000000 12.011 > 33 45 C 0.00000000000000 0.46683382374010 0.37500000000000 12.011 > 37 46 C 0.00000000000000 0.96683382374010 0.37500000000000 12.011 > 37 47 C 0.00000000000000 0.46683382374010 0.87500000000000 12.011 > 37 48 C 0.00000000000000 0.96683382374010 0.87500000000000 12.011 > 37 49 O 0.50000000000000 0.41164334482198 0.12500000000000 15.999 > 49 50 O 0.50000000000000 0.91164334482198 0.12500000000000 15.999 > 49 51 O 0.50000000000000 0.41164334482198 0.62500000000000 15.999 > 49 52 O 0.50000000000000 0.91164334482198 0.62500000000000 15.999 > 49 53 O 0.50000000000000 0.08835665517802 0.37500000000000 15.999 > 53 54 O 0.50000000000000 0.58835665517802 0.37500000000000 15.999 > 53 55 O 0.50000000000000 0.08835665517802 0.87500000000000 15.999 > 53 56 O 0.50000000000000 0.58835665517802 0.87500000000000 15.999 > 53 57 O 0.85272836362915 0.46758401424878 0.09376326919265 15.999 > 57 58 O 0.85272836362915 0.96758401424878 0.09376326919265 15.999 > 57 59 O 0.85272836362915 0.46758401424878 0.59376326919265 15.999 > 57 60 O 0.85272836362915 0.96758401424878 0.59376326919265 15.999 > 57 61 O 0.14727163637085 0.46758401424878 0.15623673080735 15.999 > 61 62 O 0.14727163637085 0.96758401424878 0.15623673080735 15.999 > 61 63 O 0.14727163637085 0.46758401424878 0.65623673080735 15.999 > 61 64 O 0.14727163637085 0.96758401424878 0.65623673080735 15.999 > 61 65 O 0.14727163637085 0.03241598575122 0.40623673080735 15.999 > 65 66 O 0.14727163637085 0.53241598575122 0.40623673080735 15.999 > 65 67 O 0.14727163637085 0.03241598575122 0.90623673080735 15.999 > 65 68 O 0.14727163637085 0.53241598575122 0.90623673080735 15.999 > 65 69 O 0.85272836362915 0.03241598575122 0.34376326919265 15.999 > 69 70 O 0.85272836362915 0.53241598575122 0.34376326919265 15.999 > 69 71 O 0.85272836362915 0.03241598575122 0.84376326919265 15.999 > 69 72 O 0.85272836362915 0.53241598575122 0.84376326919265 15.999 > 69 73 O 0.00000000000000 0.16164334482198 0.12500000000000 15.999 > 49 74 O 0.00000000000000 0.66164334482198 0.12500000000000 15.999 > 49 75 O 0.00000000000000 0.16164334482198 0.62500000000000 15.999 > 49 76 O 0.00000000000000 0.66164334482198 0.62500000000000 15.999 > 49 77 O 0.00000000000000 0.33835665517802 0.37500000000000 15.999 > 53 78 O 0.00000000000000 0.83835665517802 0.37500000000000 15.999 > 53 79 O 0.00000000000000 0.33835665517802 0.87500000000000 15.999 > 53 80 O 0.00000000000000 0.83835665517802 0.87500000000000 15.999 > 53 81 O 0.35272836362915 0.21758401424878 0.09376326919265 15.999 > 57 82 O 0.35272836362915 0.71758401424878 0.09376326919265 15.999 > 57 83 O 0.35272836362915 0.21758401424878 0.59376326919265 15.999 > 57 84 O 0.35272836362915 0.71758401424878 0.59376326919265 15.999 > 57 85 O 0.64727163637085 0.21758401424878 0.15623673080735 15.999 > 61 86 O 0.64727163637085 0.71758401424878 0.15623673080735 15.999 > 61 87 O 0.64727163637085 0.21758401424878 0.65623673080735 15.999 > 61 88 O 0.64727163637085 0.71758401424878 0.65623673080735 15.999 > 61 89 O 0.64727163637085 0.28241598575122 0.40623673080735 15.999 > 65 90 O 0.64727163637085 0.78241598575122 0.40623673080735 15.999 > 65 91 O 0.64727163637085 0.28241598575122 0.90623673080735 15.999 > 65 92 O 0.64727163637085 0.78241598575122 0.90623673080735 15.999 > 65 93 O 0.35272836362915 0.28241598575122 0.34376326919265 15.999 > 69 94 O 0.35272836362915 0.78241598575122 0.34376326919265 15.999 > 69 95 O 0.35272836362915 0.28241598575122 0.84376326919265 15.999 > 69 96 O 0.35272836362915 0.78241598575122 0.84376326919265 15.999 > 69 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz". --------------------------- Dielectric constant ---------------------------- 2.5709902 0.0000000 0.1457797 0.0000000 2.6135408 0.0000000 0.1457851 0.0000000 2.1869336 -------------------------- Born effective charges -------------------------- 1 Li 1.0861556 -0.1011054 0.0712792 0.0815575 1.0865979 -0.0468222 0.0405801 -0.0206012 0.9996841 2 Li 1.0861556 0.1011054 0.0712792 -0.0815575 1.0865979 0.0468222 0.0405801 0.0206012 0.9996841 3 Li 1.0861556 -0.1011054 0.0712792 0.0815575 1.0865979 -0.0468222 0.0405801 -0.0206012 0.9996841 4 Li 1.0861556 0.1011054 0.0712792 -0.0815575 1.0865979 0.0468222 0.0405801 0.0206012 0.9996841 5 C 2.6567927 0.0000000 0.6962956 0.0000000 2.7988725 0.0000000 0.7035624 0.0000000 0.6577623 6 C 2.6567927 0.0000000 0.6962956 0.0000000 2.7988725 0.0000000 0.7035624 0.0000000 0.6577623 7 O -1.0819794 0.0000000 -0.1290425 0.0000000 -2.2594034 0.0000000 -0.1329332 0.0000000 -0.7259883 8 O -1.0819794 0.0000000 -0.1290425 0.0000000 -2.2594034 0.0000000 -0.1329332 0.0000000 -0.7259883 9 O -1.8735623 -0.5287730 -0.3549058 -0.5380870 -1.3563324 -0.2084265 -0.3258948 -0.1844102 -0.9655711 10 O -1.8735623 0.5287730 -0.3549058 0.5380870 -1.3563324 0.2084265 -0.3258948 0.1844102 -0.9655711 11 O -1.8735623 -0.5287730 -0.3549058 -0.5380870 -1.3563324 -0.2084265 -0.3258948 -0.1844102 -0.9655711 12 O -1.8735623 0.5287730 -0.3549058 0.5380870 -1.3563324 0.2084265 -0.3258948 0.1844102 -0.9655711 ---------------------------------------------------------------------------- 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] [-0.0042 0.0000 0.0091] [ 0.0042 0.0000 -0.0091] 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] [-0.0042 0.0000 0.0091] [ 0.0042 0.0000 -0.0091] Computing fc3[ 49, 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] [-0.0042 0.0000 0.0091] [ 0.0042 0.0000 -0.0091] Computing fc3[ 57, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0042 0.0000 0.0091] [ 0.0042 0.0000 -0.0091] Expanding fc3. Symmetrizing fc3 by traditional approach (N=3). Symmetrizing fc2 by traditional approach (N=3). Max drift of fc3: 0.00000007 (xyx) 0.00000007 (xyx) 0.00000007 (xxy) fc3 was written into "fc3.hdf5". Max drift of fc2: 0.00000003 (zx) 0.00000003 (zx) fc2 was written into "fc2.hdf5". --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperatures: 0.0 300.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 ----------- None of ph-ph interaction calculation was performed. ----------- Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-07 19:21:37]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate LTC ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-07 19:21:38]------------------------- Compiled with OpenMP support (max 128 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: conductivity-RTA HDF5 data compression filter: gzip Crystal structure was read from "phono3py.yaml". Supercell (dim): [1 2 2] Primitive matrix: [0.5 0.5 0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/c (15) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 4.174910830016394 -2.491569055000000 0.000000000000000 b 4.174910830016394 2.491569055000000 0.000000000000000 c -2.551934273071737 0.000000000000000 5.551182061702927 Atomic positions (fractional): 1 Li 0.35700918815859 0.25010221249641 0.66565780371123 6.941 2 Li 0.74989778750359 0.64299081184141 0.83434219628877 6.941 3 Li 0.64299081184141 0.74989778750359 0.33434219628877 6.941 4 Li 0.25010221249641 0.35700918815859 0.16565780371123 6.941 5 C 0.93366764748020 0.06633235251980 0.25000000000000 12.011 6 C 0.06633235251980 0.93366764748020 0.75000000000000 12.011 7 O 0.67671331035604 0.32328668964396 0.25000000000000 15.999 8 O 0.32328668964396 0.67671331035604 0.75000000000000 15.999 9 O 0.91756033513159 0.78789639212670 0.18752653838531 15.999 10 O 0.21210360787330 0.08243966486841 0.31247346161469 15.999 11 O 0.08243966486841 0.21210360787330 0.81247346161469 15.999 12 O 0.78789639212670 0.91756033513159 0.68752653838531 15.999 -------------------------------- supercell --------------------------------- Lattice vectors: a 8.349821660032788 0.000000000000000 0.000000000000000 b 0.000000000000000 9.966276219999999 0.000000000000000 c -5.103868546143474 0.000000000000000 11.102364123405854 Atomic positions (fractional): 1 Li 0.30355570032750 0.47327325608445 0.33282890185562 6.941 > 1 2 Li 0.30355570032750 0.97327325608445 0.33282890185562 6.941 > 1 3 Li 0.30355570032750 0.47327325608445 0.83282890185562 6.941 > 1 4 Li 0.30355570032750 0.97327325608445 0.83282890185562 6.941 > 1 5 Li 0.69644429967250 0.47327325608445 0.41717109814438 6.941 > 5 6 Li 0.69644429967250 0.97327325608445 0.41717109814438 6.941 > 5 7 Li 0.69644429967250 0.47327325608445 0.91717109814438 6.941 > 5 8 Li 0.69644429967250 0.97327325608445 0.91717109814438 6.941 > 5 9 Li 0.69644429967250 0.02672674391555 0.16717109814438 6.941 > 9 10 Li 0.69644429967250 0.52672674391555 0.16717109814438 6.941 > 9 11 Li 0.69644429967250 0.02672674391555 0.66717109814438 6.941 > 9 12 Li 0.69644429967250 0.52672674391555 0.66717109814438 6.941 > 9 13 Li 0.30355570032750 0.02672674391555 0.08282890185562 6.941 > 13 14 Li 0.30355570032750 0.52672674391555 0.08282890185562 6.941 > 13 15 Li 0.30355570032750 0.02672674391555 0.58282890185562 6.941 > 13 16 Li 0.30355570032750 0.52672674391555 0.58282890185562 6.941 > 13 17 Li 0.80355570032750 0.22327325608445 0.33282890185562 6.941 > 1 18 Li 0.80355570032750 0.72327325608445 0.33282890185562 6.941 > 1 19 Li 0.80355570032750 0.22327325608445 0.83282890185562 6.941 > 1 20 Li 0.80355570032750 0.72327325608445 0.83282890185562 6.941 > 1 21 Li 0.19644429967250 0.22327325608445 0.41717109814438 6.941 > 5 22 Li 0.19644429967250 0.72327325608445 0.41717109814438 6.941 > 5 23 Li 0.19644429967250 0.22327325608445 0.91717109814438 6.941 > 5 24 Li 0.19644429967250 0.72327325608445 0.91717109814438 6.941 > 5 25 Li 0.19644429967250 0.27672674391555 0.16717109814438 6.941 > 9 26 Li 0.19644429967250 0.77672674391555 0.16717109814438 6.941 > 9 27 Li 0.19644429967250 0.27672674391555 0.66717109814438 6.941 > 9 28 Li 0.19644429967250 0.77672674391555 0.66717109814438 6.941 > 9 29 Li 0.80355570032750 0.27672674391555 0.08282890185562 6.941 > 13 30 Li 0.80355570032750 0.77672674391555 0.08282890185562 6.941 > 13 31 Li 0.80355570032750 0.27672674391555 0.58282890185562 6.941 > 13 32 Li 0.80355570032750 0.77672674391555 0.58282890185562 6.941 > 13 33 C 0.50000000000000 0.28316617625990 0.12500000000000 12.011 > 33 34 C 0.50000000000000 0.78316617625990 0.12500000000000 12.011 > 33 35 C 0.50000000000000 0.28316617625990 0.62500000000000 12.011 > 33 36 C 0.50000000000000 0.78316617625990 0.62500000000000 12.011 > 33 37 C 0.50000000000000 0.21683382374010 0.37500000000000 12.011 > 37 38 C 0.50000000000000 0.71683382374010 0.37500000000000 12.011 > 37 39 C 0.50000000000000 0.21683382374010 0.87500000000000 12.011 > 37 40 C 0.50000000000000 0.71683382374010 0.87500000000000 12.011 > 37 41 C 0.00000000000000 0.03316617625990 0.12500000000000 12.011 > 33 42 C 0.00000000000000 0.53316617625990 0.12500000000000 12.011 > 33 43 C 0.00000000000000 0.03316617625990 0.62500000000000 12.011 > 33 44 C 0.00000000000000 0.53316617625990 0.62500000000000 12.011 > 33 45 C 0.00000000000000 0.46683382374010 0.37500000000000 12.011 > 37 46 C 0.00000000000000 0.96683382374010 0.37500000000000 12.011 > 37 47 C 0.00000000000000 0.46683382374010 0.87500000000000 12.011 > 37 48 C 0.00000000000000 0.96683382374010 0.87500000000000 12.011 > 37 49 O 0.50000000000000 0.41164334482198 0.12500000000000 15.999 > 49 50 O 0.50000000000000 0.91164334482198 0.12500000000000 15.999 > 49 51 O 0.50000000000000 0.41164334482198 0.62500000000000 15.999 > 49 52 O 0.50000000000000 0.91164334482198 0.62500000000000 15.999 > 49 53 O 0.50000000000000 0.08835665517802 0.37500000000000 15.999 > 53 54 O 0.50000000000000 0.58835665517802 0.37500000000000 15.999 > 53 55 O 0.50000000000000 0.08835665517802 0.87500000000000 15.999 > 53 56 O 0.50000000000000 0.58835665517802 0.87500000000000 15.999 > 53 57 O 0.85272836362915 0.46758401424878 0.09376326919265 15.999 > 57 58 O 0.85272836362915 0.96758401424878 0.09376326919265 15.999 > 57 59 O 0.85272836362915 0.46758401424878 0.59376326919265 15.999 > 57 60 O 0.85272836362915 0.96758401424878 0.59376326919265 15.999 > 57 61 O 0.14727163637085 0.46758401424878 0.15623673080735 15.999 > 61 62 O 0.14727163637085 0.96758401424878 0.15623673080735 15.999 > 61 63 O 0.14727163637085 0.46758401424878 0.65623673080735 15.999 > 61 64 O 0.14727163637085 0.96758401424878 0.65623673080735 15.999 > 61 65 O 0.14727163637085 0.03241598575122 0.40623673080735 15.999 > 65 66 O 0.14727163637085 0.53241598575122 0.40623673080735 15.999 > 65 67 O 0.14727163637085 0.03241598575122 0.90623673080735 15.999 > 65 68 O 0.14727163637085 0.53241598575122 0.90623673080735 15.999 > 65 69 O 0.85272836362915 0.03241598575122 0.34376326919265 15.999 > 69 70 O 0.85272836362915 0.53241598575122 0.34376326919265 15.999 > 69 71 O 0.85272836362915 0.03241598575122 0.84376326919265 15.999 > 69 72 O 0.85272836362915 0.53241598575122 0.84376326919265 15.999 > 69 73 O 0.00000000000000 0.16164334482198 0.12500000000000 15.999 > 49 74 O 0.00000000000000 0.66164334482198 0.12500000000000 15.999 > 49 75 O 0.00000000000000 0.16164334482198 0.62500000000000 15.999 > 49 76 O 0.00000000000000 0.66164334482198 0.62500000000000 15.999 > 49 77 O 0.00000000000000 0.33835665517802 0.37500000000000 15.999 > 53 78 O 0.00000000000000 0.83835665517802 0.37500000000000 15.999 > 53 79 O 0.00000000000000 0.33835665517802 0.87500000000000 15.999 > 53 80 O 0.00000000000000 0.83835665517802 0.87500000000000 15.999 > 53 81 O 0.35272836362915 0.21758401424878 0.09376326919265 15.999 > 57 82 O 0.35272836362915 0.71758401424878 0.09376326919265 15.999 > 57 83 O 0.35272836362915 0.21758401424878 0.59376326919265 15.999 > 57 84 O 0.35272836362915 0.71758401424878 0.59376326919265 15.999 > 57 85 O 0.64727163637085 0.21758401424878 0.15623673080735 15.999 > 61 86 O 0.64727163637085 0.71758401424878 0.15623673080735 15.999 > 61 87 O 0.64727163637085 0.21758401424878 0.65623673080735 15.999 > 61 88 O 0.64727163637085 0.71758401424878 0.65623673080735 15.999 > 61 89 O 0.64727163637085 0.28241598575122 0.40623673080735 15.999 > 65 90 O 0.64727163637085 0.78241598575122 0.40623673080735 15.999 > 65 91 O 0.64727163637085 0.28241598575122 0.90623673080735 15.999 > 65 92 O 0.64727163637085 0.78241598575122 0.90623673080735 15.999 > 65 93 O 0.35272836362915 0.28241598575122 0.34376326919265 15.999 > 69 94 O 0.35272836362915 0.78241598575122 0.34376326919265 15.999 > 69 95 O 0.35272836362915 0.28241598575122 0.84376326919265 15.999 > 69 96 O 0.35272836362915 0.78241598575122 0.84376326919265 15.999 > 69 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py.yaml". --------------------------- Dielectric constant ---------------------------- 2.5709902 0.0000000 0.1457797 0.0000000 2.6135408 0.0000000 0.1457851 0.0000000 2.1869336 -------------------------- Born effective charges -------------------------- 1 Li 1.0861556 -0.1011054 0.0712792 0.0815575 1.0865979 -0.0468222 0.0405801 -0.0206012 0.9996841 2 Li 1.0861556 0.1011054 0.0712792 -0.0815575 1.0865979 0.0468222 0.0405801 0.0206012 0.9996841 3 Li 1.0861556 -0.1011054 0.0712792 0.0815575 1.0865979 -0.0468222 0.0405801 -0.0206012 0.9996841 4 Li 1.0861556 0.1011054 0.0712792 -0.0815575 1.0865979 0.0468222 0.0405801 0.0206012 0.9996841 5 C 2.6567927 0.0000000 0.6962956 0.0000000 2.7988725 0.0000000 0.7035624 0.0000000 0.6577623 6 C 2.6567927 0.0000000 0.6962956 0.0000000 2.7988725 0.0000000 0.7035624 0.0000000 0.6577623 7 O -1.0819794 0.0000000 -0.1290425 0.0000000 -2.2594034 0.0000000 -0.1329332 0.0000000 -0.7259883 8 O -1.0819794 0.0000000 -0.1290425 0.0000000 -2.2594034 0.0000000 -0.1329332 0.0000000 -0.7259883 9 O -1.8735623 -0.5287730 -0.3549058 -0.5380870 -1.3563324 -0.2084265 -0.3258948 -0.1844102 -0.9655711 10 O -1.8735623 0.5287730 -0.3549058 0.5380870 -1.3563324 0.2084265 -0.3258948 0.1844102 -0.9655711 11 O -1.8735623 -0.5287730 -0.3549058 -0.5380870 -1.3563324 -0.2084265 -0.3258948 -0.1844102 -0.9655711 12 O -1.8735623 0.5287730 -0.3549058 0.5380870 -1.3563324 0.2084265 -0.3258948 0.1844102 -0.9655711 ---------------------------------------------------------------------------- fc3 was read from "fc3.hdf5". fc2 was read from "fc2.hdf5". ----------------------------- Force constants ------------------------------ Max drift of fc3: 0.00000007 (xyx) 0.00000007 (xyx) 0.00000007 (xxy) Max drift of fc2: 0.00000000 (xx) 0.00000000 (xx) --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperature: 0.0 10.0 20.0 30.0 40.0 ... 1000.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 Length for sampling mesh generation: 50.00 Generating grid system ... [ 12 12 9 ] fc3-r2q-transformation over three atoms: True --------------------------- Phonon calculations ---------------------------- Use NAC by Gonze et al. (no real space sum in current implementation) PRB 50, 13035(R) (1994), PRB 55, 10355 (1997) G-cutoff distance: 0.85, Number of G-points: 293, Lambda: 0.14 Running harmonic phonon calculations... -------------------- Lattice thermal conductivity (RTA) -------------------- ======================= Grid point 0 (1/355) ======================= q-point: ( 0.00 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 355 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| -0.000 ( 0.000 0.000 0.000) 0.000 0.000 ( 0.000 0.000 0.000) 0.000 0.000 ( 0.000 0.000 0.000) 0.000 2.800 ( 0.000 0.000 0.000) 0.000 3.748 ( 0.000 0.000 0.000) 0.000 3.901 ( 0.000 0.000 0.000) 0.000 4.679 ( 0.000 0.000 0.000) 0.000 5.800 ( 0.000 0.000 0.000) 0.000 6.624 ( 0.000 0.000 0.000) 0.000 8.049 ( 0.000 0.000 0.000) 0.000 8.133 ( 0.000 0.000 0.000) 0.000 8.569 ( 0.000 0.000 0.000) 0.000 9.901 ( 0.000 0.000 0.000) 0.000 10.674 ( 0.000 0.000 0.000) 0.000 11.844 ( 0.000 0.000 0.000) 0.000 12.106 ( 0.000 0.000 0.000) 0.000 12.944 ( 0.000 0.000 0.000) 0.000 13.364 ( 0.000 0.000 0.000) 0.000 13.581 ( 0.000 0.000 0.000) 0.000 13.867 ( 0.000 0.000 0.000) 0.000 14.870 ( 0.000 0.000 0.000) 0.000 15.204 ( 0.000 0.000 0.000) 0.000 15.453 ( 0.000 0.000 0.000) 0.000 15.851 ( 0.000 0.000 0.000) 0.000 20.684 ( 0.000 0.000 0.000) 0.000 20.692 ( 0.000 0.000 0.000) 0.000 21.646 ( 0.000 0.000 0.000) 0.000 21.817 ( 0.000 0.000 0.000) 0.000 24.414 ( 0.000 0.000 0.000) 0.000 25.371 ( 0.000 0.000 0.000) 0.000 32.343 ( 0.000 0.000 0.000) 0.000 32.438 ( 0.000 0.000 0.000) 0.000 42.223 ( 0.000 0.000 0.000) 0.000 42.429 ( 0.000 0.000 0.000) 0.000 44.059 ( 0.000 0.000 0.000) 0.000 44.497 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 1 (2/355) ======================= q-point: ( 0.08 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.504 ( 8.225 -25.641 0.470) 26.932 0.965 ( 17.197 -45.365 3.566) 48.646 1.817 ( 46.277 -74.485 15.929) 89.125 2.892 ( 12.398 -2.555 1.260) 12.721 3.746 ( -21.723 -10.070 8.542) 25.421 4.009 ( 13.645 -5.668 -5.881) 15.903 4.740 ( 4.171 -4.682 -0.529) 6.293 5.739 ( 0.072 7.017 -0.264) 7.022 6.557 ( -6.587 3.747 -0.853) 7.626 7.933 ( -6.581 13.719 0.411) 15.222 8.154 ( -8.243 -7.360 -13.864) 17.729 8.599 ( 4.523 3.901 14.228) 15.431 9.895 ( -0.354 0.140 -1.115) 1.178 10.725 ( -3.660 9.363 31.785) 33.337 11.811 ( -0.025 3.738 -1.236) 3.937 12.196 ( -13.534 1.821 3.747) 14.161 12.935 ( 9.134 17.942 4.117) 20.550 13.358 ( 4.081 3.724 -3.878) 6.750 13.880 ( -4.192 0.837 -3.663) 5.630 13.950 ( 7.072 -2.822 2.940) 8.162 15.122 ( -13.905 -14.233 -0.271) 19.899 15.582 ( 8.824 -6.221 -1.188) 10.862 15.810 ( -15.702 -7.931 -4.046) 18.050 17.857 ( 21.223 23.637 -4.374) 32.066 20.657 ( -1.122 1.326 -0.315) 1.765 20.722 ( -2.308 -3.236 -0.828) 4.060 21.676 ( 4.454 2.983 1.281) 5.512 21.856 ( 6.389 -0.245 1.307) 6.525 24.415 ( -0.290 -0.076 0.783) 0.838 25.371 ( -0.127 -0.023 0.270) 0.300 32.382 ( -0.714 -2.024 -0.599) 2.228 32.453 ( 0.765 -1.237 0.178) 1.465 42.205 ( 1.822 2.165 -2.933) 4.075 42.944 ( 57.518 31.547 16.553) 67.658 44.114 ( 3.621 -3.995 1.331) 5.554 47.854 ( -44.194 -34.943 -35.115) 66.387 ======================= Grid point 2 (3/355) ======================= q-point: ( 0.17 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.029 ( 9.183 -26.449 0.609) 28.004 1.874 ( 15.313 -41.726 2.335) 44.509 3.101 ( 18.161 -3.651 2.841) 18.741 3.521 ( 40.665 -64.808 14.268) 77.829 3.734 ( -12.347 -5.425 5.211) 14.457 4.306 ( 2.636 -22.268 -4.423) 22.855 4.907 ( 10.272 -7.489 -2.853) 13.028 5.578 ( 0.209 11.059 -2.025) 11.245 6.362 ( -12.728 7.351 -0.782) 14.719 7.551 ( -14.284 17.094 -4.251) 22.678 8.077 ( -9.879 -1.544 -14.321) 17.466 8.659 ( 3.428 1.547 14.999) 15.463 9.886 ( -0.012 -0.294 -1.659) 1.685 10.656 ( -1.973 8.755 16.472) 18.758 11.705 ( -1.271 7.278 -1.417) 7.522 11.998 ( -8.751 9.662 3.211) 13.426 12.722 ( 0.244 15.601 6.846) 17.039 13.295 ( 3.271 4.636 -4.822) 7.446 13.815 ( 4.423 4.172 -2.561) 6.598 14.104 ( 18.041 3.727 5.724) 19.291 15.260 ( -10.274 -15.285 1.116) 18.451 15.605 ( -3.697 2.392 -3.149) 5.413 15.940 ( -10.532 -21.911 -2.948) 24.489 17.580 ( 2.114 20.304 -3.565) 20.723 20.621 ( -3.377 -0.011 -1.071) 3.542 20.749 ( -1.358 -2.735 -0.484) 3.092 21.676 ( 2.840 2.013 0.897) 3.595 21.948 ( 9.387 0.154 1.689) 9.539 24.418 ( 0.058 -0.166 0.087) 0.196 25.372 ( -0.225 -0.039 0.432) 0.489 32.416 ( 0.497 -2.284 -0.442) 2.379 32.494 ( 1.421 -2.136 0.355) 2.590 42.171 ( 2.560 1.977 -5.089) 6.030 43.102 ( 25.959 6.190 5.967) 27.346 44.272 ( 6.660 -7.177 3.159) 10.288 47.826 ( -21.457 -15.409 -17.827) 31.869 ======================= Grid point 3 (4/355) ======================= q-point: ( 0.25 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.574 ( 10.057 -26.690 0.641) 28.529 2.668 ( 12.037 -35.626 0.457) 37.607 3.346 ( 16.990 -2.294 3.444) 17.486 3.737 ( -3.266 -2.638 3.726) 5.613 4.564 ( -1.083 -22.901 5.875) 23.667 4.851 ( 12.372 -17.249 4.289) 21.656 5.208 ( 14.636 -11.886 -6.462) 19.931 5.503 ( 15.479 -16.346 2.195) 22.619 6.074 ( -17.734 6.208 -3.071) 19.039 7.052 ( -19.043 19.404 -6.492) 27.952 7.939 ( -3.110 2.032 -5.550) 6.678 8.732 ( -2.036 -2.138 8.431) 8.933 9.892 ( 0.371 -1.118 -1.453) 1.870 10.545 ( -0.848 9.944 9.709) 13.923 11.544 ( -2.827 8.339 -0.358) 8.813 11.755 ( -5.894 11.177 1.302) 12.703 12.501 ( -0.980 13.637 7.637) 15.660 13.224 ( 1.324 4.545 -7.184) 8.603 13.825 ( 12.035 2.822 -1.482) 12.450 14.211 ( 19.877 9.186 6.377) 22.807 15.380 ( -16.249 -13.332 -2.139) 21.127 15.570 ( -4.194 -5.952 0.052) 7.281 16.160 ( -10.356 -16.828 -1.787) 19.840 17.218 ( -2.704 20.154 -2.059) 20.439 20.582 ( -4.310 -0.680 -1.343) 4.565 20.787 ( 0.126 -2.694 0.030) 2.697 21.673 ( 2.248 1.740 0.629) 2.912 22.037 ( 8.721 1.109 1.211) 8.875 24.423 ( 0.203 -0.212 -0.149) 0.329 25.372 ( -0.266 -0.046 0.444) 0.520 32.461 ( 0.861 -2.413 -0.480) 2.607 32.552 ( 1.797 -2.485 0.440) 3.098 42.147 ( 2.683 0.951 -5.911) 6.561 43.291 ( 14.513 -1.956 1.863) 14.762 44.502 ( 8.249 -8.707 4.836) 12.932 47.778 ( -13.582 -7.924 -11.950) 19.750 ======================= Grid point 4 (5/355) ======================= q-point: ( 0.33 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.121 ( 10.694 -25.790 0.354) 27.921 3.280 ( 7.538 -22.702 -0.857) 23.936 3.509 ( 6.479 -2.885 3.056) 7.723 3.829 ( 8.238 -3.681 5.177) 10.403 4.772 ( 0.932 8.307 -3.974) 9.255 4.812 ( 0.414 7.602 9.119) 11.879 5.275 ( -8.148 -4.834 -0.476) 9.486 5.858 ( -13.744 -5.124 -12.535) 19.295 6.334 ( 0.438 -12.105 -6.822) 13.902 6.619 ( 8.757 -8.964 6.619) 14.173 7.957 ( 7.285 -2.449 3.805) 8.576 8.746 ( -7.836 -2.095 2.504) 8.489 9.918 ( 0.176 -2.240 -0.703) 2.354 10.399 ( 0.182 10.807 4.354) 11.653 11.389 ( -3.477 5.983 1.005) 6.993 11.536 ( -3.094 9.523 -0.311) 10.018 12.343 ( 1.336 9.296 8.478) 12.652 13.066 ( -3.791 8.001 -10.867) 14.017 13.954 ( 15.754 -1.482 0.612) 15.835 14.282 ( 17.075 6.257 4.041) 18.628 15.385 ( -16.246 -8.980 -2.327) 18.708 15.658 ( -2.594 -4.873 1.656) 5.763 16.271 ( -14.886 -13.221 -1.934) 20.003 16.870 ( -0.113 18.229 0.229) 18.231 20.549 ( -3.529 -0.823 -1.038) 3.769 20.839 ( 0.835 -2.642 0.345) 2.792 21.670 ( 1.757 1.298 0.375) 2.217 22.090 ( 6.107 1.831 0.502) 6.395 24.428 ( 0.228 -0.199 -0.186) 0.355 25.372 ( -0.234 -0.043 0.339) 0.414 32.505 ( 0.786 -2.053 -0.434) 2.241 32.612 ( 1.684 -2.172 0.373) 2.774 42.138 ( 2.301 0.188 -5.132) 5.627 43.461 ( 8.101 -3.977 0.153) 9.026 44.750 ( 7.641 -7.951 5.145) 12.169 47.715 ( -8.936 -3.711 -8.267) 12.726 ======================= Grid point 5 (6/355) ======================= q-point: ( 0.42 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.640 ( 10.607 -23.101 -0.369) 25.422 3.356 ( -3.688 8.357 2.403) 9.446 3.813 ( 7.805 -15.817 0.988) 17.665 4.044 ( 7.788 -9.500 2.556) 12.548 4.463 ( -2.282 14.457 -7.822) 16.595 4.690 ( 3.018 20.085 12.519) 23.859 5.265 ( -15.383 -7.975 -0.464) 17.333 5.778 ( -5.234 0.222 -8.803) 10.244 6.056 ( -11.488 1.748 -8.498) 14.397 7.281 ( 17.012 -19.877 6.123) 26.869 8.162 ( 12.655 -5.137 7.155) 15.419 8.669 ( -11.258 -0.201 -1.907) 11.421 9.962 ( -0.410 -3.205 0.071) 3.232 10.243 ( 0.684 8.965 0.724) 9.020 11.298 ( -2.977 1.648 1.965) 3.929 11.379 ( -0.469 6.496 -1.351) 6.651 12.304 ( 4.089 3.511 8.598) 10.148 12.816 ( -6.835 7.780 -10.936) 15.061 14.145 ( 10.309 -3.030 0.793) 10.775 14.402 ( 15.081 -0.014 2.138) 15.231 15.325 ( -14.158 -2.541 -1.567) 14.469 15.653 ( -2.635 1.803 0.470) 3.227 16.337 ( -14.102 -14.169 -1.163) 20.025 16.625 ( 5.252 14.971 1.375) 15.925 20.530 ( -1.877 -0.561 -0.516) 2.025 20.886 ( 0.646 -1.703 0.319) 1.849 21.670 ( 1.063 0.598 0.189) 1.234 22.107 ( 2.994 1.485 0.063) 3.342 24.432 ( 0.147 -0.121 -0.116) 0.223 25.372 ( -0.136 -0.028 0.177) 0.225 32.538 ( 0.454 -1.191 -0.256) 1.300 32.656 ( 1.022 -1.260 0.203) 1.635 42.137 ( 1.351 -0.074 -2.958) 3.253 43.577 ( 3.668 -2.752 -0.222) 4.591 44.943 ( 4.662 -4.801 3.391) 7.503 47.657 ( -4.692 -1.299 -4.479) 6.616 ======================= Grid point 6 (7/355) ======================= q-point: (-0.50 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 326 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.072 ( 0.000 -0.000 -0.000) 0.000 3.087 ( -0.000 0.000 0.000) 0.000 4.039 ( 0.000 -0.000 0.000) 0.000 4.181 ( -0.000 -0.000 -0.000) 0.000 4.385 ( 0.000 -0.000 -0.000) 0.000 4.413 ( -0.000 0.000 0.000) 0.000 5.238 ( 0.000 -0.000 0.000) 0.000 5.718 ( 0.000 -0.000 0.000) 0.000 5.991 ( 0.000 -0.000 -0.000) 0.000 7.550 ( 0.000 -0.000 0.000) 0.000 8.338 ( 0.000 -0.000 0.000) 0.000 8.565 ( -0.000 -0.000 -0.000) 0.000 9.998 ( 0.000 -0.000 0.000) 0.000 10.159 ( 0.000 0.000 0.000) 0.000 11.287 ( 0.000 0.000 -0.000) 0.000 11.307 ( -0.000 -0.000 0.000) 0.000 12.339 ( 0.000 -0.000 -0.000) 0.000 12.661 ( 0.000 -0.000 0.000) 0.000 14.223 ( 0.000 -0.000 0.000) 0.000 14.523 ( -0.000 -0.000 0.000) 0.000 15.235 ( 0.000 -0.000 0.000) 0.000 15.617 ( 0.000 -0.000 0.000) 0.000 16.445 ( 0.000 0.000 0.000) 0.000 16.474 ( -0.000 -0.000 0.000) 0.000 20.524 ( 0.000 -0.000 0.000) 0.000 20.905 ( 0.000 -0.000 0.000) 0.000 21.671 ( 0.000 -0.000 0.000) 0.000 22.109 ( 0.000 -0.000 0.000) 0.000 24.433 ( 0.000 -0.000 0.000) 0.000 25.372 ( 0.000 -0.000 0.000) 0.000 32.550 ( 0.000 -0.000 0.000) 0.000 32.673 ( 0.000 -0.000 0.000) 0.000 42.138 ( 0.000 -0.000 0.000) 0.000 43.619 ( 0.000 -0.000 0.000) 0.000 45.017 ( 0.000 -0.000 0.000) 0.000 47.632 ( 0.000 -0.000 0.000) 0.000 ======================= Grid point 14 (8/355) ======================= q-point: ( 0.08 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 354 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.412 ( 17.243 0.000 7.571) 18.832 1.138 ( 47.250 0.000 19.853) 51.252 1.842 ( 80.663 0.000 20.729) 83.284 3.051 ( 21.362 0.000 4.329) 21.796 3.481 ( -14.959 -0.000 -2.254) 15.128 4.134 ( 8.456 0.000 4.369) 9.518 4.726 ( 5.412 0.000 -4.045) 6.756 5.832 ( 3.311 0.000 -0.524) 3.353 6.492 ( -11.195 -0.000 -1.000) 11.239 7.928 ( -9.469 -0.000 -13.781) 16.721 7.956 ( -19.255 -0.000 -2.776) 19.454 8.729 ( 3.926 0.000 15.895) 16.373 9.883 ( -0.969 -0.000 -1.531) 1.812 10.922 ( -24.494 -0.000 49.617) 55.334 11.837 ( 0.505 0.000 -2.478) 2.529 12.063 ( -6.027 -0.000 3.508) 6.974 13.334 ( -2.478 -0.000 2.065) 3.226 13.505 ( 7.349 0.000 -4.531) 8.633 13.518 ( -4.194 -0.000 0.996) 4.311 13.959 ( 5.048 0.000 1.446) 5.251 14.813 ( -3.721 -0.000 -1.327) 3.950 15.410 ( -2.820 -0.000 -3.128) 4.211 15.904 ( 4.205 0.000 0.960) 4.313 18.309 ( 1.085 0.000 -17.184) 17.218 20.689 ( -0.022 -0.000 -0.486) 0.486 20.702 ( 1.366 0.000 0.874) 1.622 21.770 ( 1.982 0.000 -0.398) 2.021 21.806 ( -0.654 -0.000 -0.936) 1.142 24.416 ( -0.514 -0.000 1.247) 1.348 25.371 ( -0.299 -0.000 0.563) 0.637 32.364 ( 2.012 0.000 0.149) 2.017 32.455 ( 1.460 0.000 0.338) 1.499 42.196 ( 0.719 0.000 -6.835) 6.873 44.134 ( 6.342 0.000 2.126) 6.689 44.513 ( 2.596 0.000 -2.186) 3.394 46.348 ( 12.742 0.000 -32.320) 34.741 ======================= Grid point 15 (9/355) ======================= q-point: ( 0.17 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.776 ( 15.104 -17.230 4.902) 23.431 1.758 ( 43.286 -11.469 14.733) 47.141 3.135 ( 51.663 -36.714 12.893) 64.678 3.269 ( 21.523 -7.407 5.107) 23.328 3.485 ( 1.940 -11.088 5.138) 12.374 4.201 ( 7.761 -0.145 -1.985) 8.012 4.835 ( 7.592 -8.423 -8.760) 14.330 5.773 ( 3.463 10.048 -1.343) 10.713 6.331 ( -13.485 4.619 1.507) 14.333 7.593 ( -23.536 12.063 -6.238) 27.173 7.824 ( -10.549 -6.086 -13.632) 18.280 8.812 ( 2.172 3.066 15.242) 15.698 9.868 ( -0.797 -0.404 -2.025) 2.214 10.834 ( -11.466 6.807 27.076) 30.182 11.790 ( 0.316 4.656 -3.582) 5.883 12.012 ( -10.400 1.561 5.157) 11.713 13.087 ( 2.333 19.052 7.664) 20.667 13.414 ( 4.681 6.814 -3.565) 9.003 13.724 ( -6.861 -10.908 -2.913) 13.211 14.156 ( 6.986 -13.294 3.969) 15.534 14.876 ( -8.088 -11.552 -2.782) 14.374 15.473 ( -8.759 -11.506 -3.131) 14.796 15.830 ( 7.325 11.127 0.962) 13.356 17.997 ( 1.530 22.957 -7.668) 24.252 20.625 ( -0.848 4.594 -0.563) 4.706 20.730 ( 1.734 -0.699 0.968) 2.105 21.733 ( 1.879 1.975 0.315) 2.744 21.934 ( 1.149 -8.484 -1.272) 8.656 24.417 ( -0.011 -0.093 0.237) 0.255 25.370 ( -0.439 -0.034 0.732) 0.854 32.399 ( 2.252 -1.114 -0.049) 2.512 32.485 ( 1.991 -1.213 0.435) 2.372 42.169 ( 1.484 0.083 -9.237) 9.356 43.901 ( 26.713 44.333 4.646) 51.967 44.269 ( 9.140 -3.656 2.921) 10.269 46.950 ( -17.309 -46.568 -23.654) 55.025 ======================= Grid point 16 (10/355) ======================= q-point: ( 0.25 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.278 ( 13.996 -22.616 2.721) 26.735 2.462 ( 34.628 -17.790 9.585) 40.094 3.339 ( -2.368 -9.725 -1.346) 10.099 3.714 ( 12.736 -4.254 5.924) 14.676 4.303 ( 5.630 -10.018 1.052) 11.539 4.594 ( 38.221 -40.617 12.756) 57.213 5.071 ( 11.271 -14.830 -14.775) 23.775 5.607 ( 6.822 9.480 -1.740) 11.809 6.069 ( -15.382 11.726 5.193) 20.027 7.079 ( -26.106 14.726 -8.361) 31.117 7.798 ( -5.439 -7.505 -9.716) 13.428 8.808 ( -0.998 5.290 12.497) 13.607 9.866 ( -0.256 -1.161 -2.007) 2.333 10.729 ( -5.917 7.657 16.521) 19.147 11.657 ( -1.151 8.506 -3.113) 9.130 11.848 ( -9.375 7.622 3.288) 12.522 12.840 ( 4.196 18.665 8.485) 20.928 13.325 ( 3.889 7.069 -5.627) 9.837 13.812 ( -3.069 -9.140 -2.840) 10.051 14.464 ( 11.471 -6.680 5.966) 14.553 14.949 ( -14.365 -12.296 -4.972) 19.551 15.462 ( -8.648 -1.298 1.700) 8.909 15.844 ( -0.410 -6.872 -1.031) 6.961 17.599 ( 2.008 23.244 -2.780) 23.495 20.549 ( -1.967 2.109 -0.917) 3.026 20.768 ( 1.949 -1.204 0.922) 2.470 21.727 ( 2.122 1.673 0.315) 2.720 22.059 ( 1.623 -5.191 -1.347) 5.603 24.421 ( 0.206 -0.185 -0.180) 0.331 25.370 ( -0.512 -0.064 0.724) 0.889 32.442 ( 2.318 -1.421 -0.293) 2.734 32.536 ( 2.214 -2.022 0.442) 3.031 42.143 ( 2.397 0.013 -9.840) 10.128 43.660 ( 23.182 20.118 4.176) 30.977 44.477 ( 9.850 -7.180 4.169) 12.882 47.264 ( -17.213 -25.838 -16.804) 35.303 ======================= Grid point 17 (11/355) ======================= q-point: ( 0.33 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.821 ( 13.856 -24.302 1.283) 28.004 3.095 ( 26.538 -16.561 4.734) 31.638 3.469 ( -1.831 -7.325 0.583) 7.572 3.899 ( 9.587 -2.403 2.862) 10.290 4.552 ( -3.023 -18.762 0.945) 19.027 4.995 ( -4.205 12.280 -5.082) 13.940 5.312 ( 13.707 -7.854 -6.072) 16.925 5.696 ( -16.706 13.549 4.299) 21.935 6.050 ( 16.866 -25.088 -1.030) 30.248 6.610 ( -9.103 4.013 -1.040) 10.003 7.901 ( 2.954 -9.850 -3.320) 10.806 8.739 ( -4.728 5.202 8.991) 11.412 9.882 ( -0.091 -1.776 -1.404) 2.266 10.604 ( -2.447 9.718 10.029) 14.178 11.474 ( -3.035 8.792 -2.016) 9.517 11.636 ( -6.766 8.334 0.578) 10.751 12.643 ( 7.177 15.585 8.045) 18.951 13.161 ( -0.670 10.752 -10.385) 14.963 13.967 ( 3.370 -9.819 -0.629) 10.400 14.587 ( 11.297 7.547 4.453) 14.297 14.999 ( -14.225 -13.723 -3.155) 20.016 15.495 ( -6.623 -9.943 3.990) 12.595 15.920 ( -11.159 -8.659 -1.612) 14.217 17.249 ( 4.579 21.478 0.557) 21.968 20.510 ( -1.421 0.043 -0.817) 1.639 20.817 ( 1.877 -1.796 0.800) 2.718 21.719 ( 2.072 1.915 0.156) 2.826 22.121 ( 0.226 -1.955 -1.722) 2.615 24.425 ( 0.243 -0.223 -0.280) 0.433 25.369 ( -0.489 -0.106 0.568) 0.757 32.487 ( 2.117 -1.477 -0.500) 2.629 32.595 ( 1.982 -2.155 0.312) 2.944 42.129 ( 2.754 -0.346 -8.589) 9.027 43.650 ( 18.043 9.267 3.264) 20.544 44.720 ( 8.938 -7.613 4.548) 12.591 47.381 ( -14.239 -16.154 -12.361) 24.830 ======================= Grid point 18 (12/355) ======================= q-point: ( 0.42 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.365 ( 13.724 -23.555 -0.163) 27.262 3.430 ( 1.846 1.439 -0.143) 2.345 3.672 ( 16.571 -13.088 2.653) 21.282 4.011 ( 0.879 -4.272 0.258) 4.369 4.590 ( -11.627 14.660 -13.075) 22.827 4.866 ( -6.288 -19.167 0.831) 20.189 5.159 ( -6.221 25.263 11.121) 28.294 5.653 ( 1.094 -7.434 -0.615) 7.539 5.979 ( -6.794 2.350 -10.680) 12.874 7.097 ( 16.560 -23.551 7.141) 29.662 8.123 ( 4.858 -11.026 -1.398) 12.129 8.639 ( -4.347 4.516 7.058) 9.440 9.911 ( -0.184 -2.492 -0.386) 2.529 10.445 ( 0.201 11.723 4.470) 12.548 11.311 ( -4.178 4.763 -0.935) 6.404 11.456 ( -4.317 6.187 -1.133) 7.629 12.545 ( 10.326 11.258 7.018) 16.811 12.882 ( -3.668 11.757 -11.357) 16.753 14.160 ( 5.108 -6.052 0.316) 7.926 14.585 ( 8.919 4.896 2.895) 10.578 15.050 ( -13.625 -9.724 -1.589) 16.815 15.611 ( -4.134 -4.800 2.934) 6.981 15.941 ( -14.721 -13.555 -0.532) 20.018 16.987 ( 7.900 18.086 2.537) 19.898 20.508 ( 0.171 -0.783 -0.410) 0.900 20.868 ( 1.393 -1.775 0.592) 2.333 21.706 ( 1.656 1.869 0.015) 2.497 22.119 ( -2.060 -0.171 -2.069) 2.924 24.430 ( 0.161 -0.186 -0.229) 0.336 25.369 ( -0.377 -0.147 0.346) 0.533 32.527 ( 1.710 -1.137 -0.564) 2.129 32.644 ( 1.266 -1.573 0.102) 2.022 42.129 ( 2.224 -0.507 -6.016) 6.434 43.705 ( 14.135 5.891 3.132) 15.631 44.924 ( 5.811 -5.066 3.091) 8.305 47.437 ( -10.793 -11.866 -8.319) 18.069 ======================= Grid point 19 (13/355) ======================= q-point: ( 0.50 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.859 ( 12.283 -19.743 -2.130) 23.349 3.276 ( -4.908 13.307 0.079) 14.184 4.004 ( 5.756 -4.514 -5.127) 8.933 4.093 ( -4.477 -9.974 -2.055) 11.125 4.214 ( -10.390 3.454 -7.738) 13.408 4.693 ( -7.820 20.569 3.761) 22.324 5.133 ( 2.092 -10.500 6.102) 12.323 5.690 ( -1.759 -3.814 0.650) 4.251 6.075 ( 16.512 -2.260 3.142) 16.959 7.452 ( -3.589 -8.205 0.393) 8.965 8.217 ( -10.140 -2.713 -6.929) 12.577 8.656 ( 9.265 -0.702 8.569) 12.640 9.959 ( 0.046 -3.143 0.565) 3.194 10.276 ( 1.447 10.217 1.107) 10.378 11.236 ( -3.633 -0.796 -0.084) 3.720 11.335 ( -2.569 3.092 -2.254) 4.609 12.451 ( 4.590 11.430 -6.104) 13.747 12.729 ( 6.537 2.889 3.514) 7.964 14.215 ( -3.000 0.782 -0.544) 3.147 14.558 ( -5.184 6.877 1.845) 8.808 15.117 ( -1.291 -12.044 -1.132) 12.165 15.603 ( -2.884 -0.398 1.283) 3.182 16.106 ( -8.467 -17.497 1.129) 19.471 16.819 ( 10.829 14.916 2.950) 18.667 20.531 ( 1.906 -0.638 0.022) 2.010 20.903 ( 0.738 -0.711 0.286) 1.064 21.689 ( 0.687 1.596 -0.181) 1.747 22.077 ( -4.458 -0.193 -2.081) 4.924 24.432 ( 0.017 -0.088 -0.116) 0.146 25.370 ( -0.220 -0.157 0.134) 0.302 32.552 ( 1.197 -0.341 -0.458) 1.326 32.670 ( 0.269 -0.475 -0.083) 0.552 42.132 ( 0.986 -0.370 -2.902) 3.088 43.744 ( 10.976 6.711 3.641) 13.370 45.013 ( 0.762 -0.531 -0.299) 0.976 47.505 ( -6.398 -10.134 -3.770) 12.564 ======================= Grid point 20 (14/355) ======================= q-point: (-0.42 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.919 ( -7.517 20.906 -0.469) 22.221 3.213 ( 6.460 -12.010 -4.515) 14.365 3.795 ( -16.509 2.931 -13.205) 21.343 4.219 ( -11.725 -5.263 3.402) 13.295 4.270 ( -2.533 -8.749 -6.443) 11.157 4.430 ( 14.181 9.674 7.611) 18.778 5.399 ( 11.139 -10.355 3.819) 15.681 5.794 ( 4.682 -4.925 4.494) 8.147 6.279 ( 18.169 3.054 9.982) 20.954 7.317 ( -18.773 8.867 -5.757) 21.545 8.026 ( -16.095 1.999 -9.569) 18.831 8.822 ( 11.856 0.234 5.782) 13.193 10.005 ( 0.737 -0.188 0.475) 0.897 10.175 ( 0.665 2.110 0.637) 2.302 11.258 ( -1.275 -4.573 -1.738) 5.056 11.289 ( -1.866 -1.768 -0.828) 2.701 12.294 ( 5.190 6.606 -9.736) 12.859 12.866 ( 10.882 -2.776 9.642) 14.802 14.072 ( -16.148 5.164 -1.374) 17.009 14.298 ( -15.659 7.107 -0.175) 17.197 15.383 ( 10.134 -10.679 -0.047) 14.722 15.621 ( 0.005 -2.957 0.798) 3.063 16.315 ( -4.533 -14.067 0.145) 14.780 16.736 ( 15.197 11.630 3.697) 19.491 20.565 ( 3.354 -0.141 0.398) 3.380 20.907 ( 0.336 0.983 0.089) 1.043 21.665 ( -0.640 1.060 -0.549) 1.355 22.024 ( -6.833 -1.292 -1.867) 7.200 24.432 ( -0.121 0.034 0.007) 0.126 25.371 ( -0.067 -0.126 -0.036) 0.148 32.556 ( 0.686 0.760 -0.221) 1.048 32.664 ( -0.658 0.815 -0.200) 1.066 42.132 ( -0.479 -0.173 -0.062) 0.513 43.721 ( 7.861 9.790 4.301) 13.271 44.954 ( -4.444 3.951 -4.066) 7.203 47.617 ( -1.664 -8.873 0.593) 9.047 ======================= Grid point 21 (15/355) ======================= q-point: (-0.33 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.451 ( -7.824 24.948 -0.859) 26.160 3.318 ( -7.792 -3.530 -5.853) 10.365 3.553 ( -10.002 4.847 -7.671) 13.505 3.987 ( 3.102 19.035 2.842) 19.494 4.518 ( -0.808 -18.036 0.939) 18.079 4.576 ( 2.804 -9.632 0.202) 10.034 5.588 ( 16.215 8.574 -1.228) 18.384 6.032 ( 6.970 -9.453 12.486) 17.142 6.456 ( 15.545 -2.425 9.349) 18.301 6.746 ( -26.244 27.064 -9.988) 39.000 7.829 ( -11.378 -1.914 -8.348) 14.241 8.902 ( 8.633 4.860 2.213) 10.151 9.967 ( 0.101 3.746 0.047) 3.748 10.236 ( 0.089 -6.943 0.025) 6.944 11.315 ( 1.448 -4.918 -3.070) 5.975 11.382 ( -1.315 -9.708 0.882) 9.836 12.267 ( 9.576 0.368 -8.603) 12.879 13.080 ( 9.306 -4.312 10.058) 14.366 13.749 ( -27.022 3.163 -1.581) 27.252 14.074 ( -14.862 1.934 -2.030) 15.124 15.583 ( 9.886 -1.357 -0.457) 9.990 15.692 ( 1.398 -2.625 0.288) 2.988 16.449 ( -2.053 -4.778 -1.063) 5.307 16.812 ( 19.252 1.217 5.297) 20.005 20.605 ( 4.215 0.271 0.687) 4.279 20.882 ( 0.828 2.464 0.379) 2.627 21.639 ( -1.951 -0.002 -1.022) 2.203 21.965 ( -9.172 -2.071 -1.864) 9.585 24.429 ( -0.190 0.136 0.097) 0.253 25.372 ( 0.042 -0.069 -0.155) 0.175 32.539 ( 0.303 1.854 0.076) 1.880 32.630 ( -1.205 1.935 -0.274) 2.296 42.128 ( -1.685 -0.192 1.818) 2.486 43.606 ( 3.968 13.483 4.267) 14.689 44.775 ( -7.436 6.855 -6.065) 11.793 47.766 ( 2.362 -7.016 3.740) 8.294 ======================= Grid point 22 (16/355) ======================= q-point: (-0.25 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.936 ( -6.877 26.984 -0.840) 27.859 3.160 ( -17.198 4.652 -4.878) 18.472 3.242 ( 0.881 25.735 0.819) 25.763 3.805 ( 4.558 6.335 -0.446) 7.817 4.723 ( 2.933 -4.476 -5.318) 7.544 4.801 ( -1.583 -11.939 3.418) 12.519 5.421 ( -0.696 23.720 0.932) 23.749 5.843 ( -19.236 39.715 -6.524) 44.608 6.209 ( 9.303 1.025 6.899) 11.627 6.876 ( 11.989 -22.186 4.440) 25.606 7.837 ( -1.796 -10.077 -1.774) 10.388 8.850 ( 4.061 9.053 -1.364) 10.016 9.916 ( -0.542 2.023 0.480) 2.148 10.363 ( -0.054 -8.279 -2.697) 8.707 11.432 ( 2.057 -7.774 -1.478) 8.176 11.575 ( 0.584 -13.404 0.013) 13.417 12.383 ( 12.917 -4.392 -6.896) 15.287 13.227 ( 1.081 0.826 7.553) 7.674 13.525 ( -22.171 -9.767 0.754) 24.239 13.903 ( -15.701 -1.808 -5.002) 16.578 15.657 ( 8.100 4.861 -1.771) 9.611 15.691 ( 2.360 2.860 1.715) 4.085 16.430 ( 0.972 5.238 -0.226) 5.332 17.088 ( 15.888 -8.200 4.783) 18.508 20.641 ( 3.511 0.614 0.609) 3.616 20.856 ( 3.149 3.144 1.359) 4.653 21.616 ( -3.643 -1.244 -1.619) 4.176 21.892 ( -10.123 -1.983 -1.997) 10.507 24.425 ( -0.169 0.193 0.113) 0.280 25.373 ( 0.090 -0.011 -0.210) 0.229 32.503 ( 0.127 2.623 0.311) 2.645 32.578 ( -1.215 2.570 -0.303) 2.859 42.124 ( -2.357 -0.567 2.298) 3.341 43.387 ( -1.088 16.190 2.661) 16.443 44.546 ( -6.970 8.080 -5.241) 11.889 47.926 ( 5.360 -4.869 5.502) 9.094 ======================= Grid point 23 (17/355) ======================= q-point: (-0.17 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.415 ( -4.616 27.838 -0.441) 28.222 2.584 ( -0.378 44.131 1.898) 44.173 3.000 ( -9.364 3.890 -1.989) 10.333 3.803 ( 3.277 -0.311 -1.238) 3.517 4.293 ( -14.064 61.856 -7.175) 63.839 4.761 ( 3.830 18.733 -0.609) 19.130 4.912 ( -10.268 4.972 0.937) 11.447 5.467 ( 1.441 -0.083 2.775) 3.128 6.351 ( 6.845 -5.678 1.150) 8.968 7.354 ( 6.606 -20.843 2.214) 21.977 8.081 ( 3.776 -14.895 4.585) 16.036 8.675 ( -0.443 11.808 -4.913) 12.797 9.894 ( -0.317 0.416 0.685) 0.862 10.477 ( -0.294 -7.438 -4.721) 8.815 11.586 ( 1.224 -8.623 -0.298) 8.714 11.832 ( 2.242 -15.172 -0.535) 15.346 12.567 ( 9.832 -5.513 -4.534) 12.150 13.199 ( -9.004 -4.688 3.418) 10.711 13.613 ( -4.461 -10.603 3.857) 12.132 13.793 ( -13.370 -6.317 -6.103) 15.997 15.528 ( 2.169 11.795 -1.927) 12.147 15.713 ( 4.742 3.684 2.265) 6.418 16.311 ( 3.047 10.782 0.780) 11.232 17.387 ( 7.576 -10.128 3.081) 13.018 20.655 ( 1.313 0.685 0.188) 1.493 20.852 ( 5.020 3.716 1.958) 6.545 21.592 ( -5.214 -2.310 -1.961) 6.031 21.823 ( -6.811 -1.389 -1.454) 7.102 24.421 ( -0.078 0.200 0.040) 0.219 25.372 ( 0.073 0.026 -0.167) 0.184 32.460 ( 0.123 2.774 0.313) 2.795 32.522 ( -0.733 2.605 -0.206) 2.714 42.123 ( -2.334 -1.233 1.381) 2.979 43.078 ( -5.344 17.017 0.028) 17.836 44.336 ( -3.856 8.074 -2.511) 9.293 48.083 ( 6.720 -3.518 5.668) 9.469 ======================= Grid point 24 (18/355) ======================= q-point: (-0.08 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 354 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.921 ( -0.000 27.936 0.000) 27.936 1.783 ( -0.000 51.123 0.000) 51.123 2.879 ( -0.000 3.858 0.000) 3.858 2.932 ( -0.000 81.637 0.000) 81.637 3.847 ( 0.000 -2.283 -0.000) 2.283 4.337 ( -0.000 29.264 0.000) 29.264 4.803 ( -0.000 5.066 0.000) 5.066 5.600 ( 0.000 -9.783 -0.000) 9.783 6.501 ( 0.000 -6.774 -0.000) 6.774 7.715 ( 0.000 -17.350 -0.000) 17.350 8.371 ( 0.000 -12.666 -0.000) 12.666 8.428 ( -0.000 12.960 0.000) 12.960 9.895 ( 0.000 -0.240 -0.000) 0.240 10.569 ( 0.000 -5.687 -0.000) 5.687 11.725 ( 0.000 -6.898 -0.000) 6.898 12.095 ( 0.000 -13.730 -0.000) 13.730 12.701 ( 0.000 -7.525 -0.000) 7.525 13.274 ( 0.000 -6.143 -0.000) 6.143 13.764 ( 0.000 -10.013 -0.000) 10.013 13.828 ( 0.000 -6.938 -0.000) 6.938 15.336 ( -0.000 10.719 0.000) 10.719 15.644 ( -0.000 7.469 0.000) 7.469 16.149 ( -0.000 12.085 0.000) 12.085 17.583 ( 0.000 -8.477 -0.000) 8.477 20.654 ( -0.000 0.031 0.000) 0.031 20.820 ( -0.000 4.426 0.000) 4.426 21.594 ( 0.000 -2.568 -0.000) 2.568 21.803 ( 0.000 -0.862 -0.000) 0.862 24.417 ( -0.000 0.166 0.000) 0.166 25.372 ( -0.000 0.035 0.000) 0.035 32.420 ( -0.000 2.149 0.000) 2.149 32.478 ( -0.000 2.143 0.000) 2.143 42.137 ( 0.000 -2.068 -0.000) 2.068 42.753 ( -0.000 15.823 0.000) 15.823 44.185 ( -0.000 6.792 0.000) 6.792 48.207 ( 0.000 -3.386 -0.000) 3.386 ======================= Grid point 27 (19/355) ======================= q-point: ( 0.17 0.17 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 355 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.829 ( 17.591 0.000 7.524) 19.132 2.238 ( 44.748 0.000 18.883) 48.569 3.173 ( -2.102 -0.000 -6.698) 7.020 3.597 ( 66.599 0.000 19.335) 69.349 3.619 ( 26.185 0.000 8.152) 27.424 4.269 ( 4.699 0.000 -3.667) 5.960 4.741 ( 3.600 0.000 -16.730) 17.113 5.910 ( 5.429 0.000 -2.180) 5.850 6.267 ( -10.668 -0.000 5.984) 12.231 7.385 ( -31.074 -0.000 -8.838) 32.306 7.602 ( -9.643 -0.000 -11.911) 15.325 8.924 ( 0.949 0.000 14.414) 14.445 9.843 ( -1.202 -0.000 -2.150) 2.464 10.877 ( -14.654 -0.000 25.954) 29.805 11.820 ( 0.208 0.000 -2.767) 2.775 11.931 ( -9.872 -0.000 2.880) 10.284 13.316 ( -1.592 -0.000 2.843) 3.258 13.459 ( -4.009 -0.000 1.733) 4.368 13.618 ( 5.045 0.000 1.602) 5.293 14.012 ( -2.266 -0.000 4.237) 4.805 14.767 ( 1.334 0.000 -1.645) 2.118 15.287 ( -5.091 -0.000 -6.243) 8.055 16.005 ( 4.482 0.000 0.938) 4.579 18.112 ( -8.217 -0.000 -9.656) 12.679 20.688 ( 0.621 0.000 -0.762) 0.983 20.753 ( 2.576 0.000 1.365) 2.915 21.776 ( -1.090 -0.000 -1.594) 1.931 21.818 ( 2.609 0.000 0.577) 2.672 24.417 ( 0.115 0.000 -0.041) 0.122 25.369 ( -0.636 -0.000 0.937) 1.132 32.418 ( 3.071 0.000 0.052) 3.072 32.498 ( 2.381 0.000 0.467) 2.427 42.141 ( 2.540 0.000 -11.428) 11.707 44.339 ( 11.114 0.000 3.825) 11.753 44.557 ( 4.498 0.000 -3.798) 5.888 46.286 ( 3.332 0.000 -15.954) 16.298 ======================= Grid point 28 (20/355) ======================= q-point: ( 0.25 0.17 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.153 ( 17.074 -12.920 6.090) 22.261 2.777 ( 42.948 -2.916 16.167) 45.982 3.150 ( -2.375 -5.058 -3.765) 6.737 3.871 ( 16.060 1.003 5.442) 16.987 4.253 ( 0.224 -0.090 -6.194) 6.199 4.565 ( 53.724 -23.421 14.516) 60.379 4.824 ( 6.922 -14.174 -19.763) 25.286 5.851 ( 7.085 10.545 -2.594) 12.966 6.154 ( -9.186 7.370 10.423) 15.727 6.943 ( -31.185 8.280 -9.415) 33.611 7.557 ( -3.815 -8.743 -9.562) 13.506 8.945 ( -1.634 4.660 12.265) 13.222 9.832 ( -0.786 -1.090 -2.038) 2.441 10.819 ( -10.578 3.391 19.035) 22.039 11.760 ( -0.608 5.601 -2.489) 6.160 11.836 ( -10.586 1.468 1.910) 10.857 13.205 ( 2.242 12.992 7.851) 15.345 13.424 ( -3.840 1.833 -5.406) 6.880 13.592 ( -1.856 -0.767 1.972) 2.815 14.255 ( -1.313 -21.597 6.149) 22.493 14.785 ( 0.891 -0.259 -1.956) 2.165 15.275 ( -7.842 -7.418 -4.898) 11.854 15.950 ( 3.831 9.943 0.785) 10.684 17.872 ( -6.660 11.881 -6.150) 14.945 20.620 ( 0.913 6.566 -0.484) 6.647 20.788 ( 2.863 -0.143 1.294) 3.145 21.764 ( 0.936 0.201 -0.497) 1.079 21.923 ( -0.149 -8.048 -1.122) 8.127 24.419 ( 0.257 -0.112 -0.334) 0.436 25.366 ( -0.756 -0.049 0.948) 1.214 32.454 ( 3.038 -0.495 -0.180) 3.084 32.535 ( 2.485 -1.103 0.417) 2.750 42.119 ( 3.626 -0.200 -11.967) 12.506 44.301 ( 14.058 26.379 -0.587) 29.897 44.510 ( 11.972 -3.827 4.363) 13.305 46.552 ( -7.989 -29.309 -14.673) 33.736 ======================= Grid point 29 (21/355) ======================= q-point: ( 0.33 0.17 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.620 ( 16.677 -19.215 3.922) 25.744 3.268 ( 4.864 -8.212 0.595) 9.563 3.323 ( 34.088 -6.616 11.121) 36.462 3.945 ( 1.833 0.696 -2.253) 2.987 4.257 ( -4.727 -9.363 -9.869) 14.401 5.007 ( 0.728 -3.011 -15.250) 15.561 5.273 ( 17.120 -9.334 5.862) 20.361 5.882 ( 1.575 2.310 1.483) 3.165 5.934 ( -0.565 7.089 5.980) 9.291 6.561 ( -5.196 0.539 -0.020) 5.224 7.710 ( 3.835 -12.676 -6.046) 14.558 8.860 ( -4.088 7.616 10.519) 13.615 9.842 ( -0.388 -1.779 -1.664) 2.466 10.737 ( -6.660 5.071 13.274) 15.693 11.599 ( -3.355 9.864 -1.285) 10.498 11.681 ( -7.689 5.767 -1.322) 9.701 13.033 ( 6.868 16.254 8.629) 19.642 13.262 ( -4.710 7.929 -10.356) 13.867 13.717 ( -2.053 -14.749 1.565) 14.973 14.635 ( -1.899 -20.288 5.700) 21.159 14.755 ( 0.078 2.976 -1.630) 3.394 15.288 ( -9.614 -6.138 0.083) 11.407 15.821 ( -1.818 5.995 -0.234) 6.269 17.587 ( -1.142 14.571 -2.117) 14.768 20.534 ( 1.029 3.975 -0.348) 4.121 20.826 ( 2.762 -0.436 1.090) 3.001 21.765 ( 1.395 1.033 -0.374) 1.776 22.026 ( -2.188 -5.901 -2.110) 6.638 24.423 ( 0.278 -0.192 -0.419) 0.539 25.364 ( -0.748 -0.120 0.777) 1.085 32.492 ( 2.749 -0.768 -0.482) 2.895 32.584 ( 2.179 -1.690 0.241) 2.768 42.111 ( 4.153 -0.427 -10.614) 11.406 44.090 ( 17.305 17.837 1.452) 24.895 44.733 ( 11.710 -5.290 5.232) 13.874 46.827 ( -13.364 -24.045 -13.284) 30.549 ======================= Grid point 30 (22/355) ======================= q-point: ( 0.42 0.17 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.143 ( 16.565 -21.396 1.819) 27.119 3.429 ( 1.799 -4.748 0.486) 5.101 3.765 ( 27.278 -3.633 5.451) 28.054 3.887 ( -10.936 -2.828 -7.145) 13.365 4.415 ( -1.806 -16.883 -11.462) 20.486 4.712 ( -13.306 15.260 -8.293) 21.879 5.517 ( -9.448 -3.503 2.659) 10.421 5.579 ( -3.346 18.798 12.935) 23.062 5.900 ( 7.529 -5.598 -8.593) 12.722 6.960 ( 19.543 -17.182 8.436) 27.355 7.948 ( 4.220 -11.726 -5.055) 13.449 8.743 ( -2.765 6.128 9.891) 11.960 9.868 ( -0.081 -2.318 -0.916) 2.494 10.631 ( -3.259 7.842 8.239) 11.832 11.381 ( -4.525 9.273 -2.671) 10.658 11.499 ( -5.839 6.473 -2.033) 8.951 12.912 ( 12.036 14.036 7.613) 19.996 12.990 ( -4.779 11.114 -11.800) 16.900 14.001 ( 0.969 -16.412 1.545) 16.513 14.690 ( -1.391 0.788 -2.062) 2.610 14.865 ( -1.844 -2.905 4.863) 5.958 15.366 ( -9.601 -16.106 4.052) 19.183 15.706 ( -8.550 1.163 -1.381) 8.738 17.351 ( 4.132 15.059 0.988) 15.646 20.509 ( 1.554 0.557 -0.298) 1.677 20.867 ( 2.323 -0.826 0.872) 2.615 21.752 ( 1.009 1.675 -0.597) 2.045 22.053 ( -3.842 -2.267 -2.494) 5.111 24.427 ( 0.191 -0.205 -0.357) 0.454 25.363 ( -0.613 -0.210 0.511) 0.825 32.528 ( 2.325 -0.819 -0.692) 2.561 32.631 ( 1.458 -1.575 0.005) 2.147 42.117 ( 3.706 -0.481 -7.887) 8.727 44.036 ( 17.083 11.306 2.887) 20.688 44.938 ( 8.794 -3.307 4.234) 10.305 46.995 ( -13.686 -19.815 -10.638) 26.327 ======================= Grid point 31 (23/355) ======================= q-point: ( 0.50 0.17 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.660 ( 15.795 -19.897 -0.611) 25.412 3.408 ( -2.773 6.693 -1.980) 7.510 3.800 ( -15.679 -6.998 -9.847) 19.793 3.994 ( 6.182 -1.939 -7.422) 9.852 4.190 ( -17.505 12.829 -3.036) 21.914 4.726 ( 7.860 -11.643 -2.295) 14.234 5.295 ( 4.429 17.010 15.386) 23.360 5.525 ( -7.090 -10.661 -1.151) 12.856 6.208 ( 20.891 -7.923 3.389) 22.598 7.288 ( -1.507 -6.700 2.545) 7.324 8.040 ( -7.954 -2.801 -7.144) 11.052 8.760 ( 6.447 -1.419 9.229) 11.347 9.913 ( 0.618 -3.070 0.040) 3.132 10.480 ( -0.563 10.931 3.432) 11.471 11.214 ( -3.618 3.538 -2.738) 5.754 11.342 ( -5.280 4.279 -1.984) 7.080 12.691 ( 3.198 14.187 -10.455) 17.911 12.920 ( 12.614 6.285 7.353) 15.896 14.168 ( -4.748 -2.264 -0.273) 5.267 14.668 ( -4.435 9.655 2.866) 11.004 14.857 ( -2.885 -12.921 -0.815) 13.265 15.555 ( -4.412 -3.485 3.827) 6.801 15.706 ( -8.304 -19.205 -0.063) 20.923 17.178 ( 8.113 13.879 2.690) 16.300 20.534 ( 2.168 -1.190 -0.243) 2.486 20.905 ( 1.768 -0.676 0.677) 2.010 21.723 ( -0.202 1.933 -1.036) 2.202 22.013 ( -4.915 0.039 -2.253) 5.407 24.430 ( 0.053 -0.148 -0.231) 0.279 25.364 ( -0.409 -0.277 0.256) 0.556 32.557 ( 1.789 -0.506 -0.733) 1.998 32.662 ( 0.546 -0.853 -0.143) 1.023 42.125 ( 2.399 -0.258 -4.705) 5.288 44.051 ( 16.196 9.597 4.581) 19.375 45.029 ( 2.748 1.135 0.585) 3.030 47.150 ( -10.618 -18.503 -6.537) 22.313 ======================= Grid point 32 (24/355) ======================= q-point: (-0.42 0.17 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.061 ( 7.519 -10.610 -3.435) 13.450 3.176 ( -2.578 13.566 -2.083) 13.965 3.573 ( -17.920 3.225 -17.934) 25.557 3.950 ( -15.401 -9.300 5.578) 18.836 4.057 ( -4.094 -5.881 -7.662) 10.490 4.954 ( 25.654 10.902 9.311) 29.389 5.283 ( 3.679 -7.506 9.005) 12.287 5.729 ( 4.520 -11.853 0.691) 12.705 6.523 ( 18.110 -2.551 6.651) 19.461 7.199 ( -17.631 4.158 -3.361) 18.424 7.856 ( -16.604 2.996 -8.630) 18.951 8.933 ( 9.194 -3.048 6.354) 11.584 9.982 ( 1.597 -3.537 0.896) 3.983 10.302 ( -0.030 10.498 0.585) 10.514 11.169 ( -1.849 -2.268 -1.944) 3.513 11.242 ( -4.265 0.601 -1.753) 4.651 12.498 ( 10.430 11.352 -8.747) 17.724 13.017 ( 12.928 1.947 7.623) 15.134 14.003 ( -17.187 7.408 -1.170) 18.752 14.335 ( -13.219 14.557 0.982) 19.688 15.199 ( 6.198 -19.691 -0.009) 20.643 15.568 ( -1.729 -2.907 1.223) 3.597 16.003 ( -3.644 -19.433 1.467) 19.826 17.079 ( 11.250 10.966 3.564) 16.109 20.582 ( 2.579 -1.600 -0.151) 3.038 20.928 ( 1.499 0.242 0.584) 1.627 21.674 ( -2.072 1.759 -1.702) 3.207 21.944 ( -5.342 0.854 -1.489) 5.611 24.430 ( -0.069 -0.049 -0.096) 0.128 25.366 ( -0.210 -0.280 0.070) 0.357 32.572 ( 1.164 0.192 -0.610) 1.328 32.668 ( -0.199 0.247 -0.134) 0.344 42.128 ( 0.809 0.069 -1.909) 2.075 44.056 ( 14.945 12.035 6.464) 20.248 44.958 ( -4.452 4.851 -4.216) 7.818 47.350 ( -5.845 -17.499 -2.209) 18.581 ======================= Grid point 33 (25/355) ======================= q-point: (-0.33 0.17 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.788 ( -4.567 22.662 -0.868) 23.134 3.147 ( -10.585 -0.884 -6.159) 12.278 3.406 ( -4.251 -5.446 -11.008) 12.996 4.043 ( -4.645 -8.328 1.179) 9.609 4.191 ( -3.249 -17.795 -1.181) 18.128 4.929 ( 22.947 24.505 12.584) 35.852 5.659 ( 10.602 -20.184 1.773) 22.868 5.933 ( 3.987 -5.590 2.911) 7.458 6.673 ( 5.993 4.729 3.035) 8.216 6.820 ( -17.746 14.672 -2.808) 23.196 7.632 ( -13.065 -1.374 -8.135) 15.452 9.051 ( 6.544 1.614 3.258) 7.486 10.043 ( 2.377 1.980 0.835) 3.205 10.173 ( -1.534 1.202 0.088) 1.951 11.221 ( -0.505 -6.211 -2.181) 6.602 11.232 ( -2.391 -4.214 -0.370) 4.859 12.443 ( 16.844 7.300 -6.855) 19.596 13.167 ( 9.611 -1.991 6.742) 11.908 13.603 ( -25.054 12.045 0.072) 27.799 14.013 ( -12.922 8.564 -1.139) 15.544 15.539 ( 5.613 -12.598 -1.234) 13.847 15.631 ( -0.041 -4.633 1.174) 4.779 16.261 ( -1.463 -13.471 0.257) 13.552 17.079 ( 13.190 5.567 4.188) 14.917 20.633 ( 2.551 -1.320 -0.026) 2.872 20.935 ( 2.107 1.288 0.862) 2.615 21.611 ( -3.934 0.971 -2.266) 4.642 21.869 ( -5.273 1.007 -0.793) 5.427 24.429 ( -0.120 0.054 0.005) 0.132 25.369 ( -0.068 -0.215 -0.036) 0.228 32.568 ( 0.588 1.079 -0.351) 1.278 32.649 ( -0.542 1.463 -0.062) 1.561 42.122 ( -0.420 0.275 -0.077) 0.508 43.981 ( 11.691 17.401 7.018) 22.107 44.771 ( -8.294 5.675 -6.799) 12.134 47.586 ( -1.705 -15.276 0.628) 15.383 ======================= Grid point 34 (26/355) ======================= q-point: (-0.25 0.17 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.330 ( -3.110 26.335 -0.655) 26.526 3.014 ( -9.531 -0.044 -3.721) 10.231 3.429 ( -0.900 -1.225 -3.385) 3.711 4.059 ( 1.569 7.501 0.235) 7.667 4.508 ( -0.585 -19.956 0.516) 19.971 4.793 ( 10.773 13.212 6.148) 18.122 5.798 ( 2.510 16.887 -3.416) 17.411 6.193 ( 0.541 -14.877 2.470) 15.091 6.235 ( -10.809 23.691 -2.082) 26.124 6.727 ( 4.726 -2.127 3.532) 6.272 7.618 ( -3.501 -9.854 -3.462) 11.016 9.033 ( 2.991 7.304 0.821) 7.936 9.969 ( 0.085 5.041 0.011) 5.041 10.239 ( -0.052 -6.477 0.177) 6.479 11.315 ( 0.527 -6.875 -1.071) 6.977 11.356 ( -1.062 -11.350 -0.173) 11.401 12.521 ( 19.920 2.733 -4.785) 20.668 13.161 ( -27.229 2.745 0.577) 27.373 13.364 ( 10.333 -1.174 6.592) 12.313 13.762 ( -12.743 4.698 -3.635) 14.060 15.704 ( 3.567 -3.907 -1.776) 5.580 15.713 ( -0.019 -2.751 1.372) 3.074 16.409 ( -0.828 -5.338 -0.368) 5.414 17.185 ( 10.152 -1.352 3.204) 10.731 20.669 ( 1.457 -0.390 -0.008) 1.508 20.942 ( 3.314 1.592 1.313) 3.904 21.547 ( -4.756 -0.020 -2.154) 5.221 21.804 ( -3.729 0.762 -0.422) 3.830 24.427 ( -0.087 0.136 0.039) 0.166 25.371 ( 0.002 -0.115 -0.062) 0.131 32.545 ( 0.227 1.941 -0.055) 1.955 32.611 ( -0.473 2.425 -0.049) 2.472 42.112 ( -0.816 0.250 0.526) 1.002 43.756 ( 4.699 22.057 3.873) 22.882 44.578 ( -5.344 5.615 -4.357) 8.892 47.819 ( 0.622 -12.263 1.479) 12.368 ======================= Grid point 35 (27/355) ======================= q-point: (-0.17 0.17 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 355 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.857 ( -0.000 27.705 0.000) 27.705 2.937 ( -0.000 3.165 0.000) 3.165 3.266 ( -0.000 23.515 0.000) 23.515 3.870 ( -0.000 9.385 0.000) 9.385 4.785 ( 0.000 -10.120 -0.000) 10.120 4.810 ( 0.000 -4.124 -0.000) 4.124 5.218 ( -0.000 45.913 0.000) 45.913 5.735 ( -0.000 25.688 0.000) 25.688 6.333 ( 0.000 -1.310 -0.000) 1.310 7.016 ( 0.000 -22.925 -0.000) 22.925 7.822 ( 0.000 -16.084 -0.000) 16.084 8.884 ( -0.000 12.022 0.000) 12.022 9.911 ( -0.000 1.977 0.000) 1.977 10.350 ( 0.000 -6.774 -0.000) 6.774 11.446 ( 0.000 -8.458 -0.000) 8.458 11.576 ( 0.000 -15.174 -0.000) 15.174 12.612 ( -0.000 1.255 0.000) 1.255 13.009 ( 0.000 -5.668 -0.000) 5.668 13.538 ( 0.000 -7.190 -0.000) 7.190 13.602 ( -0.000 1.124 0.000) 1.124 15.686 ( -0.000 5.964 0.000) 5.964 15.765 ( 0.000 -0.924 -0.000) 0.924 16.425 ( -0.000 2.565 0.000) 2.565 17.313 ( 0.000 -5.987 -0.000) 5.987 20.673 ( -0.000 0.609 0.000) 0.609 20.939 ( -0.000 2.270 0.000) 2.270 21.520 ( 0.000 -1.228 -0.000) 1.228 21.777 ( 0.000 -0.157 -0.000) 0.157 24.424 ( -0.000 0.186 0.000) 0.186 25.372 ( 0.000 -0.025 -0.000) 0.025 32.508 ( -0.000 2.635 0.000) 2.635 32.563 ( -0.000 2.760 0.000) 2.760 42.106 ( 0.000 -0.088 -0.000) 0.088 43.404 ( -0.000 22.306 0.000) 22.306 44.437 ( -0.000 7.059 0.000) 7.059 48.008 ( 0.000 -9.001 -0.000) 9.001 ======================= Grid point 40 (28/355) ======================= q-point: ( 0.25 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 354 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.249 ( 17.650 0.000 7.130) 19.036 3.086 ( 2.275 0.000 -4.747) 5.264 3.258 ( 40.290 0.000 17.646) 43.985 3.987 ( -2.563 -0.000 -2.752) 3.761 4.250 ( -0.299 -0.000 -7.626) 7.632 4.679 ( 15.902 0.000 -16.497) 22.913 4.965 ( 46.243 0.000 10.167) 47.347 5.991 ( 3.977 0.000 -6.245) 7.404 6.190 ( -8.192 -0.000 12.067) 14.584 6.682 ( -23.691 -0.000 -5.434) 24.306 7.419 ( 3.223 0.000 -8.039) 8.661 9.016 ( -3.360 -0.000 10.646) 11.163 9.805 ( -0.680 -0.000 -1.709) 1.840 10.820 ( -10.762 -0.000 17.266) 20.345 11.727 ( -13.560 -0.000 5.640) 14.686 11.801 ( 1.870 0.000 -7.210) 7.448 13.318 ( -0.426 -0.000 1.770) 1.820 13.328 ( -10.252 -0.000 -0.299) 10.256 13.731 ( 2.524 0.000 6.576) 7.043 14.023 ( -0.933 -0.000 8.524) 8.575 14.810 ( 3.092 0.000 -1.200) 3.317 15.098 ( -6.636 -0.000 -9.091) 11.255 16.088 ( 3.100 0.000 0.452) 3.133 17.820 ( -12.901 -0.000 -6.909) 14.635 20.703 ( 1.542 0.000 -0.776) 1.726 20.825 ( 3.285 0.000 1.312) 3.537 21.737 ( -1.199 -0.000 -1.789) 2.154 21.878 ( 2.652 0.000 0.891) 2.798 24.419 ( 0.328 0.000 -0.508) 0.605 25.362 ( -0.918 -0.000 1.007) 1.362 32.479 ( 2.939 0.000 -0.298) 2.954 32.553 ( 2.528 0.000 0.360) 2.554 42.104 ( 4.966 0.000 -12.387) 13.345 44.618 ( 5.195 0.000 -4.416) 6.818 44.628 ( 13.253 0.000 4.796) 14.094 46.191 ( -0.678 -0.000 -10.367) 10.389 ======================= Grid point 41 (29/355) ======================= q-point: ( 0.33 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.553 ( 17.178 -11.245 5.867) 21.354 3.155 ( 5.701 -5.610 -1.877) 8.216 3.731 ( 28.069 -0.922 14.796) 31.743 3.867 ( -5.282 -2.509 -12.779) 14.053 4.134 ( -0.036 4.706 -10.698) 11.687 4.911 ( 13.610 -7.101 -8.064) 17.340 5.336 ( 6.899 -2.681 2.933) 7.961 5.863 ( -9.630 4.097 -11.434) 15.500 6.090 ( -9.201 7.229 10.076) 15.442 6.621 ( 18.858 -1.097 7.689) 20.395 7.557 ( 11.159 -9.388 -5.499) 15.585 8.970 ( -5.592 5.145 9.102) 11.858 9.804 ( -0.327 -1.276 -1.326) 1.869 10.777 ( -8.322 1.893 13.253) 15.764 11.610 ( -13.447 1.298 3.740) 14.018 11.736 ( 1.282 5.876 -6.381) 8.768 13.177 ( -10.818 2.150 -4.867) 12.056 13.324 ( 1.738 3.086 5.278) 6.357 13.680 ( 4.481 6.339 5.953) 9.783 14.270 ( -2.549 -19.814 7.709) 21.413 14.804 ( 0.526 2.585 -1.643) 3.108 15.066 ( -7.445 -7.864 -6.411) 12.584 16.003 ( 1.195 11.968 0.358) 12.033 17.647 ( -10.137 2.010 -4.699) 11.352 20.649 ( 2.217 6.541 -0.381) 6.917 20.862 ( 3.293 0.212 1.149) 3.494 21.750 ( -1.187 -2.586 -1.793) 3.363 21.930 ( 1.216 -2.847 0.248) 3.105 24.421 ( 0.326 -0.107 -0.551) 0.649 25.358 ( -0.928 -0.087 0.870) 1.275 32.508 ( 2.567 -0.338 -0.517) 2.640 32.586 ( 2.230 -0.857 0.210) 2.398 42.105 ( 5.541 -0.196 -11.043) 12.357 44.498 ( 8.357 14.062 -3.044) 16.639 44.828 ( 14.274 -3.228 6.198) 15.892 46.297 ( -6.804 -17.427 -10.472) 21.440 ======================= Grid point 42 (30/355) ======================= q-point: ( 0.42 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.995 ( 16.772 -17.840 3.839) 24.785 3.343 ( 5.223 -8.659 1.168) 10.179 3.625 ( -19.529 -2.930 -14.811) 24.685 4.014 ( 5.238 4.037 -8.488) 10.760 4.267 ( 29.322 -7.388 6.311) 30.890 4.821 ( -9.409 15.431 -8.525) 19.983 5.276 ( -21.991 -3.575 -3.021) 22.484 5.829 ( 4.603 -2.248 6.445) 8.233 5.911 ( 2.776 5.736 1.104) 6.467 7.021 ( 25.765 -6.768 8.885) 28.082 7.817 ( 10.762 -8.898 -4.837) 14.778 8.851 ( -5.395 5.841 8.683) 11.774 9.825 ( 0.005 -2.054 -0.916) 2.248 10.715 ( -5.656 3.351 9.137) 11.256 11.434 ( -11.329 5.691 0.596) 12.692 11.583 ( -0.120 9.364 -5.277) 10.750 13.005 ( -7.557 3.950 -8.054) 11.730 13.283 ( 8.712 10.751 7.143) 15.572 13.775 ( 4.105 -10.174 3.732) 11.588 14.600 ( -2.906 -13.452 2.021) 13.910 14.754 ( -4.211 -4.775 2.082) 6.699 15.100 ( -7.640 -6.287 -1.763) 10.050 15.769 ( -3.011 13.240 0.131) 13.579 17.518 ( -3.700 3.851 -1.690) 5.601 20.572 ( 2.568 4.703 -0.122) 5.360 20.895 ( 3.037 0.227 1.006) 3.207 21.756 ( -1.528 -0.663 -1.904) 2.529 21.977 ( -0.754 -2.148 -0.578) 2.349 24.424 ( 0.235 -0.165 -0.461) 0.543 25.355 ( -0.773 -0.211 0.608) 1.006 32.536 ( 2.147 -0.583 -0.684) 2.327 32.623 ( 1.575 -1.164 -0.019) 1.959 42.117 ( 4.974 -0.206 -8.351) 9.723 44.376 ( 11.167 10.472 -0.747) 15.327 45.044 ( 13.672 -0.969 6.866) 15.330 46.465 ( -12.271 -19.940 -10.648) 25.721 ======================= Grid point 43 (31/355) ======================= q-point: ( 0.50 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.496 ( 16.540 -19.902 1.753) 25.937 3.381 ( -14.494 0.692 -13.655) 19.925 3.517 ( -4.014 -7.099 -0.238) 8.159 3.950 ( -3.182 0.107 -11.070) 11.519 4.277 ( -18.524 20.922 -3.542) 28.168 4.733 ( 26.390 -6.731 3.860) 27.508 5.209 ( -11.677 -13.315 -2.164) 17.841 5.688 ( 3.593 13.683 12.220) 18.694 6.220 ( 14.914 -13.403 1.828) 20.135 7.271 ( 5.758 0.902 3.405) 6.751 7.936 ( -0.613 0.123 -5.529) 5.564 8.817 ( 1.418 -1.217 7.911) 8.129 9.867 ( 0.611 -2.980 -0.424) 3.071 10.627 ( -3.259 6.221 5.226) 8.754 11.237 ( -6.319 5.377 -2.911) 8.793 11.394 ( -2.447 8.857 -2.552) 9.537 12.834 ( -0.645 6.664 -7.901) 10.356 13.245 ( 13.993 10.513 6.791) 18.774 14.029 ( -0.842 -10.323 1.539) 10.471 14.609 ( -3.738 -5.876 -2.185) 7.299 14.852 ( -4.356 6.990 4.181) 9.236 15.217 ( -7.270 -22.671 2.084) 23.899 15.564 ( -4.907 4.941 -0.223) 6.967 17.419 ( 1.913 6.737 0.698) 7.038 20.548 ( 2.108 1.033 -0.255) 2.362 20.924 ( 2.505 0.051 0.868) 2.651 21.725 ( -2.560 0.771 -2.204) 3.465 21.978 ( -1.433 0.344 -0.624) 1.600 24.427 ( 0.103 -0.160 -0.307) 0.361 25.355 ( -0.520 -0.332 0.333) 0.701 32.562 ( 1.674 -0.582 -0.719) 1.913 32.652 ( 0.750 -0.930 -0.165) 1.206 42.130 ( 3.448 0.045 -5.209) 6.247 44.358 ( 12.421 6.576 1.729) 14.160 45.148 ( 8.259 5.861 3.969) 10.877 46.650 ( -11.978 -22.605 -7.933) 26.784 ======================= Grid point 44 (32/355) ======================= q-point: ( 0.58 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.952 ( 10.352 -12.714 0.315) 16.398 3.180 ( -7.051 -2.209 -14.352) 16.143 3.517 ( -5.004 3.407 -1.966) 6.364 3.758 ( -19.824 12.601 1.530) 23.540 3.887 ( -5.455 -5.011 -7.499) 10.541 5.080 ( 13.728 -7.759 3.303) 16.111 5.428 ( -1.371 -17.550 1.929) 17.708 5.674 ( 21.847 9.060 11.516) 26.306 6.550 ( 6.134 -10.620 1.670) 12.377 7.154 ( -9.672 8.444 -2.184) 13.024 7.765 ( -10.710 8.017 -4.943) 14.262 8.960 ( 5.492 -5.653 5.214) 9.450 9.934 ( 1.167 -4.064 0.074) 4.229 10.483 ( -1.358 10.107 1.689) 10.337 11.132 ( -1.450 0.776 -3.194) 3.593 11.234 ( -3.817 5.105 -0.518) 6.395 12.716 ( 6.719 6.840 -5.915) 11.266 13.270 ( 14.900 7.716 5.803) 17.754 13.960 ( -14.281 6.863 -1.516) 15.917 14.528 ( -8.121 19.788 1.550) 21.445 14.885 ( 3.072 -22.458 0.301) 22.669 15.506 ( -3.025 -2.225 1.986) 4.248 15.602 ( -2.886 -24.711 0.494) 24.884 17.337 ( 5.208 7.876 1.887) 9.629 20.570 ( 1.380 -1.493 -0.377) 2.068 20.949 ( 1.781 0.033 0.661) 1.900 21.663 ( -3.403 1.645 -2.272) 4.410 21.939 ( -1.283 2.288 -0.203) 2.632 24.428 ( -0.005 -0.104 -0.151) 0.184 25.358 ( -0.268 -0.389 0.128) 0.490 32.580 ( 1.065 -0.198 -0.606) 1.242 32.667 ( 0.125 -0.317 -0.123) 0.362 42.134 ( 1.651 0.397 -2.463) 2.992 44.400 ( 13.412 6.200 4.638) 15.487 45.036 ( -1.442 11.683 -1.791) 11.907 46.920 ( -7.048 -23.850 -3.518) 25.117 ======================= Grid point 45 (33/355) ======================= q-point: (-0.33 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.953 ( -7.119 1.052 -2.895) 7.757 3.185 ( -1.582 17.905 -1.419) 18.031 3.286 ( 2.704 0.882 -9.136) 9.568 3.743 ( -7.447 -21.659 5.847) 23.638 3.940 ( -2.295 -7.566 -3.703) 8.731 5.368 ( 3.087 -18.101 1.846) 18.455 5.646 ( 22.110 15.451 13.910) 30.350 5.837 ( 6.603 -6.720 -2.496) 9.746 6.594 ( -17.086 -1.658 -5.768) 18.110 6.966 ( 2.322 5.541 2.068) 6.354 7.506 ( -9.151 5.567 -3.947) 11.415 9.103 ( 3.372 -3.018 2.314) 5.083 10.025 ( 1.386 -5.062 0.589) 5.281 10.288 ( -1.009 11.655 -0.155) 11.700 11.137 ( 0.672 -2.579 -2.134) 3.414 11.161 ( -2.904 -0.806 0.492) 3.054 12.685 ( 10.730 4.966 -3.580) 12.354 13.311 ( 10.303 6.924 3.916) 13.017 13.610 ( -17.408 11.944 -0.764) 21.126 14.126 ( -6.899 17.787 0.053) 19.078 15.295 ( 2.738 -20.560 0.004) 20.741 15.552 ( -0.703 -4.616 0.415) 4.687 15.970 ( -0.966 -20.280 0.639) 20.313 17.281 ( 5.109 6.051 1.781) 8.116 20.614 ( 0.833 -2.472 -0.233) 2.619 20.965 ( 1.197 0.066 0.470) 1.287 21.589 ( -2.917 2.093 -1.647) 3.950 21.879 ( -1.046 3.208 0.039) 3.374 24.429 ( -0.042 -0.024 -0.039) 0.062 25.363 ( -0.087 -0.354 0.020) 0.365 32.583 ( 0.419 0.433 -0.335) 0.690 32.664 ( -0.097 0.613 -0.014) 0.621 42.128 ( 0.337 0.625 -0.648) 0.961 44.427 ( 14.686 13.038 7.946) 21.185 44.755 ( -10.463 9.605 -7.215) 15.931 47.251 ( -2.394 -21.722 -0.651) 21.863 ======================= Grid point 46 (34/355) ======================= q-point: (-0.25 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 354 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.736 ( -0.000 23.073 0.000) 23.073 2.959 ( -0.000 1.182 0.000) 1.182 3.331 ( 0.000 -5.999 -0.000) 5.999 4.030 ( 0.000 -6.119 -0.000) 6.119 4.134 ( 0.000 -23.693 -0.000) 23.693 5.337 ( -0.000 33.311 0.000) 33.311 5.786 ( 0.000 -27.418 -0.000) 27.418 5.948 ( 0.000 -0.499 -0.000) 0.499 6.441 ( -0.000 7.949 0.000) 7.949 6.864 ( -0.000 10.116 0.000) 10.116 7.451 ( 0.000 -5.420 -0.000) 5.420 9.133 ( -0.000 2.194 0.000) 2.194 10.095 ( -0.000 9.613 0.000) 9.613 10.132 ( 0.000 -6.154 -0.000) 6.154 11.199 ( 0.000 -6.265 -0.000) 6.265 11.211 ( 0.000 -5.289 -0.000) 5.289 12.694 ( -0.000 2.699 0.000) 2.699 13.136 ( -0.000 13.409 0.000) 13.409 13.439 ( -0.000 1.357 0.000) 1.357 13.829 ( -0.000 12.462 0.000) 12.462 15.588 ( 0.000 -12.382 -0.000) 12.382 15.636 ( 0.000 -5.363 -0.000) 5.363 16.250 ( 0.000 -13.253 -0.000) 13.253 17.246 ( -0.000 2.187 0.000) 2.187 20.657 ( 0.000 -1.856 -0.000) 1.856 20.973 ( -0.000 0.121 0.000) 0.121 21.533 ( -0.000 1.811 0.000) 1.811 21.820 ( -0.000 2.783 0.000) 2.783 24.428 ( -0.000 0.060 0.000) 0.060 25.368 ( 0.000 -0.246 -0.000) 0.246 32.572 ( -0.000 1.125 0.000) 1.125 32.644 ( -0.000 1.699 0.000) 1.699 42.117 ( -0.000 0.606 0.000) 0.606 44.194 ( -0.000 24.260 0.000) 24.260 44.596 ( -0.000 1.998 0.000) 1.998 47.571 ( 0.000 -17.573 -0.000) 17.573 ======================= Grid point 53 (35/355) ======================= q-point: ( 0.33 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 355 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.652 ( 16.214 0.000 5.962) 17.275 3.174 ( 8.461 0.000 -1.704) 8.631 3.563 ( -19.868 -0.000 -18.415) 27.089 4.131 ( -2.422 -0.000 -10.318) 10.599 4.157 ( 33.770 0.000 14.361) 36.696 5.014 ( 18.213 0.000 -2.329) 18.362 5.247 ( -21.862 -0.000 -4.292) 22.279 5.751 ( -4.589 -0.000 -12.067) 12.910 6.076 ( -12.239 -0.000 8.979) 15.180 6.941 ( 34.328 0.000 10.679) 35.951 7.615 ( 19.702 0.000 -3.621) 20.032 8.984 ( -8.107 -0.000 7.161) 10.817 9.787 ( 0.036 0.000 -0.743) 0.744 10.768 ( -7.547 -0.000 11.186) 13.494 11.497 ( -12.433 -0.000 1.994) 12.592 11.774 ( 0.793 0.000 -4.723) 4.789 13.089 ( -11.704 -0.000 -0.768) 11.729 13.331 ( 0.861 0.000 0.154) 0.875 13.845 ( 1.242 0.000 10.559) 10.632 14.124 ( 2.195 0.000 8.873) 9.141 14.835 ( 0.022 0.000 -0.914) 0.914 14.861 ( -7.681 -0.000 -11.161) 13.549 16.139 ( 1.856 0.000 0.112) 1.859 17.498 ( -13.102 -0.000 -4.829) 13.964 20.732 ( 1.890 0.000 -0.596) 1.982 20.901 ( 3.104 0.000 0.882) 3.227 21.699 ( -1.002 -0.000 -1.498) 1.803 21.935 ( 2.130 0.000 0.832) 2.286 24.421 ( 0.324 0.000 -0.574) 0.660 25.351 ( -0.949 -0.000 0.793) 1.236 32.525 ( 2.081 0.000 -0.593) 2.164 32.601 ( 2.008 0.000 0.162) 2.015 42.113 ( 6.016 0.000 -9.872) 11.561 44.678 ( 4.493 0.000 -3.864) 5.926 44.934 ( 12.411 0.000 4.876) 13.335 46.073 ( -2.823 -0.000 -7.303) 7.830 ======================= Grid point 54 (36/355) ======================= q-point: ( 0.42 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.925 ( 14.551 -10.955 4.520) 18.767 3.274 ( -3.900 -3.111 -7.384) 8.911 3.326 ( -7.339 -3.920 -10.131) 13.110 4.024 ( 0.160 3.534 -11.472) 12.005 4.567 ( 25.162 -2.350 11.985) 27.969 4.931 ( -23.013 2.235 -2.644) 23.272 5.035 ( -0.122 10.588 -6.508) 12.428 5.782 ( 6.430 -10.054 -3.678) 12.489 5.969 ( -10.189 3.036 5.839) 12.129 7.313 ( 29.674 1.886 8.715) 30.985 7.847 ( 19.551 -3.442 -3.134) 20.098 8.891 ( -9.354 3.202 6.266) 11.705 9.796 ( 0.271 -1.136 -0.392) 1.232 10.734 ( -5.620 1.304 7.878) 9.765 11.378 ( -11.095 1.513 0.836) 11.229 11.705 ( 0.464 6.403 -4.137) 7.637 12.945 ( -7.889 2.335 -2.621) 8.635 13.395 ( 1.952 -4.215 1.677) 4.939 13.858 ( 6.132 5.395 9.800) 12.757 14.304 ( -0.705 -14.710 6.444) 16.075 14.695 ( -7.902 2.965 -7.047) 10.995 14.910 ( -3.356 -7.872 -2.751) 8.989 16.015 ( 0.013 14.836 0.156) 14.837 17.413 ( -8.899 -5.262 -3.077) 10.787 20.692 ( 2.118 5.644 -0.275) 6.034 20.934 ( 2.827 0.094 0.773) 2.932 21.702 ( -1.630 -1.741 -1.651) 2.901 21.963 ( 1.379 -0.590 0.555) 1.599 24.422 ( 0.246 -0.085 -0.470) 0.538 25.347 ( -0.783 -0.141 0.578) 0.984 32.544 ( 1.593 -0.361 -0.614) 1.745 32.624 ( 1.480 -0.542 0.024) 1.577 42.131 ( 5.223 0.002 -7.414) 9.068 44.603 ( 5.095 8.666 -2.630) 10.391 45.164 ( 13.080 -6.836 6.270) 16.035 46.073 ( -7.262 -8.040 -7.990) 13.462 ======================= Grid point 55 (37/355) ======================= q-point: ( 0.50 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.329 ( 12.637 -18.502 2.745) 22.574 3.107 ( -15.190 -3.161 -13.591) 20.626 3.435 ( 1.653 -4.843 0.234) 5.123 3.909 ( -1.579 5.098 -10.366) 11.659 4.459 ( -11.457 17.738 0.629) 21.126 4.810 ( -11.917 -5.157 -6.414) 14.483 5.061 ( 24.617 -1.516 8.971) 26.245 5.850 ( -5.744 2.112 4.642) 7.682 6.094 ( 8.080 -15.652 0.258) 17.617 7.468 ( 12.066 9.454 3.808) 15.795 7.999 ( 9.786 3.713 -3.137) 10.927 8.813 ( -4.592 -1.298 5.542) 7.313 9.826 ( 0.469 -2.206 -0.265) 2.271 10.685 ( -3.494 2.679 4.576) 6.350 11.234 ( -7.468 3.878 -0.794) 8.452 11.544 ( -0.137 10.565 -2.841) 10.942 12.851 ( -2.419 1.333 -3.788) 4.688 13.494 ( 6.088 -0.379 3.811) 7.192 13.937 ( 7.935 -2.018 5.742) 10.000 14.499 ( -8.386 0.666 -4.285) 9.440 14.673 ( -3.508 -22.355 4.230) 23.020 14.964 ( -4.452 -3.044 -1.913) 5.722 15.718 ( -2.044 17.027 0.281) 17.152 17.431 ( -3.119 -3.938 -1.003) 5.122 20.618 ( 1.847 4.830 -0.110) 5.172 20.959 ( 2.341 0.429 0.716) 2.485 21.690 ( -2.404 -0.225 -1.797) 3.010 21.980 ( 0.540 0.123 0.238) 0.603 24.424 ( 0.127 -0.125 -0.295) 0.345 25.346 ( -0.496 -0.302 0.320) 0.663 32.563 ( 1.131 -0.618 -0.520) 1.390 32.646 ( 0.782 -0.661 -0.106) 1.029 42.145 ( 3.424 0.239 -4.441) 5.613 44.532 ( 5.474 4.726 -0.955) 7.294 45.386 ( 13.501 3.469 7.209) 15.693 46.135 ( -11.951 -17.916 -8.575) 23.181 ======================= Grid point 56 (38/355) ======================= q-point: ( 0.58 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.796 ( 9.617 -20.956 2.850) 23.233 2.975 ( -8.271 -2.793 -10.222) 13.443 3.478 ( -3.622 0.451 0.426) 3.674 3.745 ( -5.937 1.430 -4.797) 7.766 3.997 ( -5.421 24.444 -0.876) 25.053 5.001 ( -1.327 -23.710 -1.994) 23.831 5.224 ( 7.923 5.514 4.152) 10.508 5.946 ( 11.214 -8.274 6.156) 15.235 6.387 ( 0.695 -11.312 0.392) 11.340 7.279 ( -3.021 16.801 -1.508) 17.137 7.879 ( -0.595 12.599 -1.313) 12.681 8.904 ( 1.329 -7.223 2.881) 7.889 9.877 ( 0.459 -3.463 -0.170) 3.497 10.607 ( -1.522 5.639 1.742) 6.095 11.125 ( -2.357 2.089 -1.275) 3.397 11.346 ( -0.788 10.658 -0.963) 10.730 12.805 ( 1.345 2.061 -2.542) 3.538 13.557 ( 10.485 4.580 3.819) 12.062 13.954 ( -6.086 7.623 -0.770) 9.785 14.542 ( -1.155 -17.887 -0.535) 17.932 14.795 ( -2.934 14.294 1.457) 14.664 15.134 ( -2.149 -27.380 0.456) 27.468 15.499 ( -1.704 5.352 0.164) 5.619 17.446 ( 0.462 0.946 0.248) 1.081 20.577 ( 0.832 1.551 -0.153) 1.767 20.972 ( 1.257 0.504 0.426) 1.419 21.651 ( -1.951 1.233 -1.263) 2.631 21.969 ( 0.094 1.613 0.101) 1.619 24.426 ( 0.030 -0.120 -0.121) 0.173 25.350 ( -0.204 -0.416 0.113) 0.477 32.580 ( 0.598 -0.522 -0.318) 0.855 32.660 ( 0.211 -0.525 -0.090) 0.573 42.149 ( 1.410 0.550 -1.785) 2.340 44.542 ( 4.539 0.480 0.561) 4.598 45.313 ( 4.363 17.277 2.023) 17.934 46.407 ( -5.741 -27.132 -3.348) 27.934 ======================= Grid point 57 (39/355) ======================= q-point: (-0.33 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 355 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.902 ( 0.000 -0.061 -0.000) 0.061 3.289 ( 0.000 -25.959 -0.000) 25.959 3.349 ( -0.000 7.305 0.000) 7.305 3.558 ( -0.000 22.673 0.000) 22.673 3.792 ( 0.000 -7.394 -0.000) 7.394 5.212 ( 0.000 -2.627 -0.000) 2.627 5.429 ( 0.000 -25.528 -0.000) 25.528 6.287 ( 0.000 -13.449 -0.000) 13.449 6.326 ( -0.000 16.625 0.000) 16.625 7.027 ( -0.000 5.387 0.000) 5.387 7.634 ( -0.000 13.883 0.000) 13.883 9.042 ( 0.000 -6.565 -0.000) 6.565 9.948 ( 0.000 -4.682 -0.000) 4.682 10.473 ( -0.000 10.047 0.000) 10.047 11.104 ( 0.000 -0.895 -0.000) 0.895 11.192 ( -0.000 6.156 0.000) 6.156 12.776 ( -0.000 2.188 0.000) 2.188 13.572 ( -0.000 4.863 0.000) 4.863 13.669 ( -0.000 15.278 0.000) 15.278 14.444 ( -0.000 22.497 0.000) 22.497 14.925 ( 0.000 -24.476 -0.000) 24.476 15.482 ( 0.000 -2.687 -0.000) 2.687 15.578 ( 0.000 -25.637 -0.000) 25.637 17.401 ( -0.000 4.859 0.000) 4.859 20.581 ( 0.000 -1.467 -0.000) 1.467 20.973 ( -0.000 0.176 0.000) 0.176 21.608 ( -0.000 2.129 0.000) 2.129 21.930 ( -0.000 2.995 0.000) 2.995 24.427 ( 0.000 -0.084 -0.000) 0.084 25.356 ( 0.000 -0.434 -0.000) 0.434 32.588 ( 0.000 -0.077 -0.000) 0.077 32.667 ( 0.000 -0.158 -0.000) 0.158 42.140 ( -0.000 0.715 0.000) 0.715 44.587 ( 0.000 -1.605 -0.000) 1.605 44.987 ( -0.000 22.458 0.000) 22.458 46.830 ( 0.000 -26.253 -0.000) 26.253 ======================= Grid point 66 (40/355) ======================= q-point: ( 0.42 0.42 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 354 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.977 ( 10.930 0.000 3.588) 11.504 3.042 ( -14.236 -0.000 -14.338) 20.205 3.328 ( 5.861 0.000 -0.038) 5.861 4.017 ( 2.702 0.000 -11.280) 11.600 4.621 ( -28.337 -0.000 -1.348) 28.369 4.824 ( 18.762 0.000 10.871) 21.684 5.272 ( 11.524 0.000 -2.523) 11.797 5.629 ( -1.758 -0.000 -6.737) 6.962 5.916 ( -9.987 -0.000 4.920) 11.133 7.660 ( 24.459 0.000 6.521) 25.313 8.028 ( 21.906 0.000 -2.343) 22.031 8.829 ( -12.401 -0.000 4.448) 13.175 9.790 ( 0.439 0.000 0.033) 0.440 10.725 ( -4.276 -0.000 5.489) 6.958 11.295 ( -8.121 -0.000 0.508) 8.136 11.748 ( 0.206 0.000 -2.761) 2.769 12.892 ( -6.875 -0.000 -0.284) 6.881 13.353 ( 1.323 0.000 -0.581) 1.445 13.983 ( 2.302 0.000 11.606) 11.832 14.245 ( 2.523 0.000 5.797) 6.322 14.599 ( -7.496 -0.000 -11.299) 13.559 14.800 ( -2.066 -0.000 -0.971) 2.283 16.167 ( 0.925 0.000 0.029) 0.925 17.242 ( -8.285 -0.000 -2.565) 8.673 20.761 ( 1.282 0.000 -0.315) 1.320 20.958 ( 1.904 0.000 0.394) 1.945 21.672 ( -0.574 -0.000 -0.841) 1.019 21.975 ( 1.184 0.000 0.498) 1.285 24.422 ( 0.191 0.000 -0.363) 0.410 25.341 ( -0.610 -0.000 0.420) 0.740 32.551 ( 1.035 0.000 -0.489) 1.144 32.633 ( 1.086 0.000 0.032) 1.087 42.149 ( 4.171 0.000 -5.286) 6.733 44.722 ( 2.588 0.000 -2.254) 3.432 45.188 ( 8.391 0.000 3.682) 9.164 45.954 ( -3.185 -0.000 -4.552) 5.556 ======================= Grid point 67 (41/355) ======================= q-point: ( 0.50 0.42 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.175 ( 6.358 -11.603 1.805) 13.353 2.896 ( -7.906 -1.994 -7.809) 11.290 3.388 ( 1.383 -2.281 -0.243) 2.679 3.975 ( 3.635 5.347 -7.846) 10.167 4.421 ( -14.512 -5.560 2.584) 15.755 4.824 ( -2.511 18.031 -1.270) 18.249 5.342 ( 21.522 -0.696 5.720) 22.280 5.736 ( -11.416 -4.838 -3.818) 12.973 5.889 ( 0.485 -11.523 1.830) 11.678 7.786 ( 10.953 9.705 2.992) 14.937 8.184 ( 13.464 4.266 -1.948) 14.258 8.734 ( -8.854 -1.944 3.100) 9.580 9.803 ( 0.322 -1.018 0.042) 1.068 10.702 ( -2.125 1.042 2.593) 3.511 11.219 ( -4.438 1.862 0.011) 4.813 11.683 ( 0.058 6.602 -1.515) 6.773 12.827 ( -2.502 0.657 -0.716) 2.685 13.432 ( 0.861 -7.168 0.145) 7.221 14.097 ( 7.714 -0.798 10.455) 13.017 14.346 ( 0.546 -10.914 1.852) 11.083 14.429 ( -9.540 4.861 -8.756) 13.831 14.845 ( -1.620 -6.110 -0.768) 6.367 16.014 ( -0.125 16.734 0.064) 16.734 17.265 ( -3.493 -9.138 -1.085) 9.843 20.721 ( 0.837 5.021 -0.109) 5.092 20.980 ( 1.160 -0.394 0.277) 1.256 21.666 ( -0.706 -0.097 -0.637) 0.956 21.987 ( 0.550 -0.097 0.238) 0.607 24.422 ( 0.089 -0.065 -0.182) 0.213 25.339 ( -0.308 -0.182 0.198) 0.409 32.561 ( 0.530 -0.414 -0.275) 0.726 32.644 ( 0.511 -0.318 -0.018) 0.602 42.162 ( 2.147 0.211 -2.560) 3.347 44.655 ( 1.774 6.539 -1.004) 6.849 45.438 ( 7.967 -15.785 4.373) 18.215 45.871 ( -5.845 3.271 -4.829) 8.257 ======================= Grid point 68 (42/355) ======================= q-point: (-0.42 -0.58 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 354 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.485 ( 0.000 -20.156 -0.000) 20.156 2.876 ( 0.000 -2.209 -0.000) 2.209 3.435 ( 0.000 -3.071 -0.000) 3.071 3.819 ( -0.000 10.262 0.000) 10.262 4.398 ( -0.000 25.637 0.000) 25.637 4.600 ( 0.000 -19.547 -0.000) 19.547 5.455 ( -0.000 11.454 0.000) 11.454 5.752 ( 0.000 -15.725 -0.000) 15.725 6.171 ( 0.000 -16.078 -0.000) 16.078 7.594 ( -0.000 18.709 0.000) 18.709 8.095 ( -0.000 11.747 0.000) 11.747 8.788 ( 0.000 -7.109 -0.000) 7.109 9.831 ( 0.000 -2.216 -0.000) 2.216 10.669 ( -0.000 2.567 0.000) 2.567 11.152 ( -0.000 3.031 0.000) 3.031 11.529 ( -0.000 10.854 0.000) 10.854 12.815 ( 0.000 -0.173 -0.000) 0.173 13.571 ( 0.000 -7.140 -0.000) 7.140 14.136 ( -0.000 12.796 0.000) 12.796 14.293 ( 0.000 -8.411 -0.000) 8.411 14.671 ( 0.000 -25.124 -0.000) 25.124 14.903 ( 0.000 -0.350 -0.000) 0.350 15.698 ( -0.000 18.149 0.000) 18.149 17.393 ( 0.000 -6.704 -0.000) 6.704 20.637 ( -0.000 4.849 0.000) 4.849 20.988 ( -0.000 0.349 0.000) 0.349 21.655 ( -0.000 0.637 0.000) 0.637 21.988 ( -0.000 0.490 0.000) 0.490 24.424 ( 0.000 -0.105 -0.000) 0.105 25.342 ( 0.000 -0.341 -0.000) 0.341 32.572 ( 0.000 -0.658 -0.000) 0.658 32.653 ( 0.000 -0.452 -0.000) 0.452 42.161 ( -0.000 0.462 0.000) 0.462 44.582 ( -0.000 2.821 0.000) 2.821 45.631 ( -0.000 14.803 0.000) 14.803 45.900 ( 0.000 -27.102 -0.000) 27.102 ======================= Grid point 81 (43/355) ======================= q-point: (-0.50 -0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 193 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.110 ( 0.000 0.000 0.000) 0.000 2.821 ( 0.000 0.000 0.000) 0.000 3.378 ( 0.000 0.000 0.000) 0.000 4.042 ( 0.000 0.000 0.000) 0.000 4.273 ( -0.000 -0.000 0.000) 0.000 5.039 ( 0.000 0.000 0.000) 0.000 5.442 ( 0.000 0.000 0.000) 0.000 5.573 ( 0.000 0.000 0.000) 0.000 5.798 ( 0.000 0.000 0.000) 0.000 7.943 ( 0.000 0.000 0.000) 0.000 8.311 ( 0.000 0.000 -0.000) 0.000 8.656 ( -0.000 -0.000 0.000) 0.000 9.796 ( 0.000 0.000 0.000) 0.000 10.706 ( 0.000 0.000 0.000) 0.000 11.212 ( 0.000 0.000 0.000) 0.000 11.737 ( 0.000 0.000 0.000) 0.000 12.821 ( 0.000 0.000 0.000) 0.000 13.365 ( 0.000 0.000 0.000) 0.000 14.095 ( 0.000 0.000 0.000) 0.000 14.303 ( 0.000 0.000 0.000) 0.000 14.433 ( 0.000 0.000 0.000) 0.000 14.767 ( 0.000 0.000 0.000) 0.000 16.177 ( 0.000 0.000 0.000) 0.000 17.145 ( 0.000 0.000 0.000) 0.000 20.773 ( 0.000 0.000 0.000) 0.000 20.979 ( 0.000 0.000 0.000) 0.000 21.662 ( 0.000 0.000 0.000) 0.000 21.989 ( 0.000 0.000 0.000) 0.000 24.422 ( 0.000 0.000 0.000) 0.000 25.336 ( 0.000 0.000 0.000) 0.000 32.559 ( 0.000 0.000 0.000) 0.000 32.644 ( 0.000 0.000 0.000) 0.000 42.169 ( 0.000 0.000 0.000) 0.000 44.737 ( 0.000 0.000 0.000) 0.000 45.298 ( 0.000 0.000 0.000) 0.000 45.893 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 149 (44/355) ======================= q-point: ( 0.00 0.00 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 355 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.573 ( 40.372 0.000 28.658) 49.509 0.661 ( 19.689 0.000 32.661) 38.137 0.955 ( -7.853 -0.000 46.877) 47.531 2.817 ( 3.030 0.000 1.420) 3.346 3.739 ( -4.984 -0.000 -1.434) 5.187 4.589 ( -25.334 -0.000 3.079) 25.520 4.674 ( -2.609 -0.000 -0.826) 2.736 5.916 ( -5.421 -0.000 11.295) 12.528 6.569 ( 0.084 0.000 -5.327) 5.327 7.863 ( -2.292 -0.000 -20.280) 20.410 8.107 ( 1.771 0.000 -2.680) 3.213 8.721 ( 10.659 0.000 8.750) 13.790 9.947 ( -3.559 -0.000 4.429) 5.681 11.589 ( 7.900 0.000 -17.401) 19.110 12.338 ( -5.493 -0.000 15.287) 16.244 12.950 ( 19.821 0.000 1.328) 19.866 13.372 ( -1.043 -0.000 0.748) 1.284 13.551 ( 1.015 0.000 -2.782) 2.961 13.885 ( 1.699 0.000 1.497) 2.264 14.116 (-172.131 -0.000 -1.483) 172.137 14.888 ( -2.448 -0.000 1.830) 3.057 15.452 ( -4.207 -0.000 -0.097) 4.208 15.841 ( 1.635 0.000 -0.977) 1.905 15.986 ( 181.472 0.000 -2.898) 181.495 20.684 ( 0.915 0.000 0.013) 0.915 20.691 ( -0.949 -0.000 -0.103) 0.954 21.660 ( 3.282 0.000 0.523) 3.324 21.813 ( -0.780 -0.000 -0.411) 0.881 25.027 ( -31.114 -0.000 0.893) 31.127 25.359 ( 1.185 0.000 -1.189) 1.679 32.346 ( 0.033 0.000 0.359) 0.360 32.435 ( -0.309 -0.000 -0.269) 0.410 42.242 ( -8.080 -0.000 1.866) 8.292 42.862 ( 142.227 0.000 -2.155) 142.243 44.073 ( 1.779 0.000 1.372) 2.247 44.484 ( -1.679 -0.000 -1.247) 2.091 ======================= Grid point 150 (45/355) ======================= q-point: ( 0.08 0.00 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.972 ( -5.647 -10.367 34.312) 36.286 1.186 ( 25.895 -27.579 17.466) 41.668 2.246 ( 46.259 -64.853 25.446) 83.626 2.931 ( 13.340 -1.830 2.043) 13.619 3.783 ( -12.145 -17.589 -3.834) 21.715 4.223 ( -9.357 12.727 15.254) 21.960 4.719 ( -2.277 -6.577 -2.207) 7.302 5.841 ( -5.469 8.252 10.060) 14.114 6.499 ( -4.638 2.728 -4.540) 7.040 7.781 ( -4.003 -1.216 -17.654) 18.143 7.912 ( -11.107 10.293 -5.757) 16.200 8.837 ( 8.381 2.832 8.099) 11.994 9.919 ( -3.578 0.752 3.590) 5.124 11.425 ( 0.423 23.854 1.390) 23.898 11.866 ( -20.588 24.491 23.977) 39.982 12.446 ( -20.620 10.915 17.210) 28.991 13.028 ( 14.727 17.501 4.727) 23.357 13.316 ( -2.452 3.566 -0.514) 4.358 13.814 ( -7.490 -2.970 -2.990) 8.594 14.020 ( 8.943 -4.276 3.848) 10.633 15.110 ( -16.621 -19.950 -0.893) 25.982 15.557 ( 4.945 -10.556 -1.445) 11.746 15.732 ( -6.573 2.155 -3.299) 7.664 17.315 ( 46.335 -6.869 -32.158) 56.818 20.650 ( -1.740 1.904 -0.255) 2.592 20.711 ( 0.414 -1.551 -0.156) 1.613 21.687 ( 3.625 1.491 0.406) 3.941 21.839 ( 3.766 -2.595 -1.828) 4.925 24.644 ( -15.036 8.361 12.774) 21.428 25.365 ( 0.982 0.048 -0.877) 1.318 32.372 ( 0.481 -1.791 -0.232) 1.869 32.443 ( 1.321 -0.997 -0.772) 1.826 42.160 ( -6.330 0.904 -1.396) 6.545 43.139 ( 54.287 35.538 3.401) 64.974 44.159 ( 4.991 -5.003 3.063) 7.702 46.251 ( 25.743 -90.516 -73.736) 119.553 ======================= Grid point 151 (46/355) ======================= q-point: ( 0.17 0.00 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.327 ( -1.107 -18.677 25.446) 31.584 1.998 ( 20.204 -32.365 10.063) 39.458 3.138 ( 16.540 -3.968 0.645) 17.021 3.799 ( 12.369 -41.480 9.141) 44.240 3.945 ( 12.071 -24.345 16.360) 31.718 4.313 ( 6.567 -21.944 5.595) 23.579 4.817 ( -0.393 -9.109 -6.598) 11.254 5.635 ( -6.082 13.192 7.523) 16.359 6.338 ( -8.585 7.566 -1.009) 11.488 7.442 ( -17.196 17.712 -6.424) 25.508 7.764 ( -4.949 -4.907 -16.584) 17.989 8.867 ( 5.224 5.002 5.556) 9.120 9.897 ( -2.492 -0.148 2.802) 3.753 11.035 ( -2.518 21.491 13.722) 25.622 11.637 ( -3.847 5.698 0.332) 6.883 12.148 ( -10.972 15.186 9.393) 20.958 12.851 ( 2.849 16.073 5.662) 17.277 13.217 ( 0.335 6.013 -3.202) 6.820 13.768 ( 3.333 2.654 -2.116) 4.757 14.215 ( 18.762 2.429 5.238) 19.631 15.251 ( -18.932 -18.377 -2.354) 26.489 15.572 ( 1.198 4.088 0.329) 4.273 15.886 ( -7.369 -22.303 -2.192) 23.591 17.371 ( 11.212 12.549 -14.863) 22.452 20.601 ( -3.683 0.335 -0.689) 3.762 20.744 ( 0.808 -1.795 -0.042) 1.969 21.691 ( 2.177 1.675 0.663) 2.826 21.933 ( 7.758 -2.014 -2.602) 8.427 24.518 ( -5.878 2.339 8.063) 10.249 25.368 ( 0.738 0.141 -0.744) 1.057 32.408 ( 0.724 -2.033 -0.238) 2.171 32.486 ( 2.326 -2.214 -0.961) 3.352 42.087 ( -4.001 0.056 -3.193) 5.120 43.175 ( 27.613 11.178 1.412) 29.823 44.359 ( 6.917 -9.018 5.505) 12.628 47.070 ( 2.941 -36.421 -47.594) 60.003 ======================= Grid point 152 (47/355) ======================= q-point: ( 0.25 0.00 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.781 ( 2.511 -22.060 18.607) 28.968 2.725 ( 14.608 -28.849 5.250) 32.760 3.381 ( 13.496 -5.893 -0.114) 14.726 3.885 ( -4.425 -2.547 10.529) 11.701 4.699 ( -3.711 -24.558 8.301) 26.187 4.944 ( 7.485 -9.928 -15.417) 19.806 5.097 ( 4.219 -9.320 16.095) 19.071 5.598 ( 18.490 -25.315 4.805) 31.714 6.063 ( -12.827 11.114 2.450) 17.148 6.900 ( -20.108 18.488 -8.256) 28.536 7.781 ( 2.109 -6.957 -9.928) 12.305 8.833 ( 1.271 4.815 1.118) 5.104 9.903 ( -1.472 -1.531 2.629) 3.380 10.751 ( -0.353 17.957 8.236) 19.758 11.510 ( -3.483 5.222 -0.328) 6.286 11.823 ( -7.754 15.236 4.005) 17.558 12.638 ( 0.046 13.282 5.763) 14.479 13.072 ( -1.876 8.031 -7.870) 11.400 13.809 ( 12.165 0.721 -0.249) 12.189 14.319 ( 19.394 10.233 4.188) 22.324 15.312 ( -19.819 -15.110 -3.822) 25.213 15.618 ( -1.309 -6.471 4.017) 7.728 16.125 ( -9.784 -16.506 -1.483) 19.245 17.127 ( 3.513 17.332 -6.565) 18.864 20.562 ( -4.218 -0.760 -0.511) 4.316 20.790 ( 1.333 -2.321 0.204) 2.684 21.683 ( 1.661 1.689 0.364) 2.397 22.019 ( 7.287 -0.467 -2.706) 7.787 24.483 ( -3.240 0.594 5.647) 6.537 25.368 ( 0.540 0.207 -0.819) 1.002 32.451 ( 0.842 -2.260 -0.492) 2.461 32.548 ( 2.476 -2.645 -0.671) 3.685 42.056 ( -1.945 -1.689 -3.028) 3.975 43.299 ( 17.875 1.964 -0.920) 18.006 44.626 ( 6.818 -10.275 7.438) 14.401 47.321 ( -2.251 -17.971 -30.516) 35.486 ======================= Grid point 153 (48/355) ======================= q-point: ( 0.33 0.00 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.267 ( 4.626 -22.452 13.542) 26.624 3.276 ( 8.563 -19.547 0.509) 21.346 3.563 ( 4.653 -5.542 1.819) 7.462 3.995 ( 3.984 -4.383 12.249) 13.606 4.699 ( -9.826 13.028 -6.132) 17.432 5.042 ( -5.111 -6.104 11.286) 13.811 5.306 ( 5.784 -7.255 6.568) 11.368 5.659 ( -13.409 6.560 -6.058) 16.110 6.157 ( -15.498 3.840 -9.369) 18.512 6.786 ( 19.812 -24.517 8.700) 32.700 7.951 ( 8.578 -10.035 -4.551) 13.964 8.738 ( -2.410 5.277 -3.485) 6.768 9.941 ( -1.174 -2.875 3.003) 4.321 10.491 ( 0.372 16.215 3.807) 16.660 11.398 ( -4.314 3.469 0.952) 5.617 11.545 ( -4.392 11.612 0.437) 12.423 12.482 ( 1.176 8.960 4.377) 10.041 12.845 ( -5.021 8.751 -10.016) 14.216 13.974 ( 14.980 -3.072 1.370) 15.353 14.346 ( 16.642 8.117 2.074) 18.632 15.342 ( -16.552 -10.836 -1.579) 19.847 15.709 ( -2.241 -2.580 3.304) 4.754 16.233 ( -14.056 -12.885 -1.613) 19.136 16.852 ( 4.704 17.222 -2.101) 17.977 20.539 ( -3.329 -1.095 0.064) 3.505 20.846 ( 1.304 -2.448 0.346) 2.795 21.674 ( 1.428 1.307 -0.003) 1.936 22.066 ( 4.773 0.448 -2.705) 5.504 24.476 ( -2.327 0.002 4.734) 5.275 25.365 ( 0.459 0.214 -1.025) 1.144 32.494 ( 0.732 -2.151 -0.717) 2.383 32.611 ( 1.983 -2.298 -0.346) 3.055 42.074 ( -0.807 -3.082 -1.091) 3.368 43.439 ( 12.663 -0.878 -2.170) 12.878 44.878 ( 4.372 -8.211 7.552) 11.982 47.409 ( -1.924 -10.308 -20.956) 23.433 ======================= Grid point 154 (49/355) ======================= q-point: ( 0.42 0.00 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.728 ( 5.186 -20.030 8.598) 22.406 3.405 ( -5.157 4.135 1.937) 6.888 3.826 ( 6.568 -15.674 1.026) 17.025 4.183 ( 0.623 -7.353 10.345) 12.707 4.337 ( -9.507 11.547 -4.372) 15.583 4.945 ( -4.419 24.928 10.098) 27.256 5.237 ( -12.593 -7.982 -0.618) 14.923 5.759 ( 7.149 -3.988 8.346) 11.690 5.879 ( -7.630 -1.607 -9.323) 12.154 7.388 ( 11.730 -16.209 4.196) 20.443 8.186 ( 6.371 -8.813 -5.295) 12.095 8.589 ( -0.712 6.656 -5.570) 8.708 9.998 ( -1.397 -3.344 3.459) 5.010 10.272 ( 0.578 11.121 1.742) 11.272 11.312 ( -4.006 2.631 -2.026) 5.204 11.371 ( -1.758 4.870 2.029) 5.561 12.357 ( -2.488 6.672 -6.154) 9.411 12.680 ( 0.215 2.214 0.443) 2.268 14.165 ( 8.452 -2.892 1.130) 9.005 14.439 ( 15.911 1.189 1.352) 16.012 15.296 ( -14.859 -3.197 -1.011) 15.233 15.679 ( -2.477 3.085 2.122) 4.489 16.314 ( -11.418 -13.275 -1.083) 17.543 16.634 ( 7.846 15.833 -0.676) 17.683 20.531 ( -1.723 -0.804 0.651) 2.010 20.892 ( 0.656 -1.413 0.176) 1.568 21.669 ( 0.960 0.648 -0.246) 1.184 22.081 ( 1.794 0.033 -2.545) 3.114 24.477 ( -2.063 -0.170 4.480) 4.935 25.361 ( 0.503 0.194 -1.260) 1.370 32.528 ( 0.435 -1.515 -0.748) 1.745 32.656 ( 1.015 -1.303 -0.181) 1.661 42.125 ( -0.999 -3.684 1.776) 4.210 43.549 ( 9.010 -0.199 -2.474) 9.346 45.032 ( -0.112 -3.556 5.291) 6.376 47.463 ( 0.996 -6.849 -14.247) 15.839 ======================= Grid point 155 (50/355) ======================= q-point: (-0.50 0.00 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.054 ( 0.024 -3.461 -0.934) 3.585 3.209 ( -9.302 3.183 10.777) 14.588 3.960 ( -11.025 1.640 -5.609) 12.478 4.228 ( 3.187 -13.680 -6.383) 15.429 4.378 ( -0.652 1.353 11.525) 11.622 4.519 ( -9.300 10.258 7.657) 15.822 5.285 ( 4.314 1.241 5.533) 7.125 5.767 ( -2.216 -4.887 0.441) 5.384 6.059 ( 15.128 -1.753 9.511) 17.955 7.535 ( -5.487 3.336 -1.591) 6.615 8.174 ( -11.599 1.578 -14.318) 18.494 8.565 ( 14.965 2.997 -1.861) 15.376 10.027 ( -0.707 1.381 2.720) 3.131 10.185 ( -0.322 -0.360 2.536) 2.581 11.227 ( -0.428 1.470 -5.070) 5.296 11.354 ( -1.964 -2.203 3.824) 4.831 12.182 ( -5.719 2.179 -11.859) 13.345 12.780 ( 7.174 -5.442 8.254) 12.215 14.228 ( -1.412 -0.094 0.515) 1.506 14.518 ( -0.857 2.957 -0.420) 3.107 15.240 ( 0.733 -2.425 0.440) 2.571 15.635 ( -0.068 0.905 1.821) 2.035 16.423 ( -4.814 -7.560 -1.786) 9.138 16.474 ( 9.743 10.838 -0.380) 14.579 20.536 ( 0.088 -0.207 1.114) 1.136 20.904 ( -0.066 0.341 -0.176) 0.389 21.666 ( -0.067 0.076 -0.453) 0.464 22.083 ( -1.083 -1.327 -2.371) 2.925 24.480 ( -2.095 -0.173 4.537) 5.001 25.357 ( 0.634 0.194 -1.466) 1.609 32.544 ( 0.040 -0.432 -0.615) 0.753 32.670 ( -0.133 0.088 -0.232) 0.282 42.186 ( -2.387 -3.636 4.593) 6.326 43.595 ( 5.722 2.368 -2.123) 6.546 45.035 ( -5.184 1.791 1.657) 5.730 47.536 ( 5.054 -4.742 -9.338) 11.629 ======================= Grid point 156 (51/355) ======================= q-point: (-0.42 0.00 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.719 ( -14.393 20.631 5.908) 25.840 3.351 ( -2.706 -8.460 2.760) 9.301 3.753 ( -13.334 5.285 -4.709) 15.097 4.049 ( -5.638 19.408 2.684) 20.388 4.487 ( -0.968 -16.543 -7.037) 18.004 4.724 ( -0.244 -15.283 18.392) 23.914 5.270 ( 9.629 10.713 0.471) 14.412 5.976 ( 9.832 -10.828 7.957) 16.650 6.251 ( 15.690 1.673 12.010) 19.830 7.161 ( -21.254 22.893 -5.332) 31.690 7.927 ( -11.408 2.466 -15.707) 19.569 8.647 ( 15.010 4.924 -4.365) 16.389 9.989 ( -0.795 2.528 2.531) 3.664 10.256 ( -0.939 -5.776 2.162) 6.238 11.225 ( 2.212 -3.200 -5.464) 6.707 11.429 ( -0.610 -6.154 3.661) 7.187 12.101 ( -3.437 -4.514 -10.715) 12.124 13.024 ( 7.151 -8.945 8.897) 14.502 14.133 ( -12.320 2.918 -0.376) 12.667 14.365 ( -13.968 2.129 -1.288) 14.188 15.348 ( 12.527 1.205 0.591) 12.599 15.664 ( 2.429 -0.477 1.719) 3.014 16.354 ( 14.993 12.909 0.358) 19.788 16.586 ( -0.343 -11.960 -2.420) 12.207 20.551 ( 1.888 0.310 1.471) 2.413 20.880 ( -0.402 1.966 -0.343) 2.036 21.662 ( -1.240 -0.634 -0.621) 1.525 22.078 ( -4.019 -2.268 -2.654) 5.323 24.482 ( -2.263 -0.173 4.827) 5.334 25.354 ( 0.801 0.220 -1.639) 1.838 32.537 ( -0.339 0.780 -0.424) 0.950 32.648 ( -1.086 1.507 -0.492) 1.922 42.236 ( -4.446 -3.324 6.594) 8.620 43.560 ( 1.897 5.394 -1.667) 5.956 44.897 ( -8.839 5.857 -1.325) 10.686 47.629 ( 9.074 -2.096 -7.220) 11.784 ======================= Grid point 157 (52/355) ======================= q-point: (-0.33 0.00 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.231 ( -15.899 23.219 9.691) 29.763 3.309 ( -7.389 18.560 2.005) 20.077 3.449 ( -14.253 4.555 -3.252) 15.313 3.801 ( -1.904 6.174 4.425) 7.831 4.630 ( -2.125 -3.297 -6.732) 7.792 5.036 ( -7.109 -8.789 20.162) 23.115 5.234 ( 13.806 -0.746 -5.025) 14.711 6.095 ( 4.123 16.185 8.588) 18.780 6.359 ( -26.151 34.383 -2.041) 43.246 6.614 ( 18.529 -19.004 5.351) 27.076 7.812 ( -2.314 -5.834 -10.061) 11.858 8.644 ( 11.234 8.027 -7.593) 15.757 9.961 ( -1.897 0.874 3.205) 3.826 10.353 ( -0.222 -5.571 0.314) 5.584 11.319 ( 4.318 -6.687 -5.762) 9.827 11.581 ( 0.971 -9.799 3.766) 10.543 12.165 ( 0.112 -10.188 -8.797) 13.460 13.253 ( 3.064 -6.441 7.149) 10.098 13.954 ( -16.472 -1.028 0.709) 16.519 14.199 ( -17.543 -2.551 -3.817) 18.134 15.423 ( 14.129 6.448 1.209) 15.577 15.653 ( 3.516 6.034 1.451) 7.133 16.301 ( 13.581 12.356 0.924) 18.384 16.843 ( 6.514 -16.307 -2.488) 17.735 20.577 ( 3.298 0.567 1.611) 3.714 20.834 ( 0.060 2.899 -0.118) 2.902 21.658 ( -2.194 -1.415 -0.800) 2.731 22.047 ( -6.944 -2.048 -3.537) 8.058 24.486 ( -2.518 -0.356 5.508) 6.067 25.351 ( 0.972 0.238 -1.773) 2.036 32.508 ( -0.598 1.768 -0.261) 1.884 32.597 ( -1.525 2.532 -0.897) 3.089 42.267 ( -6.596 -3.159 7.354) 10.372 43.436 ( -3.434 7.434 -2.049) 8.441 44.674 ( -9.885 7.861 -2.357) 12.847 47.706 ( 13.190 2.087 -9.224) 16.230 ======================= Grid point 158 (53/355) ======================= q-point: (-0.25 0.00 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.733 ( -16.279 23.205 14.207) 31.707 2.698 ( -9.425 39.327 3.205) 40.568 3.264 ( -17.495 0.467 -4.025) 17.958 3.771 ( 3.588 4.271 8.105) 9.839 4.427 ( -5.479 23.535 -6.981) 25.153 4.913 ( -17.744 32.143 5.811) 37.173 5.205 ( -16.012 7.179 -2.028) 17.664 5.589 ( -7.309 -2.373 9.606) 12.301 6.154 ( 13.258 2.530 4.168) 14.127 7.147 ( 16.417 -19.624 2.834) 25.742 7.983 ( 7.025 -13.145 -2.048) 15.044 8.529 ( 6.331 11.116 -10.742) 16.704 9.949 ( -2.606 -0.129 3.825) 4.630 10.447 ( 1.203 -5.306 0.981) 5.529 11.462 ( 5.896 -7.267 -7.475) 11.977 11.805 ( 2.464 -12.223 4.936) 13.410 12.348 ( 2.887 -13.688 -7.131) 15.702 13.353 ( -1.363 -2.444 5.458) 6.134 13.873 ( -12.001 -4.296 3.361) 13.182 14.077 ( -20.526 -8.603 -6.606) 23.215 15.386 ( 9.410 12.779 -0.920) 15.897 15.625 ( 8.934 4.691 4.888) 11.212 16.188 ( 9.885 15.878 0.862) 18.723 17.192 ( 7.797 -17.001 -4.929) 19.343 20.609 ( 3.426 0.527 1.194) 3.666 20.791 ( 1.641 3.248 0.384) 3.659 21.656 ( -3.056 -1.925 -1.170) 3.796 21.975 ( -8.795 -1.063 -4.389) 9.886 24.499 ( -2.926 -1.125 7.180) 7.835 25.349 ( 1.122 0.212 -1.832) 2.159 32.466 ( -0.665 2.302 -0.179) 2.403 32.531 ( -1.304 2.821 -1.317) 3.375 42.279 ( -8.504 -3.471 6.813) 11.436 43.227 ( -10.989 7.056 -4.258) 13.736 44.437 ( -8.330 8.070 -1.534) 11.699 47.715 ( 18.760 9.434 -18.161) 27.763 ======================= Grid point 159 (54/355) ======================= q-point: (-0.17 0.00 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.275 ( -16.556 21.108 20.453) 33.734 1.894 ( -10.795 45.821 4.000) 47.245 3.030 ( -17.352 9.426 -3.915) 20.131 3.329 ( -34.635 61.441 -3.642) 70.624 3.775 ( 8.586 7.631 9.510) 14.913 4.427 ( -5.109 11.373 4.886) 13.391 4.984 ( -12.918 7.984 5.955) 16.312 5.712 ( -5.950 -9.792 11.416) 16.174 6.357 ( 13.348 -5.888 -1.349) 14.651 7.604 ( 11.333 -17.052 0.819) 20.491 8.265 ( 1.389 -8.851 -15.783) 18.149 8.337 ( 10.958 9.843 3.181) 15.069 9.945 ( -2.860 -0.465 4.142) 5.055 10.602 ( 4.418 -8.845 11.551) 15.204 11.595 ( 7.325 -5.091 -9.347) 12.920 12.071 ( 4.227 -11.561 7.692) 14.515 12.597 ( 2.552 -15.852 -5.234) 16.888 13.414 ( -2.269 -4.050 6.877) 8.298 13.865 ( -6.519 -4.901 1.805) 8.353 13.997 ( -17.329 -6.658 -4.136) 19.019 15.229 ( 6.550 13.054 -1.558) 14.688 15.683 ( 3.742 0.790 4.478) 5.889 15.992 ( 12.096 19.992 1.953) 23.448 17.443 ( 1.302 -9.965 -17.072) 19.810 20.635 ( 1.925 -0.116 0.321) 1.955 20.760 ( 3.090 3.698 0.341) 4.831 21.649 ( -3.902 -2.216 -1.737) 4.811 21.880 ( -7.345 -0.128 -3.676) 8.214 24.546 ( -3.613 -4.237 11.727) 12.982 25.350 ( 1.226 0.134 -1.759) 2.148 32.420 ( -0.430 2.308 -0.314) 2.369 32.471 ( -0.586 2.272 -1.434) 2.750 42.278 ( -10.213 -4.293 5.119) 12.204 42.948 ( -21.001 3.670 -8.692) 23.023 44.237 ( -5.294 6.901 -0.161) 8.699 47.524 ( 27.243 28.572 -44.029) 59.136 ======================= Grid point 160 (55/355) ======================= q-point: (-0.08 0.00 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.883 ( -13.941 23.019 21.622) 34.522 1.034 ( -13.098 42.354 12.235) 45.990 1.719 ( -29.193 73.651 9.286) 79.768 2.879 ( -9.472 3.581 0.188) 10.128 3.787 ( 6.797 5.417 5.399) 10.232 4.390 ( -10.033 -13.719 18.068) 24.806 4.781 ( -6.098 6.280 4.326) 9.764 5.855 ( -5.818 -7.124 11.340) 14.601 6.530 ( 6.840 -3.342 -3.486) 8.374 7.928 ( 5.467 -11.370 -1.725) 12.733 8.061 ( -1.031 7.341 -19.153) 20.538 8.548 ( 12.124 -3.135 7.722) 14.712 9.947 ( -2.985 -0.844 4.770) 5.690 11.152 ( 18.921 -39.161 38.538) 58.110 11.732 ( 13.450 -8.566 5.156) 16.759 12.335 ( 10.730 -6.508 12.700) 17.854 12.878 ( -4.602 -21.366 -1.283) 21.893 13.464 ( -7.770 -2.918 5.970) 10.224 13.896 ( -5.414 -0.691 -1.990) 5.810 13.987 ( -0.108 -9.377 6.934) 11.662 15.123 ( 12.501 8.098 -0.174) 14.896 15.609 ( -11.131 5.160 1.513) 12.362 15.878 ( 17.491 12.334 2.366) 21.533 17.113 ( -19.242 37.066 -57.397) 70.983 20.659 ( 0.458 -1.391 -0.027) 1.464 20.722 ( 1.270 3.268 -0.619) 3.561 21.641 ( -2.528 -1.703 -0.887) 3.175 21.821 ( -2.180 -0.105 -0.764) 2.312 24.750 ( -4.578 -19.959 20.853) 29.226 25.353 ( 1.252 0.044 -1.527) 1.975 32.378 ( -0.031 2.194 -0.974) 2.401 32.437 ( 0.178 0.781 -0.575) 0.986 42.263 ( -11.510 -4.710 2.390) 12.664 42.594 ( -28.119 3.751 -12.466) 30.986 44.107 ( -1.859 4.261 0.643) 4.693 46.514 ( 30.082 108.001 -97.581) 148.631 ======================= Grid point 162 (56/355) ======================= q-point: ( 0.08 0.08 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 354 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.998 ( -3.112 -0.000 36.734) 36.866 1.611 ( 40.159 0.000 25.948) 47.813 2.312 ( 69.723 0.000 25.601) 74.275 3.131 ( 24.776 0.000 2.925) 24.948 3.465 ( -15.338 -0.000 -2.482) 15.538 4.315 ( -7.653 -0.000 10.963) 13.370 4.595 ( -2.810 -0.000 -9.725) 10.122 5.920 ( -3.513 -0.000 8.848) 9.520 6.450 ( -5.271 -0.000 -2.639) 5.894 7.620 ( -5.807 -0.000 -15.833) 16.865 7.835 ( -21.601 -0.000 -7.871) 22.991 8.972 ( 6.543 0.000 7.492) 9.947 9.902 ( -4.141 -0.000 3.231) 5.253 11.590 ( 7.391 0.000 -15.484) 17.158 11.956 ( -59.789 -0.000 42.546) 73.382 12.288 ( -12.370 -0.000 12.306) 17.448 13.346 ( -0.242 -0.000 -1.122) 1.148 13.510 ( 8.212 0.000 4.060) 9.161 13.514 ( -0.871 -0.000 -1.401) 1.650 14.019 ( 6.049 0.000 4.669) 7.642 14.799 ( -5.687 -0.000 0.020) 5.687 15.340 ( -5.831 -0.000 -3.722) 6.918 15.912 ( 5.174 0.000 -0.220) 5.179 17.627 ( 40.497 0.000 -36.965) 54.831 20.669 ( -0.386 -0.000 -1.143) 1.206 20.718 ( 2.039 0.000 0.680) 2.149 21.746 ( 4.279 0.000 -0.611) 4.322 21.784 ( -1.260 -0.000 -1.189) 1.732 24.601 ( -14.666 -0.000 10.529) 18.054 25.371 ( 0.738 0.000 -0.491) 0.886 32.370 ( 1.867 0.000 0.443) 1.919 32.447 ( 2.015 0.000 -0.774) 2.158 42.084 ( -5.931 -0.000 -4.374) 7.369 44.182 ( 8.134 0.000 2.449) 8.495 44.459 ( 1.257 0.000 -3.125) 3.369 45.103 ( 81.865 0.000 -57.654) 100.129 ======================= Grid point 163 (57/355) ======================= q-point: ( 0.17 0.08 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.229 ( 0.411 -9.260 33.109) 34.382 2.109 ( 41.997 -2.917 19.572) 46.426 3.193 ( 1.921 -5.735 -2.772) 6.653 3.469 ( 36.196 -21.776 8.783) 43.145 3.726 ( 32.923 -28.937 17.835) 47.322 4.262 ( -1.748 1.476 6.452) 6.846 4.585 ( -3.994 -9.199 -15.687) 18.618 5.828 ( -3.297 10.577 6.404) 12.797 6.376 ( -4.571 3.944 3.305) 6.883 7.438 ( -27.260 11.417 -9.136) 30.935 7.538 ( -5.962 -5.734 -14.280) 16.503 9.022 ( 3.863 4.087 5.438) 7.823 9.877 ( -3.408 -0.224 2.836) 4.439 11.376 ( -11.905 18.515 13.733) 25.944 11.655 ( -8.325 2.137 2.960) 9.091 12.214 ( -16.784 2.904 11.057) 20.308 13.228 ( 3.050 15.436 5.611) 16.705 13.347 ( 4.345 9.937 -3.266) 11.326 13.683 ( -3.619 -6.913 -0.854) 7.849 14.261 ( 8.024 -14.232 6.473) 17.574 14.823 ( -8.786 -8.752 -2.471) 12.645 15.407 ( -9.669 -15.320 -3.159) 18.390 15.845 ( 7.787 11.142 0.419) 13.600 17.654 ( 15.741 11.290 -22.627) 29.787 20.613 ( -1.003 4.171 -0.560) 4.326 20.747 ( 2.309 -0.384 0.695) 2.442 21.738 ( 1.498 1.433 0.180) 2.081 21.878 ( 2.333 -7.411 -3.266) 8.428 24.519 ( -7.215 1.228 7.718) 10.637 25.374 ( 0.433 0.120 -0.305) 0.543 32.400 ( 2.139 -0.739 0.174) 2.270 32.478 ( 2.737 -1.220 -0.859) 3.117 42.016 ( -3.616 -0.682 -6.021) 7.057 43.920 ( 25.406 38.059 -2.018) 45.804 44.339 ( 9.318 -5.149 4.008) 11.376 46.157 ( 17.185 -51.376 -44.217) 69.928 ======================= Grid point 164 (58/355) ======================= q-point: ( 0.25 0.08 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.600 ( 3.957 -15.500 26.410) 30.877 2.695 ( 35.538 -9.671 13.314) 39.163 3.292 ( -0.402 -10.985 -3.831) 11.641 3.859 ( 6.729 -5.087 9.297) 12.553 4.344 ( -7.145 -13.161 -0.652) 14.990 4.696 ( 7.326 -16.187 -17.434) 24.892 4.930 ( 33.910 -35.110 18.490) 52.197 5.640 ( 3.976 7.773 3.838) 9.538 6.211 ( -7.167 13.011 8.625) 17.176 6.896 ( -26.366 13.717 -9.428) 31.181 7.581 ( -0.401 -10.802 -11.936) 16.104 8.968 ( 1.081 7.294 3.144) 8.016 9.873 ( -2.302 -1.270 2.600) 3.698 11.061 ( -6.538 15.892 12.644) 21.334 11.551 ( -2.869 4.696 -2.740) 6.148 11.966 ( -14.091 11.328 6.213) 19.117 12.987 ( 5.775 19.963 5.796) 21.575 13.190 ( 0.305 9.802 -7.745) 12.497 13.782 ( -1.217 -9.462 -0.109) 9.541 14.586 ( 12.517 -4.697 5.878) 14.604 14.855 ( -13.495 -11.744 -3.963) 18.323 15.497 ( -9.609 -7.821 1.821) 12.523 15.835 ( 0.584 -4.510 0.199) 4.552 17.449 ( 7.908 16.241 -11.294) 21.304 20.539 ( -1.749 2.355 -0.052) 2.934 20.783 ( 2.354 -0.919 0.566) 2.589 21.731 ( 1.672 1.563 0.021) 2.289 21.997 ( 2.089 -5.507 -4.172) 7.218 24.483 ( -3.849 0.437 5.614) 6.821 25.373 ( 0.192 0.221 -0.403) 0.498 32.436 ( 2.131 -1.073 -0.341) 2.410 32.531 ( 2.818 -2.103 -0.707) 3.587 41.987 ( -0.993 -1.932 -5.577) 5.985 43.699 ( 23.091 19.100 0.038) 29.967 44.575 ( 9.472 -8.385 5.507) 13.796 46.729 ( -0.320 -31.660 -32.621) 45.460 ======================= Grid point 165 (59/355) ======================= q-point: ( 0.33 0.08 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.048 ( 6.200 -18.743 20.036) 28.128 3.205 ( 24.250 -8.661 5.506) 26.332 3.484 ( 3.638 -9.701 0.404) 10.368 3.991 ( -0.790 -3.942 8.589) 9.483 4.464 ( -15.941 -18.496 -14.799) 28.552 4.859 ( -5.052 0.081 -2.508) 5.641 5.388 ( 15.763 -6.524 11.696) 20.684 5.845 ( -6.340 20.114 9.527) 23.141 5.951 ( -9.727 -6.479 -7.796) 14.049 6.661 ( 11.794 -13.369 5.239) 18.582 7.770 ( 4.936 -13.976 -9.527) 17.620 8.844 ( -0.521 8.375 1.076) 8.460 9.897 ( -1.695 -2.374 2.852) 4.079 10.797 ( -2.145 16.619 7.330) 18.290 11.417 ( -4.746 5.190 -1.417) 7.174 11.666 ( -10.087 10.895 1.414) 14.915 12.767 ( 7.568 16.875 2.633) 18.680 12.946 ( -2.519 11.810 -9.045) 15.087 13.974 ( 4.523 -10.336 1.265) 11.353 14.633 ( 7.502 7.606 -0.067) 10.683 14.979 ( -8.454 -12.841 1.368) 15.435 15.586 ( -6.544 -10.825 4.998) 13.601 15.897 ( -11.148 -7.787 -0.709) 13.617 17.204 ( 7.802 17.307 -4.988) 19.628 20.505 ( -1.229 0.036 0.336) 1.275 20.830 ( 2.070 -1.599 0.431) 2.651 21.718 ( 1.723 1.843 -0.273) 2.538 22.056 ( 0.302 -2.533 -4.228) 4.938 24.472 ( -2.568 -0.057 4.636) 5.300 25.368 ( 0.113 0.219 -0.698) 0.740 32.474 ( 1.992 -1.320 -0.821) 2.527 32.592 ( 2.265 -2.244 -0.487) 3.226 42.008 ( 0.665 -3.075 -3.343) 4.590 43.683 ( 19.904 9.739 0.392) 22.162 44.827 ( 7.160 -7.710 5.836) 12.032 47.001 ( -4.709 -21.272 -23.858) 32.309 ======================= Grid point 166 (60/355) ======================= q-point: ( 0.42 0.08 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.512 ( 7.050 -18.695 13.917) 24.349 3.411 ( 1.274 0.107 -2.306) 2.636 3.743 ( 14.131 -8.647 3.591) 16.952 4.043 ( -12.732 -5.433 2.357) 14.042 4.383 ( -7.963 6.016 -4.747) 11.051 4.830 ( -17.794 -13.250 -3.410) 22.446 5.389 ( -0.803 21.023 8.630) 22.739 5.732 ( -13.762 1.523 0.188) 13.847 5.851 ( 19.772 -9.218 7.385) 23.031 7.215 ( 12.528 -19.203 4.296) 23.327 7.996 ( 1.606 -11.696 -10.680) 15.920 8.719 ( 3.180 6.794 0.199) 7.504 9.944 ( -1.452 -3.293 3.573) 5.071 10.530 ( 0.248 16.422 3.205) 16.734 11.285 ( -6.364 2.756 -1.878) 7.185 11.440 ( -6.005 6.676 0.188) 8.981 12.520 ( 1.745 16.225 -10.661) 19.492 12.791 ( 6.355 5.966 3.739) 9.484 14.175 ( 4.455 -5.247 1.151) 6.979 14.619 ( 8.867 2.936 0.493) 9.354 15.040 ( -12.659 -7.074 0.670) 14.517 15.685 ( -3.766 -0.840 4.411) 5.861 15.936 ( -13.782 -16.153 -0.128) 21.234 16.993 ( 9.813 16.312 -2.083) 19.150 20.512 ( 0.095 -1.007 0.728) 1.246 20.877 ( 1.450 -1.528 0.238) 2.119 21.702 ( 1.305 1.739 -0.496) 2.230 22.055 ( -1.965 -0.857 -3.867) 4.421 24.473 ( -2.143 -0.245 4.309) 4.819 25.362 ( 0.199 0.135 -1.033) 1.060 32.511 ( 1.696 -1.236 -1.033) 2.339 32.641 ( 1.302 -1.645 -0.320) 2.122 42.064 ( 0.710 -3.487 -0.407) 3.582 43.742 ( 17.532 6.737 0.912) 18.804 44.998 ( 2.191 -3.658 3.824) 5.727 47.174 ( -3.925 -16.780 -16.952) 24.173 ======================= Grid point 167 (61/355) ======================= q-point: ( 0.50 0.08 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.910 ( 5.919 -14.469 5.952) 16.728 3.292 ( -7.480 8.991 1.445) 11.785 3.803 ( -18.621 2.258 -11.368) 21.933 4.031 ( 1.087 -8.336 -0.908) 8.456 4.343 ( -6.072 -5.159 15.130) 17.100 4.716 ( -1.983 8.715 0.154) 8.939 5.325 ( 4.082 -0.723 11.835) 12.540 5.647 ( -1.681 -5.393 -5.728) 8.045 6.251 ( 20.461 -5.440 14.125) 25.451 7.441 ( -7.688 -3.964 -1.718) 8.818 8.001 ( -10.289 -0.749 -14.233) 17.579 8.738 ( 12.681 1.125 -0.681) 12.749 10.007 ( -1.011 -3.366 4.249) 5.514 10.309 ( 1.080 11.511 1.796) 11.700 11.190 ( -4.115 0.120 -5.319) 6.726 11.327 ( -4.620 1.267 2.334) 5.329 12.243 ( 3.222 12.234 -11.764) 17.276 12.860 ( 10.608 0.002 7.005) 12.712 14.209 ( -4.341 1.069 -0.014) 4.470 14.585 ( -5.576 8.846 0.979) 10.503 15.107 ( -0.317 -12.805 0.149) 12.810 15.640 ( -3.448 0.655 2.308) 4.201 16.127 ( -7.126 -16.363 0.963) 17.873 16.840 ( 12.873 14.320 -0.989) 19.281 20.541 ( 1.537 -0.972 1.018) 2.084 20.906 ( 0.902 -0.395 -0.002) 0.985 21.679 ( 0.060 1.465 -0.802) 1.671 22.021 ( -4.064 -0.827 -3.181) 5.227 24.476 ( -2.098 -0.253 4.303) 4.794 25.358 ( 0.384 0.055 -1.300) 1.357 32.537 ( 1.263 -0.637 -0.983) 1.723 32.666 ( 0.246 -0.480 -0.225) 0.584 42.126 ( -0.632 -3.195 2.191) 3.925 43.795 ( 15.455 7.878 1.820) 17.442 45.016 ( -4.070 1.355 0.194) 4.294 47.346 ( -0.694 -14.440 -11.508) 18.477 ======================= Grid point 168 (62/355) ======================= q-point: (-0.42 0.08 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.945 ( -8.067 17.436 1.414) 19.263 3.190 ( -2.272 -8.203 2.932) 9.003 3.551 ( -19.334 -2.753 -9.746) 21.826 4.123 ( -4.807 -5.896 -4.209) 8.694 4.458 ( -7.774 -6.460 17.274) 20.014 4.661 ( 15.989 9.720 13.785) 23.242 5.457 ( 8.231 -1.490 1.861) 8.570 5.819 ( 6.379 -14.602 -2.015) 16.061 6.539 ( 16.198 2.016 14.972) 22.150 7.208 ( -21.421 11.440 -4.744) 24.743 7.771 ( -13.126 2.688 -15.605) 20.568 8.843 ( 13.610 2.644 -3.661) 14.340 10.044 ( -0.096 1.904 3.229) 3.750 10.210 ( -0.437 0.765 2.794) 2.929 11.162 ( 0.261 -2.715 -6.368) 6.928 11.322 ( -4.420 -4.535 2.723) 6.894 12.092 ( 7.999 6.318 -9.594) 13.998 13.037 ( 10.126 -4.267 6.989) 13.022 14.050 ( -16.934 5.575 -0.796) 17.846 14.303 ( -15.445 8.439 0.843) 17.620 15.374 ( 8.846 -10.228 -0.890) 13.552 15.651 ( -0.225 -2.944 2.206) 3.686 16.313 ( -3.559 -11.563 -0.303) 12.103 16.780 ( 17.715 10.205 0.335) 20.446 20.581 ( 2.746 -0.551 1.175) 3.038 20.908 ( 0.927 1.172 0.008) 1.494 21.647 ( -1.635 0.810 -1.221) 2.195 21.976 ( -6.081 -1.369 -2.598) 6.753 24.478 ( -2.211 -0.209 4.479) 4.999 25.356 ( 0.589 0.040 -1.481) 1.594 32.546 ( 0.799 0.361 -0.815) 1.197 32.659 ( -0.580 0.960 -0.220) 1.143 42.173 ( -2.642 -2.555 3.842) 5.317 43.785 ( 12.464 11.605 2.372) 17.194 44.889 ( -8.720 4.802 -2.521) 10.269 47.532 ( 2.911 -11.735 -8.779) 14.942 ======================= Grid point 169 (63/355) ======================= q-point: (-0.33 0.08 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.515 ( -11.167 22.726 6.310) 26.096 3.214 ( -11.788 -2.839 -4.305) 12.867 3.449 ( -7.949 -2.707 -1.302) 8.497 4.064 ( 0.587 11.743 4.899) 12.737 4.538 ( 7.726 -0.056 5.506) 9.487 4.842 ( -5.681 -12.569 20.702) 24.876 5.489 ( 14.921 9.690 -8.247) 19.610 6.217 ( 6.029 -19.831 4.685) 21.250 6.514 ( -13.877 21.104 -5.712) 25.895 6.724 ( -2.869 13.958 10.038) 17.430 7.621 ( -4.891 -5.767 -11.575) 13.826 8.862 ( 10.893 7.187 -6.167) 14.434 9.991 ( -1.042 3.598 2.058) 4.274 10.269 ( -0.800 -5.004 3.251) 6.021 11.228 ( 3.466 -5.843 -5.295) 8.613 11.413 ( -3.235 -9.718 1.817) 10.402 12.104 ( 12.501 0.112 -7.181) 14.418 13.245 ( 8.105 -5.308 5.838) 11.311 13.734 ( -25.732 3.238 0.116) 25.935 14.040 ( -16.752 4.469 -0.970) 17.364 15.562 ( 8.619 -2.884 -1.478) 9.208 15.721 ( 1.340 -1.564 2.548) 3.276 16.421 ( -1.237 -4.245 -1.570) 4.692 16.880 ( 20.830 1.205 1.051) 20.891 20.623 ( 3.259 -0.083 1.050) 3.425 20.892 ( 2.109 2.388 0.539) 3.231 21.612 ( -3.314 -0.381 -1.632) 3.714 21.918 ( -7.818 -1.360 -2.427) 8.298 24.480 ( -2.401 -0.250 4.859) 5.425 25.355 ( 0.776 0.074 -1.589) 1.770 32.534 ( 0.455 1.441 -0.665) 1.651 32.622 ( -0.963 2.273 -0.346) 2.492 42.193 ( -4.570 -1.906 4.356) 6.595 43.662 ( 6.885 16.055 1.139) 17.506 44.689 ( -9.100 6.312 -2.219) 11.295 47.703 ( 6.134 -8.007 -9.807) 14.068 ======================= Grid point 170 (64/355) ======================= q-point: (-0.25 0.08 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.046 ( -11.370 24.105 10.505) 28.648 3.085 ( -13.989 0.685 -2.079) 14.159 3.266 ( -0.599 23.719 1.964) 23.807 3.903 ( 1.649 8.090 10.282) 13.187 4.660 ( 8.419 0.547 -0.801) 8.474 5.028 ( -10.302 -5.407 17.000) 20.600 5.315 ( -4.871 21.069 -8.842) 23.363 5.764 ( -10.902 30.476 -1.991) 32.428 6.351 ( 1.809 6.733 6.230) 9.350 6.927 ( 8.924 -21.194 0.573) 23.004 7.762 ( 3.046 -14.717 -5.239) 15.916 8.766 ( 7.748 11.440 -7.032) 15.503 9.944 ( -1.964 1.243 2.273) 3.251 10.370 ( -0.032 -5.978 3.465) 6.910 11.362 ( 4.774 -7.483 -5.006) 10.190 11.601 ( -1.113 -14.223 1.925) 14.395 12.260 ( 15.956 -4.463 -4.965) 17.296 13.354 ( -4.059 1.497 4.773) 6.442 13.560 ( -16.286 -11.708 2.103) 20.168 13.811 ( -16.887 1.099 -3.257) 17.234 15.619 ( 5.879 5.531 -1.608) 8.231 15.750 ( 3.306 0.857 3.916) 5.196 16.413 ( 0.915 3.967 -1.460) 4.325 17.122 ( 16.273 -6.114 -1.751) 17.472 20.652 ( 2.298 0.540 0.450) 2.403 20.882 ( 4.254 3.022 1.015) 5.316 21.579 ( -4.849 -1.559 -1.926) 5.446 21.848 ( -7.406 -0.939 -2.008) 7.730 24.485 ( -2.730 -0.600 5.685) 6.335 25.354 ( 0.928 0.099 -1.618) 1.868 32.502 ( 0.264 2.301 -0.589) 2.390 32.566 ( -0.799 3.008 -0.638) 3.177 42.187 ( -5.845 -1.460 3.856) 7.153 43.397 ( -0.449 18.720 -1.911) 18.823 44.496 ( -5.436 7.380 0.660) 9.190 47.817 ( 9.149 -2.966 -15.876) 18.562 ======================= Grid point 171 (65/355) ======================= q-point: (-0.17 0.08 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.593 ( -10.835 23.646 16.068) 30.573 2.623 ( -4.241 42.510 2.126) 42.774 2.986 ( -5.801 4.439 0.688) 7.337 3.914 ( -0.424 -0.457 12.150) 12.166 4.237 ( -3.822 63.230 1.739) 63.369 4.710 ( 0.923 19.505 -5.913) 20.403 5.002 ( -10.083 3.945 8.043) 13.488 5.567 ( -5.591 -4.041 7.916) 10.500 6.365 ( 4.744 -3.089 0.109) 5.662 7.356 ( 4.024 -20.972 -1.966) 21.444 8.026 ( 1.314 -14.035 -9.925) 17.241 8.611 ( 7.761 10.996 -1.639) 13.559 9.926 ( -2.405 -0.122 2.731) 3.641 10.527 ( 2.208 -9.525 8.514) 12.964 11.514 ( 5.076 -7.401 -5.463) 10.506 11.876 ( 0.450 -17.088 3.847) 17.521 12.489 ( 14.832 -5.551 -2.887) 16.098 13.305 ( -13.455 -6.373 7.060) 16.477 13.664 ( -11.275 -7.239 -6.648) 14.957 13.698 ( -2.355 -7.769 4.401) 9.234 15.503 ( 4.600 12.140 -0.575) 12.995 15.771 ( 0.399 3.044 3.604) 4.734 16.307 ( 2.204 9.326 -1.177) 9.655 17.326 ( 7.037 -5.475 -8.941) 12.627 20.656 ( 0.908 0.769 -0.058) 1.191 20.866 ( 2.683 4.080 -0.779) 4.944 21.562 ( -2.759 -2.394 -0.622) 3.706 21.799 ( -3.433 -0.853 -0.779) 3.622 24.503 ( -3.529 -1.846 7.595) 8.576 25.356 ( 1.035 0.071 -1.525) 1.844 32.459 ( 0.043 2.684 -0.606) 2.752 32.507 ( -0.058 2.912 -1.013) 3.084 42.165 ( -5.770 -1.329 2.782) 6.542 43.040 ( -3.783 18.571 -3.863) 19.342 44.340 ( -1.267 8.373 3.072) 9.008 47.803 ( 11.735 6.202 -30.887) 33.619 ======================= Grid point 172 (66/355) ======================= q-point: (-0.08 0.08 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.203 ( -9.596 20.940 23.520) 32.920 1.801 ( -4.207 49.268 3.037) 49.540 2.892 ( 4.506 7.631 1.568) 8.999 3.085 ( 12.142 73.598 13.807) 75.860 4.019 ( 1.746 -3.021 14.866) 15.270 4.288 ( -7.876 22.751 -5.820) 24.769 4.859 ( -5.339 6.714 4.911) 9.884 5.691 ( -6.583 -10.833 9.502) 15.842 6.472 ( -0.160 -5.693 -3.082) 6.475 7.675 ( -2.317 -17.580 -4.303) 18.246 8.035 ( -3.964 1.866 -19.112) 19.608 8.651 ( 10.121 -2.042 8.145) 13.151 9.921 ( -2.796 -0.670 3.323) 4.394 10.873 ( 3.999 -22.053 20.014) 30.048 11.658 ( 2.994 -7.432 -2.051) 8.271 12.200 ( -1.127 -18.030 8.166) 19.825 12.708 ( 9.360 -7.873 0.806) 12.258 13.316 ( -11.689 -5.407 3.505) 13.347 13.760 ( -2.507 -12.822 -0.013) 13.065 13.851 ( 8.613 -4.946 2.005) 10.133 15.355 ( 5.513 10.419 1.772) 11.920 15.649 ( -6.901 8.141 0.333) 10.678 16.114 ( -5.747 13.320 -3.331) 14.884 17.327 ( 7.827 4.865 -21.354) 23.258 20.650 ( -0.192 0.095 -0.280) 0.353 20.783 ( -1.993 4.383 -2.602) 5.473 21.612 ( 3.495 -2.352 1.377) 4.432 21.807 ( 2.318 -0.872 0.188) 2.483 24.557 ( -6.301 -5.585 11.303) 14.094 25.359 ( 1.069 -0.000 -1.269) 1.659 32.411 ( -0.180 2.449 -0.802) 2.583 32.463 ( 0.827 2.147 -1.060) 2.533 42.159 ( -2.979 -2.389 2.052) 4.335 42.745 ( 8.106 13.125 -1.017) 15.460 44.221 ( 1.997 7.939 3.571) 8.931 47.438 ( 12.939 32.937 -60.455) 70.050 ======================= Grid point 175 (67/355) ======================= q-point: ( 0.17 0.17 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 355 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.320 ( 2.206 0.000 34.307) 34.378 2.641 ( 40.733 0.000 20.766) 45.721 3.068 ( -4.320 -0.000 -4.884) 6.521 3.756 ( 30.248 0.000 4.895) 30.641 4.006 ( 60.648 0.000 21.185) 64.241 4.287 ( -4.441 -0.000 5.084) 6.751 4.319 ( -7.829 -0.000 -24.862) 26.066 5.929 ( -1.638 -0.000 3.644) 3.995 6.407 ( -1.186 -0.000 7.840) 7.929 7.194 ( -31.922 -0.000 -9.616) 33.339 7.347 ( -6.840 -0.000 -13.473) 15.110 9.111 ( 2.044 0.000 3.973) 4.468 9.852 ( -3.478 -0.000 2.890) 4.522 11.460 ( -29.299 -0.000 29.508) 41.583 11.598 ( 6.316 0.000 -13.001) 14.454 12.090 ( -15.332 -0.000 6.630) 16.704 13.327 ( -0.375 -0.000 -1.318) 1.370 13.477 ( -3.876 -0.000 0.144) 3.879 13.722 ( 6.957 0.000 7.843) 10.484 14.139 ( -0.280 -0.000 8.132) 8.136 14.738 ( 1.152 0.000 -1.018) 1.537 15.151 ( -7.914 -0.000 -7.117) 10.643 16.014 ( 4.746 0.000 -0.100) 4.747 17.755 ( 6.486 0.000 -23.197) 24.087 20.660 ( 0.919 0.000 -1.712) 1.943 20.774 ( 2.842 0.000 0.775) 2.945 21.744 ( -1.381 -0.000 -1.518) 2.052 21.822 ( 3.564 0.000 0.144) 3.566 24.495 ( -5.582 -0.000 6.348) 8.453 25.377 ( 0.055 0.000 -0.035) 0.066 32.421 ( 2.655 0.000 0.156) 2.659 32.492 ( 3.046 0.000 -0.842) 3.160 41.954 ( -1.146 -0.000 -7.134) 7.226 44.417 ( 12.179 0.000 3.850) 12.773 44.477 ( 3.831 0.000 -4.128) 5.632 45.693 ( 29.931 0.000 -35.614) 46.521 ======================= Grid point 176 (68/355) ======================= q-point: ( 0.25 0.17 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.576 ( 4.146 -8.219 31.443) 32.763 3.059 ( 12.532 -6.553 2.450) 14.353 3.146 ( 27.396 -0.509 11.480) 29.709 3.957 ( 2.258 0.748 1.872) 3.026 4.076 ( -6.879 1.824 -14.878) 16.493 4.482 ( 13.786 -15.756 -7.385) 22.200 4.902 ( 44.060 -22.772 17.345) 52.543 5.831 ( -0.023 9.039 -0.237) 9.042 6.377 ( -4.901 7.469 11.387) 14.473 6.765 ( -26.048 7.886 -7.556) 28.245 7.338 ( 0.292 -10.211 -12.294) 15.984 9.092 ( -0.256 4.868 2.212) 5.353 9.841 ( -2.682 -0.917 2.806) 3.988 11.232 ( -16.773 9.261 19.324) 27.212 11.588 ( 2.587 2.445 -8.104) 8.851 11.952 ( -16.479 2.616 4.572) 17.300 13.263 ( -2.638 5.647 -4.240) 7.538 13.367 ( -0.378 9.771 1.869) 9.955 13.681 ( 1.714 5.593 6.471) 8.723 14.399 ( -1.046 -20.328 7.788) 21.794 14.748 ( 2.315 1.096 -1.532) 2.985 15.173 ( -9.854 -13.673 -4.991) 17.578 15.963 ( 3.767 9.406 0.497) 10.145 17.634 ( 1.772 6.403 -16.375) 17.671 20.607 ( 1.027 5.452 -0.746) 5.598 20.807 ( 3.012 -0.007 0.577) 3.066 21.747 ( -0.242 -1.199 -1.255) 1.752 21.895 ( 1.928 -4.734 -1.282) 5.270 24.474 ( -3.622 0.083 5.081) 6.240 25.375 ( -0.238 0.141 -0.081) 0.288 32.449 ( 2.632 -0.259 -0.274) 2.659 32.530 ( 3.029 -1.136 -0.744) 3.319 41.934 ( 1.561 -1.194 -6.301) 6.600 44.260 ( 13.020 21.995 -2.913) 25.725 44.604 ( 13.352 -4.273 4.582) 14.749 46.085 ( 8.579 -28.640 -28.384) 41.225 ======================= Grid point 177 (69/355) ======================= q-point: ( 0.33 0.17 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.948 ( 6.264 -13.686 26.331) 30.329 3.269 ( 3.354 -10.920 -0.509) 11.434 3.576 ( 37.572 0.742 13.186) 39.826 3.855 ( -19.983 -7.398 -14.117) 25.561 4.017 ( -2.063 -5.359 -4.874) 7.532 4.813 ( 5.804 -5.030 -4.373) 8.838 5.485 ( 10.512 -6.873 14.673) 19.314 5.738 ( -9.462 -0.564 -10.970) 14.498 6.139 ( -7.117 15.397 9.723) 19.551 6.632 ( 14.427 -7.573 6.387) 17.501 7.541 ( 7.233 -13.922 -10.715) 18.999 8.979 ( -1.644 7.631 1.122) 7.886 9.855 ( -1.971 -1.910 2.790) 3.914 11.016 ( -9.514 10.158 12.796) 18.906 11.486 ( 0.207 7.675 -5.787) 9.615 11.709 ( -14.592 7.807 0.965) 16.578 13.044 ( -5.596 10.385 -10.526) 15.810 13.184 ( 8.237 17.322 5.772) 20.030 13.776 ( 0.138 -12.170 4.111) 12.846 14.664 ( -4.122 -4.372 -2.516) 6.514 14.810 ( 3.708 -10.454 6.720) 12.969 15.277 ( -11.839 -12.800 -1.093) 17.470 15.835 ( -1.812 6.865 1.652) 7.290 17.464 ( 3.272 9.317 -9.808) 13.918 20.534 ( 1.008 3.688 0.280) 3.834 20.841 ( 2.905 -0.301 0.349) 2.941 21.750 ( 0.356 0.334 -1.217) 1.311 21.974 ( -0.219 -4.111 -2.620) 4.880 24.466 ( -2.523 -0.144 4.353) 5.033 25.368 ( -0.314 0.181 -0.397) 0.538 32.479 ( 2.543 -0.534 -0.809) 2.721 32.579 ( 2.478 -1.716 -0.587) 3.071 41.965 ( 3.227 -2.227 -3.804) 5.463 44.094 ( 16.873 14.791 -0.533) 22.445 44.840 ( 12.302 -4.854 4.868) 14.093 46.444 ( -2.954 -25.450 -23.171) 34.545 ======================= Grid point 178 (70/355) ======================= q-point: ( 0.42 0.17 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.378 ( 7.912 -15.785 20.144) 26.787 3.399 ( 0.150 -1.176 -6.069) 6.183 3.743 ( -16.982 -9.255 -7.230) 20.647 3.852 ( 8.553 0.135 5.473) 10.155 4.260 ( 15.326 -15.680 -1.401) 21.971 4.641 ( -15.815 11.260 0.213) 19.415 5.446 ( -19.007 0.173 -10.371) 21.653 5.834 ( 2.680 9.411 12.796) 16.108 5.933 ( 13.617 -5.458 10.985) 18.327 7.094 ( 16.632 -13.798 4.698) 22.115 7.781 ( 5.376 -11.018 -11.230) 16.626 8.851 ( 0.613 6.070 0.433) 6.116 9.892 ( -1.504 -2.954 3.269) 4.655 10.799 ( -4.433 13.427 7.257) 15.894 11.293 ( -5.062 7.939 -5.086) 10.701 11.474 ( -8.369 6.051 -0.554) 10.342 12.746 ( -1.111 14.074 -11.524) 18.225 13.056 ( 11.595 12.324 6.063) 17.975 14.049 ( 1.388 -14.226 3.112) 14.628 14.637 ( -1.829 -2.112 -2.930) 4.049 14.959 ( -1.612 2.096 4.058) 4.844 15.432 ( -11.736 -21.776 2.027) 24.820 15.711 ( -7.528 3.534 2.294) 8.627 17.304 ( 6.648 11.399 -5.656) 14.356 20.513 ( 1.243 0.510 0.652) 1.493 20.878 ( 2.517 -0.693 0.191) 2.618 21.732 ( -0.136 1.160 -1.429) 1.845 21.997 ( -1.800 -1.388 -2.670) 3.507 24.466 ( -2.079 -0.286 4.083) 4.590 25.360 ( -0.164 0.086 -0.802) 0.823 32.510 ( 2.367 -0.738 -1.095) 2.710 32.626 ( 1.567 -1.621 -0.441) 2.298 42.029 ( 3.159 -2.514 -0.801) 4.116 44.076 ( 17.958 9.266 1.672) 20.277 45.015 ( 7.526 -0.994 2.713) 8.062 46.700 ( -6.119 -23.035 -17.601) 29.628 ======================= Grid point 179 (71/355) ======================= q-point: ( 0.50 0.17 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.786 ( 8.149 -13.431 11.647) 19.557 3.283 ( -10.416 1.339 -10.407) 14.785 3.652 ( -12.531 3.916 -2.484) 13.362 3.923 ( -3.034 -5.155 0.726) 6.026 4.268 ( -20.187 5.825 9.548) 23.079 4.720 ( 19.579 -12.813 1.774) 23.467 5.402 ( 1.148 -10.166 -8.174) 13.096 5.621 ( -1.533 13.805 14.379) 19.992 6.370 ( 17.636 -11.090 11.750) 23.918 7.302 ( -4.744 -2.612 -1.565) 5.637 7.837 ( -5.337 -1.072 -12.594) 13.720 8.842 ( 7.880 -0.397 -1.258) 7.990 9.954 ( -0.957 -3.937 4.051) 5.729 10.552 ( -1.166 14.797 3.199) 15.183 11.132 ( -4.444 1.996 -5.449) 7.309 11.323 ( -5.767 3.760 0.670) 6.917 12.483 ( 6.652 14.017 -9.678) 18.286 13.056 ( 12.945 6.080 5.931) 15.483 14.167 ( -6.312 -0.303 0.131) 6.321 14.703 ( -2.917 7.445 0.623) 8.021 14.859 ( -3.866 -11.085 1.070) 11.789 15.604 ( -7.635 -0.905 -0.037) 7.689 15.741 ( -6.110 -21.152 4.374) 22.447 17.170 ( 9.917 11.689 -3.608) 15.748 20.539 ( 1.539 -1.344 0.715) 2.165 20.912 ( 2.042 -0.516 0.069) 2.107 21.694 ( -1.581 1.524 -1.768) 2.819 21.970 ( -2.574 0.487 -1.837) 3.199 24.470 ( -1.991 -0.295 4.080) 4.550 25.355 ( 0.110 -0.055 -1.137) 1.144 32.539 ( 1.997 -0.578 -1.066) 2.336 32.657 ( 0.620 -0.933 -0.275) 1.153 42.095 ( 1.670 -2.064 1.644) 3.123 44.130 ( 18.490 8.321 3.931) 20.654 45.025 ( -0.634 4.138 -1.675) 4.509 46.956 ( -4.182 -21.989 -12.037) 25.414 ======================= Grid point 180 (72/355) ======================= q-point: (-0.42 0.17 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.052 ( 5.392 -5.431 -1.838) 7.871 3.110 ( -10.692 1.956 -2.214) 11.092 3.348 ( -13.799 10.986 -2.161) 17.770 3.977 ( -3.610 -5.727 -0.023) 6.770 4.212 ( -17.286 -12.725 20.256) 29.513 5.109 ( 25.352 -2.944 5.967) 26.211 5.494 ( 4.375 7.505 11.642) 14.526 5.642 ( 6.255 -13.343 -8.629) 17.077 6.704 ( 8.329 -5.346 9.492) 13.713 7.128 ( -16.377 5.842 -3.119) 17.665 7.637 ( -11.790 5.094 -12.750) 18.097 8.953 ( 10.085 -1.591 -4.460) 11.142 10.038 ( -0.084 -4.142 4.566) 6.166 10.328 ( -1.067 11.823 1.678) 11.989 11.088 ( -0.264 -2.344 -5.543) 6.024 11.242 ( -5.046 -0.176 1.524) 5.275 12.335 ( 14.461 11.509 -7.158) 19.819 13.146 ( 11.373 1.324 5.104) 12.536 13.983 ( -17.285 7.145 -0.907) 18.726 14.358 ( -13.886 15.376 1.425) 20.767 15.201 ( 6.130 -18.576 0.024) 19.561 15.588 ( -2.974 -3.557 0.537) 4.667 16.038 ( -3.713 -17.706 2.147) 18.218 17.091 ( 12.542 9.106 -2.591) 15.714 20.588 ( 1.847 -1.877 0.732) 2.733 20.935 ( 1.872 0.216 0.061) 1.885 21.635 ( -3.132 1.517 -1.969) 3.999 21.919 ( -3.119 1.326 -0.883) 3.502 24.473 ( -2.058 -0.229 4.213) 4.694 25.354 ( 0.391 -0.133 -1.349) 1.410 32.557 ( 1.463 0.036 -0.866) 1.700 32.665 ( -0.072 0.208 -0.113) 0.247 42.141 ( -0.368 -1.262 3.086) 3.355 44.171 ( 18.090 12.386 5.107) 22.511 44.871 ( -8.346 5.942 -4.701) 11.272 47.235 ( -0.736 -19.580 -8.855) 21.502 ======================= Grid point 181 (73/355) ======================= q-point: (-0.33 0.17 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.822 ( -5.817 20.307 3.272) 21.376 3.058 ( -9.888 0.106 -2.437) 10.184 3.266 ( -0.479 -9.485 -1.493) 9.614 4.066 ( -1.113 -5.647 3.971) 6.992 4.437 ( -12.669 -18.212 21.965) 31.219 5.176 ( 19.178 26.562 10.851) 34.512 5.637 ( 10.198 -8.297 -4.135) 13.781 5.885 ( 2.331 -17.037 -5.613) 18.089 6.615 ( -17.036 10.140 -5.235) 20.505 6.955 ( -1.228 9.307 10.969) 14.438 7.444 ( -4.632 -2.927 -9.836) 11.259 9.012 ( 7.974 2.594 -7.091) 10.982 10.086 ( 1.201 5.053 3.204) 6.103 10.196 ( -3.284 -1.507 2.216) 4.239 11.144 ( 2.742 -5.191 -4.365) 7.316 11.252 ( -3.532 -5.518 1.353) 6.689 12.321 ( 20.461 7.649 -5.023) 22.414 13.270 ( 6.300 -2.551 3.563) 7.674 13.612 ( -22.655 10.548 0.436) 24.995 14.003 ( -14.491 10.650 0.350) 17.987 15.509 ( 5.712 -10.704 -1.780) 12.263 15.663 ( -0.683 -6.396 2.120) 6.773 16.267 ( -1.416 -11.784 0.318) 11.873 17.099 ( 12.672 3.789 -2.414) 13.445 20.640 ( 1.897 -1.483 0.688) 2.504 20.947 ( 2.325 0.805 0.265) 2.474 21.569 ( -3.778 1.060 -1.665) 4.263 21.857 ( -3.588 1.644 -0.423) 3.969 24.475 ( -2.177 -0.174 4.436) 4.945 25.354 ( 0.617 -0.120 -1.454) 1.584 32.557 ( 0.978 0.920 -0.657) 1.495 32.648 ( -0.409 1.561 -0.076) 1.615 42.158 ( -2.124 -0.455 3.525) 4.141 44.071 ( 11.384 20.135 1.060) 23.155 44.680 ( -7.967 3.721 -1.261) 8.882 47.498 ( 2.237 -15.511 -9.139) 18.142 ======================= Grid point 182 (74/355) ======================= q-point: (-0.25 0.17 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.408 ( -5.597 24.151 7.589) 25.926 2.988 ( -4.373 -0.302 1.229) 4.553 3.413 ( 2.081 -3.431 2.289) 4.620 4.119 ( -0.910 4.414 6.480) 7.893 4.693 ( -5.514 -9.426 14.543) 18.187 4.917 ( -3.547 9.450 7.171) 12.382 5.640 ( 9.382 15.711 -10.677) 21.186 6.132 ( -3.142 13.421 -1.907) 13.916 6.305 ( -4.686 -9.299 2.001) 10.603 6.791 ( -2.568 3.905 2.071) 5.111 7.556 ( 3.441 -10.883 -2.331) 11.649 8.959 ( 5.369 7.285 -8.197) 12.210 9.991 ( -0.804 5.147 2.042) 5.595 10.271 ( -1.775 -6.537 2.907) 7.371 11.263 ( 3.491 -7.028 -3.336) 8.527 11.374 ( -1.290 -11.128 1.338) 11.282 12.440 ( 23.775 2.830 -3.108) 24.143 13.210 ( -25.017 2.202 4.151) 25.455 13.427 ( 3.167 -2.688 -1.112) 4.300 13.724 ( -9.851 6.762 0.603) 11.964 15.665 ( 3.436 -3.806 -1.675) 5.394 15.764 ( 0.020 -3.476 3.181) 4.712 16.398 ( 0.108 -4.590 -0.785) 4.658 17.175 ( 7.179 -1.798 -4.224) 8.521 20.674 ( 1.144 -0.273 0.477) 1.269 20.954 ( 1.692 1.176 -0.251) 2.076 21.520 ( -1.807 0.284 -0.289) 1.852 21.797 ( -2.605 1.173 -0.254) 2.868 24.477 ( -2.354 -0.245 4.820) 5.370 25.356 ( 0.776 -0.065 -1.472) 1.665 32.540 ( 0.640 1.860 -0.530) 2.037 32.607 ( -0.343 2.674 -0.284) 2.711 42.149 ( -3.036 0.126 3.143) 4.371 43.747 ( 0.770 22.927 -5.047) 23.489 44.581 ( -0.685 5.062 5.101) 7.219 47.699 ( 4.232 -10.192 -13.047) 17.089 ======================= Grid point 183 (75/355) ======================= q-point: (-0.17 0.17 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.991 ( -4.272 24.847 12.089) 27.960 2.976 ( 3.944 4.127 3.827) 6.873 3.273 ( -1.451 25.535 0.723) 25.587 3.964 ( -5.434 6.462 9.437) 12.663 4.785 ( -0.675 -6.644 -0.715) 6.716 4.966 ( -8.688 -5.313 15.762) 18.765 5.219 ( 9.683 40.632 -2.335) 41.835 5.710 ( 1.744 25.993 0.646) 26.059 6.346 ( -6.048 -0.022 0.350) 6.058 6.977 ( -2.467 -22.496 -3.694) 22.931 7.777 ( 2.585 -12.058 -4.556) 13.147 8.825 ( 4.093 9.045 -5.939) 11.569 9.933 ( -1.250 2.006 2.276) 3.281 10.406 ( -0.253 -9.567 4.814) 10.713 11.409 ( 3.368 -7.697 -2.834) 8.867 11.601 ( -0.546 -15.862 1.969) 15.993 12.603 ( 11.225 0.952 -0.668) 11.285 13.079 ( -7.164 -5.668 6.449) 11.182 13.418 ( -10.541 -5.498 -7.564) 14.091 13.698 ( 9.112 -1.450 5.027) 10.507 15.678 ( 1.787 4.492 -0.444) 4.855 15.799 ( -2.693 0.301 3.022) 4.060 16.414 ( 1.193 2.999 -1.065) 3.399 17.228 ( -2.920 -4.777 -8.078) 9.828 20.675 ( -0.079 0.828 0.235) 0.865 20.913 ( -2.907 2.743 -2.311) 4.617 21.543 ( 4.207 -1.174 2.032) 4.817 21.778 ( 1.177 -0.275 0.060) 1.210 24.482 ( -2.732 -0.628 5.573) 6.238 25.359 ( 0.869 -0.042 -1.382) 1.633 32.503 ( 0.095 2.706 -0.482) 2.751 32.555 ( 0.466 3.028 -0.711) 3.145 42.128 ( -2.783 0.188 2.177) 3.539 43.337 ( -1.154 20.888 -6.420) 21.883 44.514 ( 3.046 8.233 7.489) 11.539 47.780 ( 4.572 -2.640 -21.481) 22.120 ======================= Grid point 184 (76/355) ======================= q-point: (-0.08 0.17 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.615 ( -2.795 23.760 17.551) 29.671 2.568 ( -0.537 43.218 1.153) 43.237 3.055 ( 11.219 4.487 3.052) 12.462 3.943 ( -7.263 -2.798 11.565) 13.941 4.495 ( 18.078 56.423 11.355) 60.327 4.755 ( 6.031 26.561 -4.035) 27.535 4.937 ( -0.418 5.046 6.232) 8.030 5.491 ( -6.864 -4.318 6.102) 10.149 6.315 ( -8.466 -5.900 -2.546) 10.628 7.274 ( -9.074 -21.048 -5.403) 23.549 7.891 ( -2.033 -4.062 -13.080) 13.847 8.755 ( 5.374 1.950 1.596) 5.936 9.910 ( -1.675 0.568 2.581) 3.129 10.657 ( 1.348 -15.993 10.072) 18.948 11.547 ( 1.097 -7.029 -2.009) 7.392 11.891 ( -2.917 -18.322 4.260) 19.036 12.655 ( -2.974 -5.540 3.907) 7.402 13.163 ( -2.177 -3.825 -0.659) 4.450 13.552 ( 8.257 -13.580 -1.971) 16.015 13.903 ( 15.274 -5.930 4.763) 17.063 15.576 ( 1.611 9.640 2.644) 10.125 15.678 ( -11.327 6.751 -1.125) 13.234 16.279 ( -3.431 12.947 -2.212) 13.575 17.229 ( -4.046 -7.502 -11.416) 14.247 20.648 ( -2.285 1.035 -0.408) 2.541 20.807 ( -3.282 3.555 -2.149) 5.294 21.628 ( 4.122 -1.738 1.610) 4.754 21.843 ( 8.285 -1.426 0.231) 8.410 24.496 ( -3.729 -1.534 6.879) 7.974 25.363 ( 0.874 -0.083 -1.140) 1.439 32.451 ( -0.222 2.863 -0.509) 2.916 32.513 ( 1.625 2.804 -0.985) 3.387 42.113 ( -2.181 -0.596 0.425) 2.300 43.042 ( 8.396 12.930 -3.415) 15.791 44.434 ( 4.954 9.930 7.130) 13.191 47.630 ( 2.640 11.378 -35.206) 37.093 ======================= Grid point 188 (77/355) ======================= q-point: ( 0.25 0.25 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 354 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.696 ( 4.128 0.000 32.729) 32.989 3.018 ( 4.273 0.000 -2.412) 4.906 3.553 ( 24.618 0.000 0.765) 24.629 3.770 ( -5.039 -0.000 -6.565) 8.276 4.176 ( -8.281 -0.000 0.101) 8.281 4.490 ( 30.822 0.000 -3.473) 31.017 5.195 ( 32.382 0.000 13.252) 34.988 5.846 ( -10.520 -0.000 -8.695) 13.648 6.431 ( -9.609 -0.000 11.704) 15.143 6.636 ( -5.534 -0.000 1.163) 5.655 7.220 ( 9.606 0.000 -12.066) 15.423 9.128 ( -2.247 -0.000 0.358) 2.275 9.821 ( -2.327 -0.000 3.123) 3.895 11.214 ( -19.730 -0.000 21.071) 28.866 11.596 ( 3.564 0.000 -10.028) 10.643 11.828 ( -13.655 -0.000 1.366) 13.724 13.311 ( 0.254 0.000 -1.822) 1.840 13.323 ( -11.102 -0.000 -0.264) 11.105 13.921 ( 3.999 0.000 11.371) 12.054 14.197 ( -0.466 -0.000 8.064) 8.077 14.797 ( 3.372 0.000 0.391) 3.395 14.902 ( -8.810 -0.000 -10.364) 13.603 16.092 ( 3.187 0.000 0.055) 3.188 17.579 ( -4.457 -0.000 -16.194) 16.796 20.675 ( 2.153 0.000 -1.716) 2.754 20.841 ( 3.257 0.000 0.286) 3.270 21.705 ( -1.157 -0.000 -1.299) 1.740 21.890 ( 2.990 0.000 0.425) 3.020 24.463 ( -2.849 -0.000 4.458) 5.290 25.371 ( -0.580 -0.000 -0.031) 0.581 32.472 ( 2.504 0.000 -0.434) 2.542 32.547 ( 3.034 0.000 -0.736) 3.122 41.926 ( 4.149 0.000 -5.099) 6.574 44.533 ( 5.351 0.000 -3.978) 6.668 44.719 ( 13.734 0.000 4.178) 14.355 45.828 ( 12.715 0.000 -23.283) 26.529 ======================= Grid point 189 (78/355) ======================= q-point: ( 0.33 0.25 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.952 ( 4.566 -7.813 30.529) 31.842 3.144 ( 7.673 -8.192 0.460) 11.234 3.445 ( -17.253 -4.783 -24.490) 30.336 4.002 ( -1.930 4.073 -0.052) 4.508 4.076 ( 31.024 3.384 14.012) 34.209 4.800 ( 14.997 -3.854 -3.856) 15.957 5.422 ( -14.692 -2.803 1.285) 15.012 5.660 ( -1.130 -0.024 -3.560) 3.735 6.281 ( -11.664 7.662 8.132) 16.152 6.789 ( 26.636 -2.468 8.642) 28.112 7.403 ( 16.313 -9.180 -9.848) 21.152 9.056 ( -3.994 4.302 -0.806) 5.925 9.824 ( -1.760 -1.028 3.105) 3.714 11.077 ( -14.789 4.666 15.759) 22.109 11.570 ( 0.386 1.348 -6.662) 6.808 11.661 ( -11.815 5.881 -1.810) 13.322 13.081 ( -8.520 8.457 -4.583) 12.850 13.390 ( 0.316 -3.200 1.866) 3.718 13.837 ( 5.905 12.624 8.729) 16.445 14.412 ( -2.977 -16.901 5.891) 18.144 14.753 ( -3.663 0.180 -3.936) 5.379 14.961 ( -5.227 -12.364 -2.850) 13.723 16.015 ( 1.065 11.171 0.903) 11.257 17.470 ( -3.961 -0.881 -12.476) 13.119 20.637 ( 2.457 5.428 -0.784) 6.009 20.874 ( 3.328 0.118 0.023) 3.331 21.714 ( -1.307 -2.230 -1.626) 3.053 21.931 ( 2.076 -1.392 -0.014) 2.500 24.459 ( -2.195 -0.123 4.047) 4.606 25.364 ( -0.671 0.082 -0.277) 0.730 32.495 ( 2.366 -0.200 -0.779) 2.499 32.580 ( 2.590 -0.834 -0.631) 2.793 41.967 ( 5.519 -1.009 -2.383) 6.096 44.442 ( 8.463 11.747 -2.329) 14.664 44.936 ( 15.089 -4.551 4.390) 16.360 45.974 ( 2.736 -15.682 -20.272) 25.775 ======================= Grid point 190 (79/355) ======================= q-point: ( 0.42 0.25 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.313 ( 5.749 -13.097 25.693) 29.406 3.254 ( -15.626 -4.214 -19.248) 25.148 3.407 ( 3.915 -12.444 3.951) 13.630 3.865 ( -6.197 1.641 -3.967) 7.539 4.458 ( 34.605 1.257 9.294) 35.853 4.722 ( -10.392 12.994 -1.084) 16.674 5.167 ( -22.391 -2.335 -7.826) 23.833 5.898 ( 13.527 -12.711 7.215) 19.915 6.075 ( -8.520 8.091 8.033) 14.233 7.165 ( 22.800 -3.464 5.391) 23.683 7.668 ( 14.199 -7.504 -9.668) 18.745 8.927 ( -3.427 4.708 -1.325) 5.972 9.849 ( -1.324 -2.117 3.195) 4.055 10.924 ( -10.362 6.072 10.920) 16.232 11.388 ( -9.050 10.703 -5.340) 15.000 11.487 ( -1.346 5.068 -3.676) 6.404 12.856 ( -3.711 7.847 -6.700) 10.966 13.401 ( 7.917 8.578 4.563) 12.533 13.868 ( 4.573 -7.088 5.353) 9.990 14.574 ( -3.798 -1.162 -3.471) 5.275 14.832 ( -6.880 -19.868 3.995) 21.402 15.056 ( -7.134 -6.251 -2.200) 9.737 15.800 ( -3.504 12.363 3.070) 13.211 17.410 ( 0.385 0.687 -8.828) 8.863 20.573 ( 2.337 4.245 0.200) 4.850 20.904 ( 3.213 0.148 -0.077) 3.217 21.716 ( -1.886 -0.667 -1.937) 2.785 21.966 ( 0.759 -0.840 -0.509) 1.242 24.460 ( -1.869 -0.241 3.902) 4.333 25.354 ( -0.478 0.020 -0.672) 0.825 32.520 ( 2.294 -0.467 -0.978) 2.537 32.617 ( 1.779 -1.148 -0.512) 2.178 42.038 ( 5.088 -1.261 0.658) 5.283 44.370 ( 10.966 7.500 0.516) 13.295 45.149 ( 14.687 0.985 2.836) 14.991 46.177 ( -5.381 -21.117 -16.966) 27.618 ======================= Grid point 191 (80/355) ======================= q-point: ( 0.50 0.25 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.713 ( 7.487 -13.712 17.772) 23.662 3.086 ( -13.277 -1.968 -12.856) 18.586 3.591 ( -2.919 -4.724 6.142) 8.280 3.799 ( -5.393 -2.482 -3.166) 6.728 4.285 ( -19.149 17.623 3.973) 26.326 4.809 ( 22.079 -6.454 2.639) 23.153 5.140 ( -1.497 -10.964 -3.952) 11.750 5.897 ( -0.486 7.823 9.084) 11.998 6.331 ( 10.196 -15.147 8.139) 19.990 7.290 ( 1.698 5.230 -1.700) 5.756 7.781 ( 4.684 1.493 -9.366) 10.578 8.870 ( 1.987 -0.983 -2.856) 3.615 9.899 ( -0.975 -3.406 3.664) 5.097 10.753 ( -6.468 9.615 6.803) 13.437 11.139 ( -3.538 6.693 -6.405) 9.916 11.355 ( -2.890 6.144 -1.244) 6.903 12.693 ( 4.203 8.211 -6.033) 11.022 13.362 ( 12.955 10.110 4.840) 17.131 14.065 ( -3.321 -5.860 1.981) 7.021 14.565 ( -2.349 -10.287 -2.126) 10.764 14.904 ( -5.863 10.876 1.003) 12.396 15.214 ( -8.320 -25.599 -2.378) 27.022 15.623 ( -5.731 3.770 5.997) 9.111 17.360 ( 4.614 4.296 -6.594) 9.123 20.551 ( 1.681 1.020 0.549) 2.041 20.932 ( 2.642 0.034 -0.162) 2.647 21.683 ( -2.508 0.844 -1.803) 3.202 21.967 ( 0.001 0.853 -0.395) 0.940 24.464 ( -1.799 -0.269 3.944) 4.343 25.348 ( -0.120 -0.140 -1.035) 1.052 32.546 ( 2.080 -0.533 -0.878) 2.319 32.647 ( 0.905 -0.997 -0.349) 1.391 42.107 ( 3.289 -0.759 2.938) 4.475 44.408 ( 12.016 3.368 3.867) 13.065 45.169 ( 7.684 10.423 -2.877) 13.265 46.449 ( -5.219 -25.624 -11.126) 28.419 ======================= Grid point 192 (81/355) ======================= q-point: (-0.42 0.25 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.935 ( -6.059 -2.347 -8.326) 10.562 3.054 ( 6.928 -5.476 7.958) 11.887 3.526 ( -3.806 12.051 2.326) 12.850 3.839 ( -3.115 -7.332 2.784) 8.439 3.946 ( -22.040 -1.876 17.228) 28.037 5.126 ( 10.878 -8.437 0.936) 13.798 5.372 ( 2.656 -18.463 -6.368) 19.710 5.918 ( 19.908 8.532 12.607) 25.061 6.609 ( -6.499 -7.869 1.804) 10.364 7.086 ( -7.896 6.480 -3.321) 10.741 7.636 ( -3.541 10.046 -7.608) 13.090 8.951 ( 5.506 -4.837 -6.158) 9.572 9.976 ( -0.772 -4.617 4.097) 6.221 10.539 ( -3.148 12.691 3.612) 13.565 11.049 ( 1.233 0.307 -4.878) 5.041 11.232 ( -3.618 3.883 0.320) 5.317 12.615 ( 11.575 7.658 -4.077) 14.465 13.366 ( 13.081 7.668 3.867) 15.648 13.931 ( -15.578 7.128 -1.365) 17.185 14.548 ( -8.923 19.584 0.448) 21.526 14.896 ( 2.987 -22.854 0.719) 23.059 15.453 ( -3.628 -9.881 -4.943) 11.629 15.701 ( -4.679 -16.469 7.012) 18.501 17.299 ( 6.763 6.199 -5.724) 10.814 20.573 ( 1.074 -1.492 0.718) 1.974 20.952 ( 1.708 -0.030 -0.335) 1.741 21.627 ( -2.282 1.860 -1.114) 3.148 21.936 ( -0.539 2.368 -0.069) 2.429 24.469 ( -1.853 -0.217 4.079) 4.486 25.347 ( 0.244 -0.273 -1.274) 1.326 32.568 ( 1.616 -0.190 -0.576) 1.726 32.664 ( 0.264 -0.425 -0.153) 0.523 42.152 ( 1.105 0.053 4.127) 4.272 44.511 ( 12.685 2.718 7.216) 14.845 44.945 ( -1.971 15.738 -8.116) 17.817 46.806 ( -1.325 -25.170 -7.431) 26.277 ======================= Grid point 193 (82/355) ======================= q-point: (-0.33 0.25 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.906 ( -1.434 -1.658 -1.247) 2.522 3.176 ( 5.240 6.702 0.613) 8.530 3.225 ( 0.247 11.284 3.549) 11.832 3.976 ( -1.992 -6.962 7.497) 10.423 4.062 ( -16.376 -19.990 23.831) 35.152 5.371 ( 0.677 -17.514 -1.548) 17.596 5.668 ( 3.804 -10.373 -11.530) 15.969 5.907 ( 14.191 25.527 9.454) 30.699 6.478 ( -13.001 -4.381 -5.345) 14.724 7.070 ( -2.186 0.246 7.771) 8.077 7.396 ( -0.467 6.964 -7.084) 9.945 9.034 ( 3.966 -2.684 -9.054) 10.242 10.069 ( -1.225 -5.294 3.649) 6.545 10.312 ( -1.608 12.773 2.464) 13.107 11.083 ( 3.384 -3.094 -2.976) 5.466 11.175 ( -2.456 -0.919 0.872) 2.764 12.626 ( 15.987 5.977 -2.271) 17.218 13.379 ( 8.199 7.035 2.884) 11.182 13.584 ( -19.046 10.279 -1.873) 21.724 14.136 ( -7.640 18.175 0.829) 19.732 15.297 ( 2.878 -19.590 0.138) 19.801 15.540 ( -1.140 -6.811 -1.445) 7.055 15.998 ( -2.601 -18.344 2.169) 18.655 17.238 ( 5.075 4.995 -5.981) 9.299 20.621 ( 0.746 -2.445 0.916) 2.716 20.964 ( 0.752 -0.154 -0.569) 0.956 21.573 ( -0.533 2.355 0.166) 2.420 21.879 ( -0.997 3.241 -0.016) 3.391 24.472 ( -1.940 -0.134 4.247) 4.671 25.350 ( 0.521 -0.303 -1.390) 1.515 32.578 ( 1.074 0.457 -0.234) 1.190 32.663 ( -0.062 0.589 -0.075) 0.597 42.166 ( -0.642 0.805 4.362) 4.482 44.527 ( 5.231 23.026 -5.544) 24.255 44.650 ( -1.613 -0.601 4.484) 4.803 47.169 ( 1.948 -21.194 -7.384) 22.528 ======================= Grid point 194 (83/355) ======================= q-point: (-0.25 0.25 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.787 ( -0.889 20.091 4.321) 20.569 3.017 ( 5.675 2.095 5.814) 8.390 3.369 ( 8.210 -6.845 4.669) 11.664 4.091 ( -3.342 -6.163 7.779) 10.472 4.387 ( -10.978 -20.555 21.728) 31.861 5.236 ( -16.820 29.082 -8.525) 34.660 5.729 ( 2.183 -21.229 -6.254) 22.238 5.889 ( 1.084 -3.598 -6.014) 7.091 6.493 ( 11.685 8.586 6.123) 15.740 6.887 ( -10.045 11.158 1.182) 15.060 7.460 ( 8.257 -6.495 0.769) 10.533 9.026 ( 1.512 1.528 -10.541) 10.757 10.114 ( -2.989 7.342 2.008) 8.177 10.163 ( -0.019 -3.336 2.709) 4.297 11.172 ( 2.504 -5.303 -1.581) 6.074 11.234 ( 0.576 -6.234 1.184) 6.371 12.691 ( 10.184 3.274 -0.140) 10.698 13.175 ( -6.536 11.761 3.396) 13.877 13.383 ( -4.990 3.164 -4.720) 7.562 13.854 ( 2.224 11.178 1.892) 11.554 15.575 ( 2.284 -10.204 -0.915) 10.497 15.654 ( -2.178 -8.571 1.473) 8.965 16.252 ( -0.452 -12.785 0.200) 12.795 17.170 ( -1.533 2.060 -7.284) 7.724 20.666 ( -0.076 -1.656 0.938) 1.904 20.960 ( -1.128 0.353 -1.245) 1.717 21.554 ( 3.151 1.690 1.949) 4.073 21.819 ( -0.033 2.744 -0.156) 2.749 24.474 ( -2.034 -0.083 4.448) 4.892 25.354 ( 0.690 -0.246 -1.413) 1.591 32.571 ( 0.582 1.272 -0.025) 1.399 32.642 ( 0.000 1.790 -0.228) 1.804 42.155 ( -1.514 1.303 3.822) 4.312 44.072 ( -6.247 21.975 -10.745) 25.247 44.713 ( 6.203 3.622 10.396) 12.636 47.467 ( 3.811 -15.334 -10.129) 18.768 ======================= Grid point 195 (84/355) ======================= q-point: (-0.17 0.25 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.432 ( 0.161 24.006 8.641) 25.514 3.127 ( 12.962 1.050 7.162) 14.846 3.530 ( 4.300 3.310 6.344) 8.348 4.105 ( -6.859 9.665 5.292) 12.979 4.621 ( -10.165 -5.304 3.480) 11.982 4.770 ( -9.922 -9.105 11.709) 17.845 5.691 ( 2.424 16.036 -12.673) 20.583 6.111 ( -10.995 -19.423 -3.944) 22.665 6.372 ( 17.770 28.355 8.206) 34.454 6.671 ( -9.218 -1.084 -1.370) 9.382 7.671 ( 8.981 -6.458 1.271) 11.135 8.926 ( -0.282 4.798 -9.824) 10.937 9.994 ( -1.035 5.157 2.455) 5.805 10.261 ( -1.368 -7.977 2.115) 8.365 11.304 ( 2.903 -7.380 -0.962) 7.988 11.383 ( 0.063 -10.404 1.524) 10.515 12.617 ( -13.171 2.695 4.378) 14.139 13.186 ( 17.359 -3.421 0.136) 17.694 13.207 ( -5.275 5.543 -5.504) 9.426 13.833 ( 11.522 2.602 2.860) 12.153 15.686 ( -0.141 -2.864 -0.646) 2.939 15.756 ( -3.892 -4.391 2.620) 6.426 16.412 ( 1.760 -5.421 -0.063) 5.700 17.058 ( -11.238 -0.769 -8.908) 14.361 20.675 ( -2.083 -0.026 0.547) 2.154 20.909 ( -2.949 2.225 -1.828) 4.122 21.596 ( 4.707 0.078 2.486) 5.324 21.812 ( 5.147 0.294 0.199) 5.159 24.475 ( -2.191 -0.143 4.750) 5.233 25.359 ( 0.759 -0.177 -1.345) 1.555 32.544 ( -0.118 2.285 -0.140) 2.293 32.607 ( 0.860 2.515 -0.455) 2.697 42.131 ( -1.492 1.412 2.566) 3.287 43.616 ( -4.312 19.433 -9.546) 22.076 44.732 ( 5.810 7.052 10.644) 14.028 47.644 ( 3.579 -7.676 -15.424) 17.596 ======================= Grid point 196 (85/355) ======================= q-point: (-0.08 0.25 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.083 ( 1.411 24.259 12.883) 27.504 3.215 ( -1.426 32.811 -0.510) 32.846 3.278 ( 17.312 3.297 5.538) 18.473 3.915 ( -6.286 2.185 9.993) 12.006 4.784 ( -0.377 -12.281 3.597) 12.802 4.984 ( -4.356 -9.492 16.711) 19.706 5.280 ( 0.090 25.915 -9.886) 27.736 5.990 ( 14.181 35.177 3.025) 38.048 6.114 ( -9.373 2.862 0.614) 9.820 6.765 ( -12.774 -19.996 -6.000) 24.475 7.821 ( 6.448 -1.298 -3.562) 7.480 8.814 ( -0.160 2.424 -5.194) 5.734 9.935 ( -0.861 2.522 2.577) 3.708 10.448 ( 0.054 -13.734 4.565) 14.473 11.435 ( 0.092 -6.182 -0.002) 6.183 11.598 ( -1.843 -14.937 1.495) 15.125 12.518 ( -10.045 -3.912 6.175) 12.423 13.065 ( -7.572 -2.496 -8.337) 11.536 13.535 ( 25.466 -6.934 1.702) 26.448 13.989 ( 15.179 -4.078 3.331) 16.067 15.646 ( -9.386 3.862 -1.253) 10.226 15.720 ( -2.891 4.838 2.895) 6.336 16.422 ( -1.728 7.279 -0.986) 7.546 16.955 ( -11.152 -9.293 -7.829) 16.493 20.630 ( -4.585 1.156 -0.359) 4.742 20.834 ( -0.837 3.087 -0.833) 3.306 21.642 ( 1.934 -0.841 1.003) 2.335 21.914 ( 10.362 -1.774 0.009) 10.512 24.479 ( -2.551 -0.368 5.213) 5.815 25.363 ( 0.722 -0.165 -1.155) 1.372 32.495 ( -0.236 2.850 -0.455) 2.896 32.574 ( 1.895 2.714 -0.574) 3.360 42.102 ( -1.377 1.263 0.317) 1.895 43.300 ( 4.628 12.484 -5.773) 14.512 44.695 ( 5.714 9.573 9.456) 14.619 47.625 ( 0.878 3.056 -23.027) 23.245 ======================= Grid point 201 (86/355) ======================= q-point: ( 0.33 0.33 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 355 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.063 ( 2.338 0.000 31.728) 31.814 3.137 ( -14.343 -0.000 -21.968) 26.236 3.176 ( 10.614 0.000 1.655) 10.743 3.969 ( -8.891 -0.000 -5.695) 10.558 4.462 ( 30.275 0.000 15.162) 33.860 4.963 ( 18.048 0.000 -3.218) 18.333 5.158 ( -28.386 -0.000 -6.724) 29.171 5.636 ( -0.938 -0.000 2.914) 3.062 6.234 ( -15.608 -0.000 6.351) 16.850 7.125 ( 34.096 0.000 7.777) 34.971 7.495 ( 23.992 0.000 -8.431) 25.431 9.030 ( -6.476 -0.000 -2.604) 6.980 9.815 ( -1.356 -0.000 3.287) 3.555 11.035 ( -15.132 -0.000 15.045) 21.339 11.477 ( -9.726 -0.000 -3.701) 10.407 11.668 ( 0.985 0.000 -5.912) 5.993 13.080 ( -11.626 -0.000 -0.233) 11.628 13.309 ( 1.422 0.000 -1.847) 2.331 14.087 ( 1.320 0.000 12.868) 12.936 14.264 ( 0.970 0.000 4.385) 4.491 14.622 ( -8.153 -0.000 -12.533) 14.952 14.837 ( -0.703 -0.000 1.755) 1.891 16.145 ( 1.841 0.000 0.577) 1.929 17.328 ( -6.765 -0.000 -11.701) 13.516 20.710 ( 2.599 0.000 -1.433) 2.968 20.905 ( 3.092 0.000 -0.451) 3.125 21.677 ( -0.732 -0.000 -0.635) 0.969 21.945 ( 2.139 0.000 0.252) 2.154 24.456 ( -1.842 -0.000 3.863) 4.279 25.355 ( -0.787 -0.000 -0.409) 0.887 32.511 ( 2.047 0.000 -0.842) 2.213 32.596 ( 2.366 0.000 -0.571) 2.434 42.016 ( 6.431 0.000 0.461) 6.448 44.612 ( 5.423 0.000 -2.686) 6.051 45.019 ( 12.194 0.000 3.562) 12.703 45.821 ( 5.782 0.000 -16.878) 17.841 ======================= Grid point 202 (87/355) ======================= q-point: ( 0.42 0.33 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.290 ( 0.861 -8.328 29.331) 30.503 2.956 ( -10.211 -3.389 -15.470) 18.843 3.348 ( 7.883 -6.002 4.728) 10.978 3.832 ( -3.827 2.990 -7.269) 8.742 4.781 ( 1.637 2.605 6.536) 7.224 4.869 ( -10.178 3.085 -5.291) 11.879 4.957 ( 12.413 7.533 2.147) 14.678 5.785 ( 3.122 -14.107 5.147) 15.338 6.074 ( -13.236 3.264 3.596) 14.099 7.451 ( 26.143 3.330 5.032) 26.831 7.732 ( 22.785 -2.615 -8.311) 24.394 8.920 ( -7.559 2.210 -3.447) 8.597 9.826 ( -1.091 -0.995 3.207) 3.531 10.931 ( -12.246 2.731 11.346) 16.916 11.350 ( -10.648 1.999 -3.411) 11.359 11.604 ( 3.522 6.591 -5.868) 9.502 12.902 ( -5.888 5.947 -1.773) 8.555 13.411 ( 0.924 -8.062 0.212) 8.117 14.055 ( 7.499 10.513 8.833) 15.645 14.390 ( -3.641 -15.069 1.713) 15.597 14.525 ( -9.373 -1.452 -9.092) 13.139 14.900 ( -2.928 -6.987 1.739) 7.772 16.032 ( -0.389 13.821 1.582) 13.916 17.286 ( -3.561 -6.519 -9.378) 11.963 20.681 ( 2.446 4.900 -0.736) 5.526 20.935 ( 2.914 -0.202 -0.638) 2.990 21.678 ( -1.068 -0.809 -0.678) 1.501 21.968 ( 1.443 -0.337 0.005) 1.482 24.457 ( -1.644 -0.123 3.838) 4.177 25.345 ( -0.599 -0.033 -0.718) 0.935 32.529 ( 1.865 -0.335 -0.842) 2.073 32.619 ( 1.757 -0.488 -0.486) 1.887 42.090 ( 5.549 -0.260 3.553) 6.594 44.570 ( 5.826 7.130 -0.596) 9.226 45.263 ( 13.446 -9.059 3.534) 16.594 45.827 ( -0.540 -5.275 -15.955) 16.813 ======================= Grid point 203 (88/355) ======================= q-point: ( 0.50 0.33 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.612 ( 0.339 -14.192 22.917) 26.958 2.894 ( -4.729 -3.848 -6.228) 8.716 3.503 ( -2.391 -4.936 6.498) 8.503 3.764 ( 2.358 2.308 -3.908) 5.115 4.500 ( -9.134 22.275 2.298) 24.185 4.683 ( -9.693 -9.804 -5.075) 14.691 5.228 ( 22.700 0.886 7.145) 23.815 5.888 ( -11.305 -2.798 0.219) 11.648 6.168 ( 4.157 -16.320 6.091) 17.909 7.509 ( 9.072 13.173 0.233) 15.997 7.887 ( 14.296 3.669 -7.875) 16.729 8.822 ( -4.171 -1.381 -4.725) 6.452 9.858 ( -0.997 -2.306 3.417) 4.241 10.813 ( -9.082 4.000 7.867) 12.664 11.178 ( -5.378 5.273 -4.473) 8.760 11.478 ( 2.611 9.306 -3.657) 10.334 12.792 ( 0.998 3.373 -2.080) 4.087 13.547 ( 3.332 -3.918 1.716) 5.422 14.055 ( 8.342 4.103 5.699) 10.904 14.393 ( -9.842 -2.010 -5.922) 11.661 14.696 ( -4.924 -25.042 -2.679) 25.662 14.949 ( -3.727 -0.590 0.904) 3.880 15.762 ( -3.543 15.211 4.109) 16.150 17.342 ( 1.017 -5.076 -7.715) 9.290 20.618 ( 1.765 4.408 0.079) 4.749 20.959 ( 2.336 0.208 -0.704) 2.448 21.666 ( -1.302 0.357 -0.523) 1.448 21.980 ( 0.667 0.260 -0.159) 0.733 24.461 ( -1.614 -0.181 3.934) 4.256 25.339 ( -0.209 -0.184 -1.049) 1.085 32.552 ( 1.649 -0.617 -0.621) 1.867 32.641 ( 1.019 -0.660 -0.376) 1.271 42.158 ( 3.430 0.261 5.748) 6.699 44.545 ( 5.209 2.707 2.380) 6.335 45.450 ( 13.689 9.308 -2.280) 16.710 45.930 ( -5.549 -22.848 -10.240) 25.645 ======================= Grid point 204 (89/355) ======================= q-point: ( 0.58 0.33 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.847 ( 0.398 -3.801 0.333) 3.836 3.034 ( 4.638 -12.670 16.090) 20.998 3.536 ( -7.147 -0.835 4.634) 8.559 3.746 ( -0.518 -1.603 5.785) 6.025 4.051 ( -7.474 21.930 6.774) 24.139 4.927 ( 3.106 -22.452 -4.836) 23.176 5.284 ( 2.030 7.040 1.516) 7.482 6.007 ( 2.380 -15.011 -0.129) 15.199 6.439 ( -2.880 -8.690 4.512) 10.206 7.243 ( 0.207 18.880 -1.812) 18.968 7.803 ( 4.124 12.182 -6.204) 14.279 8.852 ( 0.699 -6.525 -7.994) 10.343 9.915 ( -1.127 -3.713 3.948) 5.535 10.678 ( -6.101 6.892 5.042) 10.495 11.071 ( 1.470 2.405 -3.833) 4.758 11.324 ( 0.836 9.306 -1.361) 9.442 12.772 ( 5.617 2.749 -0.689) 6.292 13.605 ( 5.526 2.919 0.898) 6.313 13.946 ( -6.325 11.341 0.136) 12.986 14.533 ( 0.093 -20.556 -0.291) 20.558 14.781 ( -4.211 12.966 -2.952) 13.949 15.090 ( -1.161 -23.528 -4.047) 23.901 15.578 ( -4.813 2.764 6.994) 8.929 17.374 ( 3.392 0.356 -7.244) 8.007 20.582 ( 0.730 1.358 0.709) 1.697 20.967 ( 1.016 0.397 -0.919) 1.426 21.642 ( -0.176 1.415 0.389) 1.478 21.968 ( 0.045 1.562 -0.201) 1.575 24.466 ( -1.680 -0.167 4.086) 4.421 25.338 ( 0.205 -0.352 -1.291) 1.353 32.575 ( 1.224 -0.542 -0.232) 1.358 32.657 ( 0.427 -0.597 -0.211) 0.764 42.198 ( 1.129 1.072 6.712) 6.890 44.591 ( 1.776 -1.270 4.477) 4.981 45.250 ( 4.997 19.026 -8.425) 21.400 46.328 ( 1.384 -27.693 -4.321) 28.062 ======================= Grid point 205 (90/355) ======================= q-point: (-0.33 0.33 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.923 ( 7.354 -0.965 3.794) 8.331 3.326 ( 13.937 0.603 4.669) 14.711 3.460 ( -6.774 2.430 2.948) 7.777 3.727 ( -14.281 0.711 20.117) 24.680 3.922 ( 3.081 -5.828 13.457) 14.985 5.175 ( -2.276 -3.191 -3.693) 5.385 5.367 ( 2.008 -21.402 -5.327) 22.146 6.094 ( -29.422 1.328 -12.625) 32.044 6.481 ( 17.058 0.445 9.336) 19.451 7.075 ( 1.455 3.865 3.765) 5.588 7.582 ( 5.524 13.429 -5.133) 15.401 8.928 ( 0.014 -6.314 -11.156) 12.819 9.989 ( -1.905 -4.393 3.954) 6.210 10.507 ( -2.957 10.299 3.154) 11.170 11.084 ( 4.724 -1.123 -1.708) 5.147 11.194 ( -0.020 5.592 -0.020) 5.592 12.790 ( 5.256 2.514 1.367) 5.985 13.519 ( -12.449 6.012 -4.456) 14.525 13.707 ( 8.725 14.203 3.007) 16.938 14.434 ( -1.154 21.121 -1.228) 21.188 14.927 ( -0.779 -24.616 0.280) 24.629 15.387 ( 2.200 -12.183 -6.326) 13.903 15.669 ( -4.372 -15.511 6.113) 17.236 17.322 ( 1.628 4.905 -7.723) 9.293 20.594 ( -0.021 -1.553 1.240) 1.987 20.961 ( -0.286 0.074 -1.150) 1.187 21.626 ( 2.084 2.065 1.696) 3.389 21.927 ( -0.180 2.936 -0.294) 2.956 24.471 ( -1.766 -0.107 4.239) 4.594 25.342 ( 0.518 -0.434 -1.415) 1.568 32.590 ( 0.628 -0.097 0.184) 0.661 32.666 ( 0.126 -0.170 -0.112) 0.240 42.208 ( -0.562 1.755 6.693) 6.942 44.584 ( -9.297 3.335 -2.242) 10.128 44.953 ( 8.230 16.194 -1.233) 18.207 46.786 ( 5.117 -24.650 -4.470) 25.570 ======================= Grid point 206 (91/355) ======================= q-point: (-0.25 0.33 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.036 ( 8.895 3.845 5.680) 11.232 3.236 ( 1.512 11.486 3.345) 12.058 3.465 ( 14.917 2.930 7.931) 17.147 3.889 ( -11.399 -15.965 18.495) 26.960 4.141 ( 0.059 -10.063 16.914) 19.681 5.273 ( -5.704 -10.201 -9.299) 14.936 5.398 ( -23.902 9.719 -8.590) 27.195 5.757 ( -4.961 -9.143 -8.951) 13.724 6.748 ( 10.215 -4.295 9.816) 14.804 6.946 ( -4.521 10.505 -1.488) 11.532 7.555 ( 17.386 2.364 0.907) 17.570 8.946 ( -2.435 -3.737 -13.053) 13.794 10.048 ( -3.507 -3.797 2.788) 5.872 10.317 ( -0.733 10.983 2.672) 11.327 11.149 ( 2.574 0.258 -0.148) 2.591 11.171 ( 3.046 -3.697 0.790) 4.855 12.765 ( -4.374 4.418 4.232) 7.521 13.214 ( -15.045 6.205 -6.005) 17.347 13.629 ( 17.430 14.417 1.536) 22.672 14.128 ( 5.973 15.948 -0.085) 17.030 15.299 ( -3.041 -21.156 0.374) 21.376 15.527 ( 1.339 -6.276 -1.720) 6.644 15.970 ( -1.267 -19.240 0.645) 19.292 17.174 ( -4.175 6.589 -8.468) 11.513 20.631 ( -1.132 -2.271 1.366) 2.882 20.947 ( -1.252 0.198 -1.334) 1.840 21.634 ( 4.013 1.877 2.655) 5.165 21.877 ( 1.505 3.082 -0.267) 3.440 24.474 ( -1.841 -0.032 4.372) 4.744 25.349 ( 0.690 -0.403 -1.444) 1.650 32.591 ( -0.012 0.549 0.401) 0.680 32.663 ( 0.225 0.692 -0.168) 0.747 42.193 ( -1.324 2.177 5.925) 6.450 44.239 ( -12.569 15.896 -11.442) 23.272 44.911 ( 7.650 5.090 9.161) 12.975 47.190 ( 6.842 -18.932 -6.809) 21.251 ======================= Grid point 207 (92/355) ======================= q-point: (-0.17 0.33 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.857 ( 2.838 20.666 5.518) 21.577 3.289 ( 8.972 -1.872 7.411) 11.786 3.654 ( 12.644 -0.247 13.035) 18.161 4.094 ( -1.201 -8.305 8.393) 11.868 4.414 ( -5.722 -13.263 17.110) 22.392 4.712 ( -21.451 17.171 -7.881) 28.585 5.578 ( -10.424 -23.851 -6.102) 26.735 5.777 ( -1.183 1.041 -10.097) 10.219 6.579 ( -18.970 8.090 -4.989) 21.218 6.979 ( 22.046 10.206 10.103) 26.311 7.751 ( 17.720 -1.393 3.531) 18.122 8.885 ( -4.518 -0.527 -13.175) 13.938 10.058 ( -3.545 0.592 2.293) 4.264 10.191 ( -0.229 2.776 1.858) 3.348 11.217 ( 2.448 -5.558 -0.208) 6.076 11.278 ( 2.246 -4.419 1.807) 5.276 12.581 ( -13.236 7.098 6.452) 16.347 13.006 ( -12.932 -0.374 -8.928) 15.719 13.622 ( 26.626 11.544 2.072) 29.094 14.034 ( 11.493 6.859 0.639) 13.399 15.560 ( -5.801 -14.222 0.900) 15.386 15.617 ( -0.401 -4.320 -0.118) 4.340 16.255 ( 1.097 -14.546 -0.463) 14.595 16.947 ( -11.383 6.426 -8.442) 15.560 20.641 ( -3.434 -0.779 0.793) 3.610 20.915 ( -1.114 1.362 -1.025) 2.037 21.652 ( 2.123 1.369 1.686) 3.037 21.884 ( 7.097 0.589 0.545) 7.142 24.475 ( -1.921 0.018 4.501) 4.894 25.356 ( 0.735 -0.310 -1.398) 1.610 32.572 ( -0.605 1.475 0.135) 1.600 32.648 ( 0.884 1.496 -0.195) 1.749 42.166 ( -1.264 2.365 4.430) 5.179 43.804 ( -8.196 15.985 -10.624) 20.870 44.940 ( 4.775 4.912 10.135) 12.234 47.471 ( 6.129 -11.124 -10.708) 16.612 ======================= Grid point 208 (93/355) ======================= q-point: (-0.08 0.33 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.556 ( 3.652 22.706 9.082) 24.726 3.420 ( 4.273 -0.319 3.308) 5.413 3.703 ( 7.361 17.425 5.880) 19.808 4.010 ( -2.296 10.180 7.547) 12.879 4.499 ( -5.047 -16.402 1.981) 17.275 4.800 ( -1.469 -16.864 16.725) 23.796 5.556 ( -7.285 11.047 -2.764) 13.518 5.777 ( -11.602 -9.451 -11.849) 19.087 6.278 ( -17.794 -0.941 -8.360) 19.683 6.959 ( 22.098 23.747 10.435) 34.075 7.936 ( 14.675 1.801 2.064) 14.928 8.774 ( -5.296 0.123 -10.526) 11.784 9.995 ( -1.237 3.970 2.890) 5.064 10.258 ( -0.644 -9.440 1.737) 9.620 11.353 ( 0.943 -4.661 1.713) 5.055 11.380 ( -1.080 -9.278 -0.220) 9.343 12.424 ( -8.155 0.639 6.175) 10.249 12.868 ( -10.538 -3.468 -10.193) 15.066 13.794 ( 26.642 3.187 2.797) 26.978 14.108 ( 14.090 -0.086 1.092) 14.133 15.584 ( -11.161 0.181 -0.150) 11.163 15.704 ( -1.835 -4.465 1.246) 4.985 16.460 ( 1.971 -3.965 0.053) 4.428 16.689 ( -14.250 -0.472 -6.456) 15.651 20.598 ( -4.740 0.821 0.080) 4.811 20.877 ( 0.357 2.259 -0.124) 2.291 21.653 ( 0.807 0.228 0.382) 0.922 21.983 ( 8.755 -1.428 -0.173) 8.873 24.476 ( -2.068 0.015 4.644) 5.084 25.361 ( 0.663 -0.233 -1.267) 1.449 32.534 ( -0.417 2.258 -0.395) 2.330 32.630 ( 1.569 1.990 -0.206) 2.542 42.129 ( -1.019 2.589 2.011) 3.433 43.493 ( 0.888 10.616 -6.917) 12.702 44.928 ( 3.683 6.800 9.223) 12.036 47.564 ( 2.750 -1.299 -15.821) 16.111 ======================= Grid point 214 (94/355) ======================= q-point: ( 0.42 0.42 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 354 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.335 ( -4.376 -0.000 29.692) 30.013 2.809 ( -2.873 -0.000 -8.089) 8.584 3.396 ( 4.942 0.000 6.738) 8.356 3.812 ( 3.875 0.000 -8.703) 9.527 4.586 ( -21.684 -0.000 -2.646) 21.845 5.007 ( 7.815 0.000 5.638) 9.636 5.221 ( 16.645 0.000 -0.986) 16.674 5.639 ( -2.628 -0.000 7.962) 8.384 5.978 ( -13.634 -0.000 1.130) 13.681 7.751 ( 20.092 0.000 2.758) 20.281 7.922 ( 24.784 0.000 -8.278) 26.129 8.825 ( -10.492 -0.000 -4.811) 11.542 9.821 ( -1.056 -0.000 2.981) 3.162 10.882 ( -11.669 -0.000 9.876) 15.288 11.260 ( -6.824 -0.000 -3.992) 7.906 11.674 ( 3.621 0.000 -4.660) 5.901 12.891 ( -6.706 -0.000 0.113) 6.707 13.334 ( 2.208 0.000 -1.136) 2.483 14.151 ( -5.233 -0.000 0.760) 5.287 14.296 ( 0.092 0.000 -1.006) 1.010 14.426 ( -0.089 -0.000 -1.710) 1.712 14.813 ( -2.901 -0.000 2.594) 3.892 16.177 ( 0.601 0.000 1.018) 1.182 17.134 ( -2.803 -0.000 -8.069) 8.542 20.746 ( 1.975 0.000 -1.079) 2.250 20.951 ( 2.098 0.000 -1.061) 2.351 21.666 ( -0.215 -0.000 0.247) 0.328 21.978 ( 1.024 0.000 -0.209) 1.045 24.458 ( -1.519 -0.000 3.900) 4.186 25.336 ( -0.448 -0.000 -0.922) 1.025 32.539 ( 1.499 0.000 -0.689) 1.650 32.629 ( 1.333 0.000 -0.428) 1.400 42.163 ( 4.296 0.000 6.811) 8.052 44.693 ( 4.028 0.000 -0.566) 4.067 45.239 ( 6.524 0.000 1.326) 6.658 45.781 ( 4.709 0.000 -12.295) 13.166 ======================= Grid point 215 (95/355) ======================= q-point: ( 0.50 0.42 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.480 ( -8.556 -9.390 26.239) 29.152 2.822 ( 4.173 -2.603 0.770) 4.979 3.461 ( -1.792 -1.634 7.026) 7.432 3.864 ( 13.138 1.955 -3.357) 13.700 4.422 ( -13.166 -4.370 -1.512) 13.955 4.830 ( -1.568 20.021 1.784) 20.161 5.447 ( 17.170 -5.431 3.300) 18.308 5.701 ( -14.435 0.983 0.682) 14.484 5.941 ( -2.200 -13.937 4.063) 14.683 7.810 ( 6.690 10.349 -0.607) 12.338 8.085 ( 18.167 3.927 -7.862) 20.181 8.703 ( -8.852 -1.722 -6.216) 10.953 9.833 ( -1.177 -1.155 2.987) 3.412 10.801 ( -9.086 1.570 7.032) 11.596 11.176 ( -2.646 2.081 -4.210) 5.390 11.636 ( 3.801 6.462 -3.143) 8.129 12.823 ( -1.373 1.397 0.284) 1.980 13.430 ( 0.775 -8.146 -0.311) 8.188 14.161 ( -9.897 -8.933 -9.267) 16.237 14.282 ( 5.490 1.350 -0.947) 5.733 14.407 ( 0.265 0.955 4.676) 4.780 14.865 ( -1.902 -5.579 2.459) 6.387 16.033 ( -0.993 15.711 1.871) 15.853 17.186 ( 1.396 -9.166 -6.708) 11.444 20.714 ( 1.261 4.586 -0.569) 4.790 20.970 ( 1.293 -0.530 -1.261) 1.882 21.666 ( 0.005 0.194 0.629) 0.659 21.985 ( 0.376 -0.120 -0.445) 0.595 24.462 ( -1.521 -0.075 4.048) 4.325 25.329 ( -0.089 -0.145 -1.186) 1.198 32.554 ( 1.134 -0.451 -0.402) 1.285 32.640 ( 0.727 -0.320 -0.389) 0.885 42.229 ( 1.963 0.563 9.212) 9.436 44.661 ( 2.658 5.519 1.532) 6.314 45.471 ( 1.778 -19.739 -1.687) 19.891 45.720 ( 6.182 7.803 -9.480) 13.747 ======================= Grid point 216 (96/355) ======================= q-point: (-0.42 -0.58 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.696 ( -10.998 -14.766 18.826) 26.332 2.979 ( 9.051 -5.146 10.211) 14.583 3.498 ( -2.296 -2.000 5.050) 5.897 3.887 ( 9.329 8.895 6.853) 14.599 4.386 ( -3.663 12.395 0.977) 12.962 4.637 ( 6.921 -7.329 2.948) 10.503 5.423 ( -13.931 9.565 -3.192) 17.198 5.715 ( 2.479 -12.121 -3.807) 12.944 6.227 ( -2.719 -15.689 5.647) 16.894 7.569 ( -1.716 17.586 -2.488) 17.844 8.035 ( 5.963 11.573 -5.875) 14.283 8.690 ( -1.676 -6.573 -9.660) 11.804 9.867 ( -1.414 -2.612 3.602) 4.669 10.713 ( -6.379 2.895 4.233) 8.185 11.115 ( 2.732 2.513 -3.530) 5.122 11.517 ( 3.452 10.526 -1.263) 11.149 12.833 ( 2.793 -0.372 1.725) 3.304 13.557 ( -2.843 -6.100 -1.566) 6.910 14.055 ( -10.235 1.940 -5.996) 12.020 14.353 ( 9.735 -0.965 3.840) 10.509 14.594 ( -1.063 -20.214 -6.260) 21.188 14.929 ( 0.668 -1.286 1.610) 2.166 15.740 ( -2.302 16.293 4.100) 16.958 17.326 ( 4.076 -6.093 -6.581) 9.851 20.639 ( 0.082 4.379 0.248) 4.387 20.972 ( -0.104 0.287 -1.524) 1.554 21.669 ( 1.280 0.512 1.438) 1.992 21.982 ( -0.152 0.384 -0.580) 0.712 24.467 ( -1.604 -0.095 4.222) 4.518 25.329 ( 0.318 -0.336 -1.407) 1.481 32.572 ( 0.595 -0.729 -0.009) 0.941 32.650 ( 0.226 -0.534 -0.298) 0.652 42.264 ( -0.347 1.462 10.230) 10.340 44.617 ( -0.748 2.441 3.304) 4.176 45.479 ( -4.738 9.351 -12.799) 16.544 45.937 ( 11.197 -21.497 1.378) 24.278 ======================= Grid point 217 (97/355) ======================= q-point: (-0.33 -0.58 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.899 ( -9.982 -13.410 12.193) 20.691 3.251 ( 7.414 -8.599 14.996) 18.809 3.506 ( 1.287 1.603 2.695) 3.389 3.902 ( 9.900 6.539 10.196) 15.644 4.132 ( 5.241 16.560 14.478) 22.612 5.005 ( 7.542 -21.094 -0.997) 22.424 5.129 ( -14.952 4.166 -5.305) 16.403 5.763 ( -15.785 -1.950 -11.708) 19.750 6.436 ( -4.689 -12.125 5.230) 14.012 7.287 ( 0.805 12.406 -1.150) 12.485 7.855 ( 7.390 12.167 -3.690) 14.706 8.743 ( -1.920 -6.987 -12.888) 14.785 9.921 ( -2.058 -3.553 4.169) 5.852 10.611 ( -3.824 5.143 1.970) 6.705 11.121 ( 5.703 0.695 -1.560) 5.953 11.361 ( 3.220 11.065 0.379) 11.530 12.872 ( 2.937 1.612 4.153) 5.336 13.458 ( -13.695 5.745 -5.916) 15.986 13.974 ( 4.182 2.759 1.121) 5.134 14.553 ( 2.393 -13.773 0.677) 13.996 14.725 ( 2.406 7.894 -5.414) 9.870 15.079 ( 3.527 -19.520 -4.249) 20.286 15.567 ( -2.081 3.206 6.213) 7.294 17.366 ( 2.570 2.151 -7.466) 8.184 20.589 ( -0.987 1.106 1.104) 1.848 20.950 ( -1.290 0.349 -1.662) 2.133 21.689 ( 3.104 0.978 2.390) 4.038 21.963 ( 0.055 1.452 -0.581) 1.565 24.472 ( -1.706 -0.074 4.375) 4.696 25.334 ( 0.629 -0.472 -1.532) 1.722 32.587 ( -0.126 -0.618 0.358) 0.725 32.660 ( -0.020 -0.594 -0.184) 0.622 42.269 ( -1.860 2.184 10.094) 10.494 44.549 ( -7.932 3.783 0.129) 8.789 45.203 ( -2.004 11.150 -7.291) 13.472 46.441 ( 11.510 -23.903 -0.557) 26.536 ======================= Grid point 218 (98/355) ======================= q-point: (-0.25 -0.58 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.063 ( -10.763 -12.497 10.447) 19.524 3.356 ( 2.522 6.671 2.364) 7.513 3.673 ( 9.721 -9.822 10.844) 17.566 3.876 ( 15.032 13.306 14.756) 24.915 4.158 ( 3.180 0.167 19.578) 19.835 4.997 ( -11.831 -8.423 -5.145) 15.407 5.301 ( -11.486 5.916 -10.065) 16.378 5.466 ( -7.566 -9.953 -8.147) 14.922 6.579 ( -14.159 -9.977 4.113) 17.803 7.152 ( 6.874 6.058 -2.450) 9.484 7.823 ( 17.286 5.440 0.592) 18.131 8.753 ( -5.089 -6.072 -15.073) 17.028 9.972 ( -3.077 -3.196 3.781) 5.828 10.477 ( -2.196 8.221 1.089) 8.579 11.167 ( 3.491 0.291 0.195) 3.509 11.253 ( 5.536 5.795 1.316) 8.122 12.846 ( -1.632 6.292 6.914) 9.490 13.136 ( -17.034 8.118 -7.509) 20.309 13.993 ( 13.041 6.687 1.825) 14.768 14.482 ( 7.075 17.353 -3.252) 19.020 14.885 ( -2.630 -21.766 0.255) 21.926 15.413 ( 5.166 -12.564 -5.225) 14.555 15.654 ( -1.223 -13.818 3.964) 14.428 17.232 ( -2.855 8.966 -8.328) 12.566 20.588 ( -1.909 -1.539 1.477) 2.863 20.927 ( -1.499 -0.169 -1.481) 2.114 21.711 ( 2.843 1.689 2.343) 4.053 21.941 ( 2.741 1.961 -0.018) 3.370 24.475 ( -1.792 -0.026 4.480) 4.825 25.342 ( 0.788 -0.495 -1.563) 1.818 32.591 ( -0.841 -0.193 0.516) 1.005 32.667 ( 0.033 -0.310 -0.134) 0.339 42.251 ( -2.367 2.595 9.145) 9.796 44.283 ( -13.864 11.532 -8.175) 19.800 45.066 ( 0.839 3.862 2.605) 4.734 46.929 ( 12.263 -20.356 -2.948) 23.947 ======================= Grid point 219 (99/355) ======================= q-point: (-0.17 -0.58 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.187 ( -8.252 -2.292 1.889) 8.770 3.228 ( 1.014 4.954 9.946) 11.158 3.937 ( 19.082 1.691 7.062) 20.417 4.009 ( 7.353 -4.122 20.301) 21.982 4.284 ( -2.663 -7.432 14.342) 16.372 4.753 ( -20.549 18.698 -10.488) 29.696 5.131 ( -4.518 -16.132 -5.672) 17.687 5.662 ( 0.398 -8.817 -3.324) 9.432 6.436 ( -22.930 2.500 -3.271) 23.296 7.260 ( 15.454 -2.420 2.783) 15.888 7.969 ( 19.111 1.316 2.571) 19.328 8.708 ( -7.715 -4.668 -15.840) 18.226 10.001 ( -3.188 -2.557 2.558) 4.821 10.312 ( -1.973 9.102 1.581) 9.446 11.181 ( 1.987 -0.835 -0.366) 2.186 11.289 ( 5.137 -0.078 2.430) 5.684 12.659 ( -9.508 11.852 5.539) 16.173 12.860 ( -11.836 3.003 -6.432) 13.801 14.032 ( 17.142 7.315 1.813) 18.725 14.311 ( 12.266 12.416 -1.636) 17.530 15.204 ( -5.908 -19.809 0.426) 20.676 15.550 ( 1.758 -4.069 -0.264) 4.441 15.976 ( 2.670 -19.403 -1.172) 19.620 16.962 ( -8.438 11.149 -7.739) 15.981 20.594 ( -3.417 -1.137 1.031) 3.745 20.913 ( -0.803 -0.119 -0.866) 1.187 21.699 ( 0.228 2.189 0.811) 2.345 21.970 ( 6.980 0.713 0.929) 7.078 24.478 ( -1.864 0.037 4.537) 4.905 25.351 ( 0.805 -0.415 -1.523) 1.772 32.581 ( -1.205 0.479 0.258) 1.322 32.669 ( 0.353 0.231 -0.088) 0.432 42.221 ( -2.081 2.830 7.458) 8.244 43.896 ( -11.221 12.568 -9.885) 19.534 45.058 ( 0.038 1.306 6.243) 6.378 47.311 ( 10.841 -13.181 -6.244) 18.173 ======================= Grid point 220 (100/355) ======================= q-point: (-0.08 0.42 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.977 ( 3.840 18.260 4.625) 19.224 3.336 ( -8.623 -9.435 7.372) 14.756 4.051 ( 8.287 11.997 9.555) 17.433 4.211 ( 0.329 -9.167 2.444) 9.493 4.271 ( -3.536 14.412 0.798) 14.861 4.550 ( -2.473 -18.565 12.579) 22.561 5.311 ( -8.515 -12.350 -3.985) 15.521 5.728 ( 2.085 0.146 1.043) 2.336 6.118 ( -17.651 6.182 -7.357) 20.097 7.425 ( 13.775 4.931 4.694) 15.366 8.146 ( 16.925 1.622 2.316) 17.159 8.616 ( -8.774 -3.331 -14.502) 17.274 10.026 ( -1.750 -1.375 2.328) 3.221 10.187 ( -1.491 2.607 1.841) 3.522 11.248 ( 1.236 -5.223 -1.518) 5.577 11.338 ( 0.854 -0.353 2.722) 2.875 12.419 ( -8.448 5.156 -0.516) 9.910 12.711 ( -6.523 1.319 -2.528) 7.119 14.105 ( 14.535 4.632 1.951) 15.380 14.301 ( 16.292 5.407 -0.150) 17.166 15.381 ( -10.991 -9.801 -0.111) 14.727 15.622 ( 0.089 -3.719 0.981) 3.847 16.304 ( 5.133 -15.905 -1.021) 16.744 16.646 ( -11.151 10.918 -4.976) 16.380 20.566 ( -3.654 0.277 0.569) 3.708 20.904 ( 0.101 0.569 -0.124) 0.591 21.669 ( -0.019 1.147 -0.069) 1.150 22.041 ( 6.217 -0.277 -0.192) 6.226 24.478 ( -1.949 0.102 4.547) 4.948 25.357 ( 0.707 -0.294 -1.425) 1.617 32.556 ( -0.761 1.208 -0.274) 1.454 32.665 ( 0.714 0.789 -0.078) 1.067 42.181 ( -1.604 3.204 4.882) 6.056 43.607 ( -2.537 7.798 -7.038) 10.807 45.058 ( -0.636 2.148 6.381) 6.763 47.506 ( 6.690 -3.710 -10.274) 12.809 ======================= Grid point 227 (101/355) ======================= q-point: (-0.50 -0.50 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 355 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.394 ( -15.863 -0.000 25.915) 30.384 2.900 ( 11.581 0.000 7.366) 13.725 3.453 ( -3.846 -0.000 6.332) 7.409 4.056 ( 22.805 0.000 0.524) 22.811 4.280 ( -8.780 -0.000 3.416) 9.421 4.979 ( -6.744 -0.000 -5.398) 8.638 5.469 ( -0.962 -0.000 2.123) 2.331 5.712 ( 0.395 0.000 13.065) 13.071 5.752 ( -2.391 -0.000 -4.499) 5.095 7.904 ( -5.033 -0.000 -3.872) 6.351 8.248 ( 9.212 0.000 -6.278) 11.148 8.568 ( -4.268 -0.000 -8.599) 9.600 9.823 ( -1.340 -0.000 2.810) 3.113 10.757 ( -7.559 -0.000 4.989) 9.057 11.167 ( 1.720 0.000 -4.386) 4.712 11.719 ( 3.748 0.000 -1.833) 4.172 12.827 ( 0.070 0.000 0.605) 0.609 13.361 ( 0.799 0.000 -0.431) 0.908 13.943 ( -6.347 -0.000 -11.343) 12.998 14.234 ( -2.830 -0.000 -6.285) 6.893 14.568 ( 6.842 0.000 9.836) 11.981 14.799 ( -0.587 -0.000 2.774) 2.835 16.187 ( -0.558 -0.000 1.033) 1.174 17.091 ( 4.921 0.000 -5.244) 7.191 20.764 ( 0.653 0.000 -0.783) 1.020 20.965 ( 0.314 0.000 -1.460) 1.493 21.673 ( 0.336 0.000 1.119) 1.169 21.982 ( -0.184 -0.000 -0.777) 0.798 24.465 ( -1.543 -0.000 4.246) 4.518 25.323 ( 0.211 0.000 -1.396) 1.412 32.558 ( 0.642 0.000 -0.145) 0.658 32.640 ( 0.145 0.000 -0.461) 0.484 42.292 ( -0.453 -0.000 12.129) 12.138 44.755 ( 1.509 0.000 1.783) 2.336 45.265 ( -2.988 -0.000 -3.354) 4.492 45.821 ( 8.237 0.000 -7.156) 10.911 ======================= Grid point 228 (102/355) ======================= q-point: (-0.42 -0.50 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.407 ( -20.832 -9.990 22.610) 32.326 3.105 ( 16.431 -1.967 11.950) 20.413 3.448 ( -5.343 -2.250 4.364) 7.257 4.186 ( 3.353 6.484 13.603) 15.438 4.371 ( 19.300 -4.049 -0.333) 19.723 4.822 ( -3.947 4.546 -2.695) 6.596 5.274 ( -17.411 8.345 -0.628) 19.318 5.733 ( 6.760 2.147 -5.302) 8.856 5.960 ( -2.237 -15.249 10.176) 18.468 7.689 ( -15.413 8.468 -6.746) 18.835 8.165 ( -8.237 4.377 -3.679) 10.027 8.580 ( 8.462 -1.665 -12.151) 14.901 9.835 ( -1.387 -1.337 3.406) 3.913 10.701 ( -5.307 1.018 2.362) 5.897 11.175 ( 6.162 1.244 -4.279) 7.605 11.696 ( 3.600 6.324 -0.266) 7.282 12.853 ( 3.564 -1.004 1.961) 4.190 13.419 ( -1.670 -5.650 -1.462) 6.071 13.878 ( -7.340 -3.096 -10.483) 13.166 14.242 ( -1.588 -10.556 -7.425) 13.003 14.606 ( 8.517 6.849 7.812) 13.435 14.887 ( 1.742 -5.687 2.975) 6.651 16.029 ( -0.922 15.957 1.612) 16.065 17.227 ( 7.992 -8.255 -4.843) 12.469 20.718 ( -0.423 4.711 -0.344) 4.743 20.960 ( -0.953 -0.201 -1.751) 2.004 21.690 ( 1.259 -0.568 1.716) 2.203 21.975 ( -0.670 -0.209 -0.985) 1.209 24.470 ( -1.643 -0.030 4.467) 4.759 25.321 ( 0.565 -0.209 -1.598) 1.708 32.565 ( 0.013 -0.456 0.158) 0.483 32.640 ( -0.378 -0.430 -0.517) 0.771 42.327 ( -2.712 1.037 13.663) 13.968 44.699 ( -1.150 6.353 3.214) 7.212 45.307 ( -8.978 -8.644 -8.512) 15.092 45.896 ( 12.579 -3.647 -2.583) 13.349 ======================= Grid point 229 (103/355) ======================= q-point: (-0.33 -0.50 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.505 ( -23.661 -16.509 18.067) 34.041 3.385 ( 18.364 -3.394 12.735) 22.604 3.462 ( -5.289 -3.788 2.220) 6.874 4.182 ( 3.910 5.825 16.825) 18.229 4.506 ( 9.545 8.684 5.344) 13.967 4.880 ( 0.583 -9.467 -4.523) 10.508 4.949 ( -6.805 8.172 4.416) 11.514 5.684 ( -0.416 5.315 -11.301) 12.496 6.175 ( -8.719 -11.737 7.844) 16.592 7.355 ( -16.035 5.873 -7.500) 18.651 8.009 ( -4.651 3.012 -2.115) 5.931 8.608 ( 4.835 -0.551 -14.704) 15.488 9.871 ( -1.566 -2.462 4.273) 5.174 10.637 ( -3.219 2.167 -0.165) 3.884 11.209 ( 9.003 1.904 -3.193) 9.740 11.589 ( 3.494 10.563 1.587) 11.239 12.944 ( 5.717 -1.020 5.409) 7.936 13.389 ( -9.541 3.353 -6.630) 12.092 13.839 ( -5.979 -8.608 -3.673) 11.106 14.500 ( 2.780 -19.034 -6.012) 20.154 14.624 ( 7.894 2.240 1.710) 8.382 14.995 ( 4.497 -1.779 0.658) 4.881 15.750 ( -0.096 15.340 3.458) 15.725 17.382 ( 6.918 -2.026 -5.866) 9.293 20.624 ( -1.904 4.308 0.497) 4.736 20.932 ( -2.082 0.432 -1.947) 2.883 21.733 ( 2.766 -0.666 2.367) 3.701 21.969 ( -0.163 -0.298 -0.897) 0.959 24.474 ( -1.765 -0.028 4.649) 4.973 25.326 ( 0.839 -0.396 -1.726) 1.960 32.573 ( -0.782 -0.693 0.397) 1.118 32.643 ( -0.659 -0.861 -0.471) 1.182 42.330 ( -4.014 1.947 13.765) 14.470 44.568 ( -6.785 7.071 1.881) 9.979 45.201 ( -10.467 1.645 -10.370) 14.826 46.233 ( 15.855 -17.907 0.706) 23.928 ======================= Grid point 230 (104/355) ======================= q-point: (-0.25 -0.50 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.640 ( -23.825 -19.005 14.017) 33.546 3.474 ( -1.158 -0.266 1.961) 2.293 3.689 ( 14.544 -6.248 9.381) 18.401 4.168 ( -5.062 3.717 8.639) 10.680 4.498 ( 14.189 12.780 19.878) 27.564 4.686 ( -15.335 -4.353 0.102) 15.941 5.242 ( 15.474 -10.762 2.226) 18.980 5.402 ( -5.629 16.077 -15.916) 23.312 6.269 ( -16.082 -10.044 6.180) 19.943 7.158 ( -9.232 -2.587 -7.706) 12.300 7.990 ( 4.605 -1.376 -0.200) 4.811 8.565 ( -0.710 -1.019 -16.952) 16.997 9.917 ( -2.024 -2.514 4.608) 5.627 10.556 ( -1.944 4.218 -1.742) 4.960 11.248 ( 7.645 2.699 -1.786) 8.302 11.453 ( 4.209 10.378 3.138) 11.630 12.998 ( 4.068 5.137 7.590) 10.027 13.097 ( -13.981 10.909 -7.000) 19.065 14.008 ( -0.687 -13.542 -0.528) 13.570 14.648 ( 4.847 -0.998 1.262) 5.107 14.745 ( 4.091 -0.227 -5.762) 7.070 15.148 ( 7.305 -16.032 -4.384) 18.155 15.620 ( 2.475 3.630 4.937) 6.609 17.336 ( 1.062 8.766 -7.345) 11.486 20.563 ( -2.562 0.651 1.216) 2.910 20.898 ( -2.049 -0.208 -1.672) 2.653 21.764 ( 1.182 1.125 1.610) 2.292 21.987 ( 3.368 -0.518 0.178) 3.413 24.478 ( -1.871 -0.008 4.758) 5.113 25.335 ( 0.967 -0.488 -1.757) 2.064 32.574 ( -1.528 -0.626 0.466) 1.716 32.651 ( -0.699 -1.099 -0.385) 1.358 42.312 ( -4.221 2.481 12.795) 13.699 44.301 ( -13.794 11.494 -5.163) 18.682 45.061 ( -6.966 -0.465 -3.266) 7.708 46.732 ( 16.993 -20.153 -0.247) 26.362 ======================= Grid point 231 (105/355) ======================= q-point: (-0.17 -0.50 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.795 ( -20.783 -19.456 10.568) 30.367 3.444 ( 0.885 5.951 4.018) 7.235 3.935 ( 4.784 -6.931 1.987) 8.653 4.103 ( -15.697 -7.479 5.336) 18.188 4.470 ( 17.068 16.455 20.096) 31.080 4.819 ( 0.750 -9.118 8.511) 12.495 4.973 ( -2.877 16.537 -16.191) 23.322 5.542 ( 9.373 -8.395 2.705) 12.870 6.215 ( -18.489 -2.117 2.651) 18.798 7.214 ( -0.909 -12.656 -4.454) 13.448 8.114 ( 8.766 -4.246 0.239) 9.743 8.485 ( -4.151 -2.144 -17.939) 18.538 9.951 ( -2.130 -1.833 3.840) 4.758 10.433 ( -2.195 7.293 -1.062) 7.690 11.235 ( 3.759 4.111 -1.158) 5.690 11.392 ( 5.184 4.633 3.193) 7.651 12.719 ( -15.523 10.766 -8.672) 20.787 12.935 ( 2.413 10.842 9.770) 14.793 14.180 ( 3.602 -3.927 1.079) 5.437 14.591 ( 4.889 8.886 -4.732) 11.192 14.886 ( 3.550 -13.316 1.909) 13.913 15.483 ( 5.565 -11.206 -3.116) 12.894 15.725 ( 6.465 -11.243 1.975) 13.119 17.072 ( -5.383 14.471 -7.545) 17.185 20.549 ( -2.748 -0.977 1.212) 3.159 20.887 ( -1.280 -1.117 -1.048) 1.996 21.735 ( -1.075 2.311 0.223) 2.559 22.047 ( 5.961 -0.105 0.866) 6.025 24.481 ( -1.957 0.031 4.778) 5.164 25.344 ( 0.952 -0.462 -1.708) 2.009 32.567 ( -1.784 -0.362 0.280) 1.842 32.661 ( -0.588 -0.994 -0.317) 1.198 42.283 ( -3.678 2.795 10.934) 11.870 43.923 ( -13.746 11.139 -8.585) 19.666 45.032 ( -5.646 -3.073 1.425) 6.584 47.192 ( 15.768 -14.756 -2.756) 21.770 ======================= Grid point 232 (106/355) ======================= q-point: (-0.08 -0.50 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.964 ( -15.113 -17.146 5.711) 23.558 3.326 ( 0.127 11.216 7.046) 13.246 4.012 ( -10.800 -7.430 -1.384) 13.182 4.192 ( -7.614 -11.962 5.508) 15.212 4.462 ( 10.297 12.670 7.461) 17.950 4.577 ( 3.602 17.132 -0.709) 17.521 5.106 ( 3.478 -11.493 4.120) 12.695 5.739 ( 5.921 -3.492 7.175) 9.937 6.056 ( -7.426 4.046 -0.249) 8.461 7.432 ( -1.126 -12.956 -1.506) 13.092 8.255 ( 0.101 -4.711 -5.017) 6.883 8.423 ( 3.938 -2.377 -12.496) 13.315 9.981 ( -1.145 -2.312 2.588) 3.655 10.276 ( -2.418 7.720 1.268) 8.189 11.217 ( 2.551 0.505 -2.516) 3.619 11.386 ( 1.798 2.893 3.102) 4.607 12.376 ( -12.730 7.088 -9.980) 17.661 12.821 ( 3.285 10.042 9.130) 13.964 14.232 ( 1.623 0.587 1.191) 2.097 14.511 ( 4.479 3.817 -2.684) 6.468 15.148 ( 2.644 -10.368 1.797) 10.850 15.597 ( 2.684 -1.478 0.952) 3.209 16.083 ( 9.834 -17.685 -1.156) 20.269 16.732 ( -7.841 13.400 -5.391) 16.435 20.541 ( -2.038 -0.323 1.009) 2.297 20.895 ( -0.583 -1.163 -0.449) 1.376 21.687 ( -0.998 1.660 -0.333) 1.965 22.095 ( 3.672 0.766 -0.391) 3.772 24.482 ( -2.033 0.092 4.706) 5.127 25.353 ( 0.830 -0.345 -1.605) 1.840 32.555 ( -1.193 0.024 -0.131) 1.200 32.668 ( -0.405 -0.610 -0.267) 0.779 42.243 ( -3.074 3.246 8.049) 9.207 43.641 ( -5.982 5.223 -6.622) 10.340 45.039 ( -5.513 -2.956 2.354) 6.683 47.482 ( 11.329 -5.570 -6.094) 14.018 ======================= Grid point 240 (107/355) ======================= q-point: (-0.42 -0.42 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 354 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.191 ( -25.476 -0.000 22.128) 33.744 3.332 ( 19.668 0.000 13.143) 23.655 3.372 ( -8.218 -0.000 3.492) 8.929 4.265 ( -1.372 -0.000 14.148) 14.214 4.608 ( -23.646 -0.000 -10.098) 25.712 4.698 ( 34.808 0.000 7.385) 35.582 5.296 ( -10.616 -0.000 -0.540) 10.630 5.797 ( 7.325 0.000 -6.161) 9.572 5.870 ( 0.895 0.000 16.275) 16.300 7.488 ( -28.716 -0.000 -10.631) 30.621 8.018 ( -18.641 -0.000 -3.299) 18.931 8.652 ( 13.966 0.000 -12.914) 19.022 9.828 ( -1.172 -0.000 3.980) 4.149 10.669 ( -3.658 -0.000 -0.023) 3.658 11.237 ( 9.019 0.000 -5.293) 10.457 11.784 ( 3.145 0.000 0.874) 3.265 12.908 ( 7.029 0.000 1.443) 7.175 13.342 ( -1.534 -0.000 -2.291) 2.757 13.765 ( -1.617 -0.000 -8.920) 9.065 14.088 ( -3.965 -0.000 -9.225) 10.041 14.819 ( 8.283 0.000 10.214) 13.151 14.831 ( 1.122 0.000 1.659) 2.003 16.174 ( -1.508 -0.000 0.709) 1.666 17.231 ( 12.823 0.000 -3.750) 13.360 20.757 ( -0.647 -0.000 -0.608) 0.888 20.936 ( -1.650 -0.000 -1.777) 2.425 21.699 ( 0.800 0.000 1.798) 1.968 21.957 ( -1.257 -0.000 -1.282) 1.796 24.474 ( -1.761 -0.000 4.772) 5.086 25.319 ( 0.857 0.000 -1.803) 1.996 32.559 ( -0.637 -0.000 0.325) 0.715 32.625 ( -1.007 -0.000 -0.797) 1.284 42.366 ( -4.915 -0.000 15.987) 16.725 44.781 ( -1.472 -0.000 3.664) 3.949 45.094 ( -9.042 -0.000 -5.664) 10.670 45.946 ( 9.380 0.000 -5.808) 11.032 ======================= Grid point 241 (108/355) ======================= q-point: (-0.33 -0.42 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.108 ( -27.339 -9.967 19.800) 35.197 3.329 ( -8.221 -3.277 3.495) 9.515 3.591 ( 17.884 -1.148 9.040) 20.072 4.305 ( -2.300 0.388 16.372) 16.537 4.345 ( -28.654 -3.174 -8.514) 30.060 5.050 ( 31.347 3.536 8.599) 32.697 5.147 ( -3.421 5.051 5.081) 7.939 5.751 ( 5.113 7.048 -7.250) 11.331 6.021 ( -2.868 -4.805 11.892) 13.143 7.103 ( -32.439 0.107 -12.247) 34.674 7.856 ( -15.549 -4.366 -2.271) 16.309 8.678 ( 10.651 4.441 -14.627) 18.631 9.848 ( -1.009 -1.269 4.924) 5.184 10.629 ( -1.968 0.819 -2.443) 3.242 11.311 ( 11.068 0.361 -5.948) 12.570 11.771 ( 2.893 5.836 2.628) 7.024 13.010 ( 9.438 -1.855 3.922) 10.388 13.322 ( -4.200 0.516 -6.158) 7.471 13.704 ( -3.439 0.703 -4.779) 5.930 14.151 ( 0.429 -16.368 -8.420) 18.412 14.792 ( 3.898 4.985 2.825) 6.931 15.000 ( 5.934 -4.289 5.451) 9.128 16.024 ( -0.985 14.241 1.013) 14.311 17.402 ( 13.142 -3.751 -4.251) 14.313 20.692 ( -1.781 5.417 -0.185) 5.706 20.905 ( -2.552 0.254 -2.002) 3.253 21.740 ( 1.741 -2.261 2.143) 3.569 21.944 ( -1.146 -1.003 -1.342) 2.030 24.478 ( -1.903 0.011 5.067) 5.413 25.322 ( 1.084 -0.221 -1.949) 2.242 32.554 ( -1.410 -0.384 0.422) 1.521 32.615 ( -1.399 -0.741 -0.952) 1.847 42.376 ( -6.116 1.114 16.716) 17.835 44.669 ( -5.133 10.030 3.553) 11.814 45.017 ( -11.948 -3.229 -8.298) 14.901 46.121 ( 12.699 -12.560 -3.647) 18.230 ======================= Grid point 242 (109/355) ======================= q-point: (-0.25 -0.42 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.150 ( -26.653 -16.884 16.483) 35.597 3.361 ( -5.833 -7.093 3.501) 9.828 3.758 ( 0.242 -3.179 -2.806) 4.247 4.047 ( -22.080 1.338 -0.995) 22.143 4.412 ( -3.260 -7.534 16.819) 18.716 5.073 ( 10.255 13.772 16.621) 23.898 5.319 ( 13.609 -3.798 1.570) 14.216 5.603 ( 7.928 13.799 -11.229) 19.477 6.063 ( -7.192 -2.690 11.825) 14.099 6.813 ( -26.935 -8.838 -11.739) 30.682 7.855 ( -7.253 -9.483 -1.059) 11.985 8.593 ( 7.366 7.026 -16.639) 19.506 9.890 ( -1.039 -1.811 5.625) 6.000 10.577 ( -0.723 1.990 -4.403) 4.885 11.371 ( 10.159 2.661 -5.731) 11.964 11.683 ( 3.117 9.758 4.669) 11.257 13.088 ( -6.998 9.610 -6.914) 13.752 13.206 ( 8.373 1.376 6.776) 10.859 13.723 ( -3.688 -11.590 -1.429) 12.247 14.502 ( 4.033 -23.020 -6.443) 24.242 14.754 ( 2.629 4.516 1.045) 5.329 15.117 ( 7.488 -0.505 -0.123) 7.506 15.795 ( 1.491 11.246 2.732) 11.668 17.475 ( 7.233 6.420 -5.911) 11.335 20.580 ( -2.652 4.207 0.697) 5.021 20.865 ( -2.608 0.018 -1.838) 3.191 21.787 ( 0.175 0.085 1.132) 1.149 21.982 ( 2.498 -3.689 -0.217) 4.460 24.482 ( -2.029 0.048 5.273) 5.650 25.329 ( 1.179 -0.381 -1.992) 2.346 32.547 ( -2.115 -0.631 0.382) 2.240 32.614 ( -1.546 -1.445 -0.936) 2.314 42.363 ( -6.156 1.897 15.990) 17.239 44.369 ( -12.964 15.362 -2.722) 20.284 44.908 ( -11.120 -3.535 -5.658) 12.968 46.564 ( 17.551 -21.259 -1.516) 27.610 ======================= Grid point 243 (110/355) ======================= q-point: (-0.17 -0.42 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.283 ( -23.544 -20.793 13.248) 34.091 3.457 ( -2.527 -5.194 4.886) 7.565 3.640 ( -27.802 -10.247 -5.934) 30.219 3.980 ( -0.706 -1.416 -0.607) 1.695 4.618 ( -3.738 -13.138 10.281) 17.096 5.002 ( 10.090 16.604 19.109) 27.252 5.289 ( 9.146 20.501 -13.670) 26.283 5.555 ( 4.467 -7.147 6.049) 10.374 6.131 ( 3.156 0.108 12.868) 13.250 6.766 ( -21.275 -20.462 -10.594) 31.362 7.974 ( -3.696 -10.413 -2.681) 11.371 8.474 ( 7.290 5.481 -16.366) 18.736 9.931 ( -1.330 -1.287 5.392) 5.701 10.499 ( -0.756 4.236 -4.553) 6.265 11.359 ( 6.117 5.610 -4.659) 9.518 11.576 ( 3.940 9.211 5.266) 11.317 12.737 ( -11.722 13.294 -9.299) 20.015 13.221 ( 5.265 10.870 10.492) 15.998 13.992 ( 0.225 -17.503 0.833) 17.524 14.674 ( -2.459 4.576 -4.560) 6.912 14.817 ( 7.108 -8.742 1.257) 11.337 15.282 ( 9.565 -13.399 -4.245) 17.002 15.757 ( 7.100 0.509 3.716) 8.030 17.269 ( -1.120 16.855 -6.961) 18.270 20.526 ( -1.722 0.409 1.317) 2.206 20.845 ( -1.934 -1.225 -1.302) 2.634 21.757 ( -1.787 2.011 -0.071) 2.691 22.082 ( 4.416 -2.592 0.183) 5.124 24.484 ( -2.135 0.093 5.312) 5.726 25.339 ( 1.139 -0.431 -1.930) 2.282 32.538 ( -2.317 -0.808 0.238) 2.465 32.623 ( -1.524 -1.838 -0.861) 2.538 42.338 ( -5.479 2.404 14.038) 15.260 43.936 ( -16.181 13.398 -7.573) 22.331 44.873 ( -9.511 -6.054 -1.751) 11.409 47.086 ( 19.079 -18.212 -2.239) 26.471 ======================= Grid point 244 (111/355) ======================= q-point: (-0.08 -0.42 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.489 ( -18.867 -22.165 9.994) 30.776 3.465 ( -4.968 1.980 4.800) 7.186 3.648 ( -15.148 -16.760 0.494) 22.597 3.973 ( -7.826 -4.568 -5.195) 10.445 4.795 ( -4.753 0.101 -4.326) 6.428 4.888 ( 6.418 18.279 12.524) 23.069 5.020 ( 8.613 3.379 1.836) 9.433 5.799 ( 9.117 -7.983 12.115) 17.135 6.183 ( 11.913 9.275 9.057) 17.606 6.947 ( -20.482 -28.738 -7.138) 36.004 8.031 ( -8.061 -5.577 -10.810) 14.593 8.470 ( 12.679 -1.343 -9.235) 15.743 9.957 ( -1.244 -1.063 4.009) 4.330 10.379 ( -1.574 6.650 -1.732) 7.050 11.287 ( 3.764 5.449 -4.015) 7.745 11.504 ( 2.832 6.656 4.076) 8.303 12.366 ( -10.339 11.535 -9.883) 18.374 13.107 ( 4.052 12.213 9.909) 16.241 14.165 ( -5.862 -5.679 0.899) 8.211 14.511 ( -8.707 4.043 -4.154) 10.460 15.096 ( 14.272 -9.868 2.782) 17.573 15.570 ( 4.811 -8.879 -1.050) 10.153 15.961 ( 15.282 -10.778 1.527) 18.763 16.900 ( -4.849 17.828 -5.922) 19.401 20.527 ( -0.123 -0.565 1.437) 1.549 20.854 ( -1.186 -2.161 -0.740) 2.573 21.702 ( -1.797 1.953 -0.429) 2.688 22.128 ( 1.123 0.477 -1.164) 1.686 24.485 ( -2.222 0.135 5.146) 5.607 25.348 ( 0.998 -0.366 -1.798) 2.089 32.533 ( -1.626 -0.937 -0.018) 1.877 32.636 ( -1.388 -1.824 -0.733) 2.406 42.299 ( -4.961 3.023 10.702) 12.177 43.609 ( -9.981 4.416 -6.281) 12.593 44.884 ( -9.037 -6.650 -0.823) 11.250 47.477 ( 15.609 -8.704 -4.646) 18.465 ======================= Grid point 253 (112/355) ======================= q-point: (-0.33 -0.33 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 355 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.831 ( -29.061 -0.000 20.185) 35.384 3.246 ( -7.200 -0.000 5.743) 9.210 3.696 ( -6.588 -0.000 -8.418) 10.689 4.010 ( -14.220 -0.000 1.862) 14.342 4.398 ( -1.021 -0.000 16.714) 16.745 5.079 ( -11.055 -0.000 4.476) 11.927 5.375 ( 11.664 0.000 8.066) 14.182 5.899 ( 8.398 0.000 -8.030) 11.619 6.048 ( 5.117 0.000 17.122) 17.870 6.704 ( -29.881 -0.000 -12.546) 32.408 7.641 ( -14.087 -0.000 -1.038) 14.125 8.752 ( 8.734 0.000 -15.604) 17.882 9.852 ( -0.905 -0.000 5.904) 5.973 10.607 ( -0.462 -0.000 -4.421) 4.445 11.390 ( 11.738 0.000 -8.701) 14.611 11.862 ( 2.506 0.000 4.174) 4.868 13.116 ( 11.267 0.000 2.054) 11.452 13.277 ( -0.660 -0.000 -5.496) 5.535 13.701 ( -0.019 -0.000 -3.219) 3.219 13.935 ( -1.943 -0.000 -9.474) 9.671 14.854 ( -0.227 -0.000 0.791) 0.823 15.064 ( 7.094 0.000 9.080) 11.523 16.139 ( -2.455 -0.000 0.098) 2.457 17.508 ( 17.628 0.000 -4.093) 18.097 20.731 ( -1.254 -0.000 -0.572) 1.378 20.871 ( -2.928 -0.000 -2.041) 3.570 21.736 ( 1.028 0.000 2.134) 2.369 21.910 ( -2.005 -0.000 -1.646) 2.594 24.483 ( -2.057 -0.000 5.602) 5.968 25.322 ( 1.276 0.000 -2.130) 2.483 32.536 ( -2.109 -0.000 0.427) 2.152 32.586 ( -1.875 -0.000 -1.395) 2.337 42.398 ( -7.356 -0.000 18.161) 19.595 44.763 ( -4.078 -0.000 4.572) 6.126 44.826 ( -11.985 -0.000 -5.821) 13.324 46.068 ( 9.205 0.000 -8.805) 12.738 ======================= Grid point 254 (113/355) ======================= q-point: (-0.25 -0.33 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.721 ( -28.438 -10.423 18.793) 35.645 3.233 ( -5.384 -2.989 6.342) 8.840 3.422 ( -34.624 -4.192 -14.243) 37.673 3.990 ( -1.771 0.690 -0.733) 2.037 4.424 ( -3.544 1.678 17.368) 17.805 5.134 ( -3.027 -10.675 12.745) 16.898 5.322 ( -23.291 -2.984 0.829) 23.496 5.855 ( 8.040 9.168 -9.616) 15.529 6.106 ( -7.383 5.134 9.326) 12.955 6.518 ( 6.848 1.731 -1.027) 7.138 7.623 ( -4.866 -8.781 1.109) 10.101 8.702 ( 6.333 5.387 -17.320) 19.212 9.884 ( -0.904 -1.184 6.682) 6.846 10.578 ( 0.840 1.003 -6.023) 6.163 11.467 ( 11.238 0.150 -10.307) 15.250 11.865 ( 2.572 5.355 6.288) 8.651 13.164 ( -3.133 9.506 -8.804) 13.330 13.286 ( 12.175 -6.067 4.816) 14.430 13.621 ( -3.196 3.100 -0.307) 4.463 14.123 ( 3.898 -21.841 -6.583) 23.142 14.828 ( -0.851 2.458 0.783) 2.717 15.188 ( 6.914 -1.455 5.381) 8.881 16.001 ( -2.087 11.293 0.221) 11.487 17.642 ( 14.411 3.797 -5.543) 15.900 20.652 ( -1.878 6.228 -0.041) 6.505 20.830 ( -2.984 0.080 -1.999) 3.593 21.782 ( 0.252 -1.501 1.353) 2.037 21.917 ( -0.023 -4.609 -1.114) 4.742 24.488 ( -2.185 0.102 6.144) 6.522 25.327 ( 1.355 -0.202 -2.201) 2.593 32.516 ( -2.710 -0.363 0.316) 2.753 32.568 ( -2.061 -1.067 -1.568) 2.801 42.397 ( -7.486 0.986 17.881) 19.410 44.542 ( -10.118 19.380 -0.075) 21.863 44.704 ( -12.118 -3.079 -5.038) 13.481 46.333 ( 13.784 -22.247 -7.987) 27.363 ======================= Grid point 255 (114/355) ======================= q-point: (-0.17 -0.33 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.776 ( -25.128 -18.263 16.075) 34.976 3.095 ( -37.320 -10.281 -9.442) 39.845 3.335 ( -1.001 -8.780 6.646) 11.057 3.911 ( -8.740 -0.241 -6.440) 10.859 4.466 ( -6.536 -4.181 12.497) 14.710 5.179 ( -24.135 -9.617 0.881) 25.996 5.416 ( 0.855 -12.651 18.110) 22.108 5.668 ( 10.450 16.640 -11.986) 23.017 5.950 ( -22.730 -7.404 2.008) 23.990 6.631 ( 23.956 9.255 6.202) 26.420 7.783 ( 1.570 -9.386 1.361) 9.614 8.572 ( 5.802 6.450 -17.843) 19.840 9.925 ( -1.308 -1.174 6.669) 6.897 10.530 ( 1.202 2.588 -6.600) 7.190 11.485 ( 8.289 4.242 -9.424) 13.248 11.800 ( 3.008 9.150 7.185) 12.017 12.846 ( -6.618 15.656 -9.630) 19.536 13.442 ( 0.777 6.196 6.894) 9.302 13.726 ( 6.418 -17.163 2.848) 18.544 14.518 ( 0.480 -18.444 -5.362) 19.213 14.801 ( 4.359 -0.511 2.570) 5.085 15.271 ( 8.179 0.783 -1.651) 8.381 15.845 ( 1.011 3.546 2.218) 4.303 17.540 ( 4.785 16.622 -6.934) 18.636 20.549 ( -0.862 3.384 1.133) 3.671 20.799 ( -2.381 -0.807 -1.550) 2.954 21.767 ( -2.022 1.466 -0.206) 2.506 22.042 ( 2.714 -6.353 -0.746) 6.949 24.491 ( -2.312 0.282 6.426) 6.835 25.335 ( 1.313 -0.327 -2.138) 2.530 32.499 ( -2.811 -0.845 0.168) 2.940 32.566 ( -2.048 -1.963 -1.523) 3.220 42.381 ( -6.887 1.756 16.027) 17.532 44.009 ( -18.085 20.998 -7.196) 28.632 44.651 ( -11.089 -6.145 -2.614) 12.945 46.906 ( 20.460 -25.836 -6.559) 33.602 ======================= Grid point 256 (115/355) ======================= q-point: (-0.08 -0.33 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.967 ( -19.918 -22.813 13.272) 33.065 3.032 ( -24.554 -23.532 -1.251) 34.033 3.504 ( -1.505 -4.940 4.814) 7.060 3.795 ( -10.061 -2.987 -7.039) 12.637 4.564 ( -6.259 -12.043 1.287) 13.633 5.122 ( -10.787 1.442 11.108) 15.551 5.374 ( 4.833 16.978 -3.438) 17.984 5.756 ( 9.063 -10.191 8.873) 16.270 6.035 ( -28.098 -32.717 0.071) 43.127 6.687 ( 22.744 15.653 5.568) 28.165 7.902 ( 1.449 -1.138 -3.238) 3.726 8.504 ( 8.192 -0.930 -13.879) 16.143 9.951 ( -1.828 -0.492 5.358) 5.683 10.451 ( 0.333 4.684 -4.374) 6.417 11.416 ( 5.464 6.909 -6.990) 11.245 11.698 ( 3.127 9.881 5.809) 11.881 12.468 ( -6.310 15.539 -9.052) 19.058 13.335 ( -1.329 7.686 6.598) 10.217 14.003 ( -3.323 -7.569 3.042) 8.809 14.475 ( -12.406 6.202 -6.160) 15.176 15.084 ( 16.048 -12.015 4.748) 20.602 15.433 ( 8.531 -11.186 -1.935) 14.200 15.959 ( 10.201 -8.573 2.235) 13.512 17.182 ( -0.638 21.944 -6.009) 22.760 20.536 ( 1.565 -0.022 1.719) 2.324 20.799 ( -1.418 -2.205 -0.890) 2.768 21.712 ( -2.237 1.959 -0.505) 3.016 22.114 ( -1.167 -1.395 -2.427) 3.033 24.491 ( -2.463 0.400 6.168) 6.654 25.344 ( 1.170 -0.335 -1.974) 2.319 32.494 ( -1.987 -1.470 0.040) 2.472 32.577 ( -1.874 -2.451 -1.328) 3.359 42.342 ( -6.664 2.796 12.301) 14.267 43.547 ( -15.325 7.439 -6.921) 18.387 44.652 ( -10.520 -7.875 -2.217) 13.327 47.436 ( 20.018 -15.089 -7.622) 26.201 ======================= Grid point 266 (116/355) ======================= q-point: (-0.25 -0.25 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 354 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.431 ( -29.090 -0.000 20.321) 35.485 2.920 ( -40.888 -0.000 -15.573) 43.753 3.232 ( -1.121 -0.000 10.721) 10.779 3.911 ( -11.922 -0.000 -7.719) 14.203 4.483 ( -6.450 -0.000 15.084) 16.405 4.768 ( -59.205 -0.000 -9.566) 59.973 5.050 ( -4.679 -0.000 17.742) 18.349 5.956 ( 8.375 0.000 -11.193) 13.980 6.134 ( -9.482 -0.000 9.058) 13.113 6.829 ( 32.831 0.000 8.608) 33.940 7.546 ( 3.848 0.000 4.565) 5.970 8.712 ( 3.493 0.000 -19.374) 19.686 9.896 ( -1.039 -0.000 7.459) 7.531 10.573 ( 2.065 0.000 -6.115) 6.454 11.518 ( 11.037 0.000 -13.820) 17.686 11.969 ( 2.594 0.000 8.327) 8.722 13.233 ( 1.646 0.000 -5.882) 6.108 13.331 ( 7.572 0.000 -0.168) 7.574 13.679 ( -1.535 -0.000 0.891) 1.775 13.881 ( 4.267 0.000 -5.266) 6.778 14.832 ( -2.497 -0.000 0.811) 2.625 15.261 ( 5.103 0.000 7.126) 8.765 16.075 ( -3.685 -0.000 -0.751) 3.760 17.819 ( 17.842 0.000 -7.638) 19.409 20.703 ( -0.930 -0.000 -0.635) 1.126 20.790 ( -3.003 -0.000 -2.083) 3.655 21.775 ( 0.944 0.000 2.026) 2.235 21.850 ( -2.292 -0.000 -1.956) 3.013 24.498 ( -2.232 -0.000 7.451) 7.778 25.329 ( 1.442 0.000 -2.306) 2.720 32.484 ( -3.217 -0.000 0.248) 3.227 32.529 ( -2.151 -0.000 -2.006) 2.942 42.411 ( -7.938 -0.000 17.982) 19.656 44.530 ( -12.267 -0.000 -4.981) 13.240 44.706 ( -5.584 -0.000 4.327) 7.065 46.129 ( 8.549 0.000 -18.903) 20.747 ======================= Grid point 267 (117/355) ======================= q-point: (-0.17 -0.25 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.341 ( -26.783 -11.763 19.539) 35.178 2.486 ( -42.805 -7.537 -12.324) 45.177 3.285 ( 0.821 -0.773 10.694) 10.753 3.729 ( -17.043 -1.887 -7.978) 18.913 4.290 ( -62.318 -25.659 -12.249) 68.498 4.450 ( -8.469 1.222 13.278) 15.797 5.174 ( -11.469 -12.278 13.901) 21.806 5.939 ( 6.165 10.150 -1.217) 11.938 5.995 ( 1.045 8.436 2.636) 8.900 7.121 ( 30.668 8.773 8.089) 32.908 7.719 ( 9.996 -7.238 6.480) 13.939 8.613 ( 2.199 3.667 -20.559) 20.999 9.927 ( -1.459 -0.794 7.359) 7.544 10.557 ( 2.531 1.770 -5.229) 6.073 11.561 ( 9.661 0.369 -14.247) 17.218 11.991 ( 2.702 5.466 9.356) 11.168 13.032 ( -1.622 16.364 -8.332) 18.434 13.517 ( 0.714 -1.800 3.471) 3.975 13.599 ( 5.676 -5.488 2.402) 8.253 14.165 ( 2.726 -21.036 -2.698) 21.383 14.822 ( 0.799 -1.739 1.718) 2.572 15.358 ( 6.245 -1.222 3.107) 7.082 15.936 ( -4.447 8.673 -0.417) 9.756 17.834 ( 11.096 12.829 -10.672) 20.040 20.627 ( -0.556 5.746 0.296) 5.781 20.757 ( -2.405 -0.447 -1.705) 2.982 21.767 ( -1.826 1.319 -0.217) 2.263 21.924 ( 1.054 -8.827 -1.148) 8.964 24.510 ( -2.223 0.553 8.770) 9.064 25.335 ( 1.426 -0.173 -2.257) 2.676 32.457 ( -3.217 -0.591 0.125) 3.273 32.509 ( -2.013 -1.255 -2.064) 3.145 42.405 ( -7.663 0.850 16.348) 18.075 44.243 ( -15.975 30.307 -7.122) 34.992 44.454 ( -11.404 -0.652 -1.252) 11.491 46.521 ( 17.600 -36.958 -19.856) 45.496 ======================= Grid point 268 (118/355) ======================= q-point: (-0.08 -0.25 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.467 ( -20.640 -20.843 17.438) 34.125 2.325 ( -31.182 -25.628 -3.760) 40.537 3.382 ( -7.181 -5.874 2.586) 9.631 3.616 ( -5.784 -5.555 -1.672) 8.192 4.229 ( -35.641 -27.972 -7.428) 45.911 4.532 ( -18.801 -24.964 6.393) 31.899 5.261 ( -18.587 -9.372 5.483) 21.526 5.741 ( -7.265 10.627 11.504) 17.265 6.005 ( 21.246 6.863 -1.480) 22.376 7.219 ( 23.653 15.154 5.561) 28.636 7.966 ( 12.120 -2.467 6.884) 14.156 8.478 ( 1.954 1.578 -20.227) 20.382 9.950 ( -2.222 -0.354 6.048) 6.453 10.514 ( 2.062 3.858 -3.024) 5.318 11.544 ( 7.482 4.886 -11.070) 14.227 11.929 ( 2.989 9.740 7.898) 12.891 12.668 ( -2.815 18.304 -8.179) 20.245 13.420 ( -3.955 4.761 4.034) 7.388 13.889 ( 2.075 -7.853 4.560) 9.315 14.352 ( -11.578 -4.359 -5.149) 13.400 15.043 ( 12.624 -13.316 4.098) 18.801 15.434 ( 11.532 0.227 -0.826) 11.564 15.875 ( 0.509 -8.083 2.108) 8.369 17.532 ( 2.080 21.995 -9.734) 24.143 20.574 ( 2.084 1.479 1.562) 2.995 20.749 ( -1.190 -1.711 -0.929) 2.282 21.718 ( -2.378 1.738 -0.683) 3.024 22.034 ( -2.385 -4.206 -3.614) 6.037 24.511 ( -2.592 1.259 8.722) 9.185 25.342 ( 1.312 -0.248 -2.071) 2.464 32.447 ( -2.192 -1.570 0.061) 2.697 32.511 ( -1.723 -2.243 -1.836) 3.372 42.372 ( -7.702 2.400 12.671) 15.021 43.519 ( -23.200 18.291 -10.009) 31.193 44.413 ( -10.227 -6.628 -2.181) 12.380 47.255 ( 25.749 -28.920 -18.943) 43.107 ======================= Grid point 279 (119/355) ======================= q-point: (-0.17 -0.17 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 355 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.059 ( -27.324 -0.000 22.225) 35.222 1.913 ( -46.084 -0.000 -12.861) 47.845 3.247 ( -75.214 -0.000 -11.828) 76.138 3.408 ( 4.454 0.000 14.736) 15.394 3.457 ( -22.796 -0.000 -7.324) 23.944 4.438 ( -11.863 -0.000 12.824) 17.470 4.987 ( -13.667 -0.000 8.179) 15.927 6.033 ( -9.630 -0.000 10.501) 14.248 6.161 ( 18.724 0.000 -4.914) 19.358 7.533 ( 27.278 0.000 5.821) 27.892 7.806 ( 13.493 0.000 7.392) 15.385 8.554 ( 0.479 0.000 -21.666) 21.672 9.939 ( -1.661 -0.000 7.151) 7.341 10.594 ( 3.145 0.000 2.041) 3.749 11.577 ( 9.436 0.000 -17.151) 19.575 12.112 ( 2.254 0.000 11.420) 11.640 13.241 ( 3.603 0.000 -3.361) 4.927 13.413 ( 3.728 0.000 -2.553) 4.519 13.653 ( -3.162 -0.000 4.412) 5.428 13.966 ( 3.868 0.000 -0.680) 3.927 14.800 ( -0.696 -0.000 1.627) 1.770 15.396 ( 2.944 0.000 4.525) 5.399 15.979 ( -4.698 -0.000 -1.506) 4.934 18.017 ( 12.441 0.000 -20.970) 24.382 20.686 ( -0.112 -0.000 -0.584) 0.595 20.721 ( -1.995 -0.000 -1.705) 2.624 21.785 ( -2.148 -0.000 -2.665) 3.423 21.807 ( 0.539 0.000 1.463) 1.559 24.549 ( -1.128 -0.000 13.109) 13.157 25.337 ( 1.454 0.000 -2.225) 2.658 32.419 ( -3.288 -0.000 0.093) 3.289 32.470 ( -1.615 -0.000 -2.230) 2.754 42.405 ( -7.940 -0.000 14.853) 16.842 44.267 ( -9.665 -0.000 -3.482) 10.273 44.626 ( -5.614 -0.000 3.030) 6.379 45.966 ( 2.325 0.000 -52.356) 52.408 ======================= Grid point 280 (120/355) ======================= q-point: (-0.08 -0.17 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.034 ( -22.057 -15.616 21.561) 34.572 1.555 ( -39.749 -20.147 -4.370) 44.777 2.850 ( -65.901 -44.982 -11.050) 80.550 3.209 ( -19.216 -2.898 -2.431) 19.584 3.554 ( 5.454 -1.935 11.169) 12.579 4.372 ( -9.701 -0.357 14.285) 17.272 4.959 ( -14.679 -8.267 4.619) 17.468 5.896 ( -8.514 9.336 11.236) 16.909 6.294 ( 18.152 4.201 -2.638) 18.817 7.683 ( 19.018 11.244 3.064) 22.305 8.044 ( 12.859 -7.893 5.570) 16.084 8.440 ( 1.233 3.690 -19.539) 19.923 9.952 ( -2.292 -0.066 5.975) 6.400 10.624 ( 4.619 5.205 10.825) 12.869 11.607 ( 9.075 -0.356 -14.980) 17.518 12.136 ( 2.466 5.881 10.974) 12.692 12.950 ( -0.555 21.789 -5.406) 22.456 13.492 ( -2.963 5.077 4.056) 7.142 13.799 ( 8.327 -12.769 4.934) 16.023 14.098 ( -7.571 -9.901 -2.016) 12.626 14.932 ( 7.113 -12.600 2.794) 14.736 15.521 ( 9.536 -8.023 1.446) 12.546 15.815 ( -7.224 7.935 -0.244) 10.734 17.805 ( -0.416 16.519 -27.690) 32.245 20.637 ( 1.001 3.289 0.746) 3.518 20.711 ( -0.767 -1.206 -0.826) 1.651 21.719 ( -2.348 1.861 -1.360) 3.291 21.905 ( -1.658 -6.215 -3.249) 7.206 24.583 ( -0.861 3.856 15.837) 16.322 25.343 ( 1.394 -0.131 -2.028) 2.465 32.401 ( -2.161 -1.344 0.048) 2.546 32.457 ( -1.103 -1.276 -1.934) 2.566 42.381 ( -8.014 1.168 11.668) 14.203 43.684 ( -34.050 47.531 -18.803) 61.418 44.223 ( -8.964 -3.060 -1.679) 9.620 46.642 ( 26.282 -65.644 -52.640) 88.152 ======================= Grid point 292 (121/355) ======================= q-point: (-0.08 -0.08 0.11) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 354 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.740 ( -26.391 -0.000 18.447) 32.199 0.900 ( -45.168 -0.000 -1.823) 45.205 1.593 ( -77.669 -0.000 2.236) 77.701 2.983 ( -17.587 -0.000 -2.097) 17.712 3.714 ( 7.136 0.000 10.617) 12.792 4.415 ( 2.530 0.000 29.435) 29.544 4.781 ( -9.304 -0.000 1.895) 9.495 5.950 ( -8.448 -0.000 11.188) 14.019 6.474 ( 13.182 0.000 -2.942) 13.506 7.943 ( 11.031 0.000 0.009) 11.031 8.034 ( 4.161 0.000 -10.111) 10.933 8.462 ( 8.099 0.000 -4.210) 9.128 9.957 ( -2.349 -0.000 5.757) 6.218 11.021 ( 35.186 0.000 60.826) 70.270 11.591 ( 8.396 0.000 -18.134) 19.984 12.253 ( -0.156 -0.000 13.908) 13.909 13.318 ( 4.714 0.000 1.053) 4.830 13.485 ( 5.636 0.000 -1.849) 5.932 13.710 ( 6.253 0.000 17.589) 18.667 13.945 ( -4.725 -0.000 -0.532) 4.755 14.852 ( 2.833 0.000 2.581) 3.833 15.457 ( 0.335 0.000 1.271) 1.315 15.876 ( -3.471 -0.000 -1.694) 3.862 17.588 ( -34.300 -0.000 -78.848) 85.985 20.684 ( -0.503 -0.000 -0.915) 1.044 20.688 ( 0.475 0.000 0.271) 0.547 21.705 ( -3.214 -0.000 -4.146) 5.245 21.821 ( -0.101 -0.000 0.570) 0.579 24.808 ( 13.533 0.000 28.491) 31.542 25.347 ( 1.385 0.000 -1.834) 2.298 32.364 ( -2.038 -0.000 0.154) 2.044 32.433 ( -0.165 -0.000 -1.122) 1.134 42.356 ( -8.204 -0.000 9.031) 12.201 44.092 ( -5.741 -0.000 -5.006) 7.617 44.545 ( -4.188 -0.000 1.002) 4.306 44.593 ( -79.824 -0.000 -150.930) 170.739 ======================= Grid point 293 (122/355) ======================= q-point: ( 0.00 0.00 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 355 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.142 ( 30.925 0.000 27.969) 41.696 1.299 ( 19.846 0.000 30.833) 36.668 1.860 ( -1.114 -0.000 43.092) 43.107 2.835 ( 4.017 0.000 -0.175) 4.021 3.660 ( -10.099 -0.000 -7.098) 12.344 4.622 ( -7.935 -0.000 -5.274) 9.528 4.717 ( -15.084 -0.000 10.347) 18.291 6.228 ( -10.845 -0.000 19.032) 21.905 6.420 ( 1.444 0.000 -9.216) 9.328 7.446 ( 4.443 0.000 -19.921) 20.410 8.036 ( -5.430 -0.000 -4.031) 6.763 8.808 ( 13.853 0.000 -0.832) 13.878 10.070 ( -6.469 -0.000 7.547) 9.940 11.233 ( 9.719 0.000 -17.478) 19.998 12.644 ( -6.866 -0.000 14.913) 16.418 12.990 ( 18.654 0.000 2.665) 18.843 13.388 ( -0.641 -0.000 0.633) 0.901 13.478 ( -0.106 -0.000 -4.299) 4.301 13.917 ( 6.683 0.000 1.498) 6.849 14.074 ( -82.587 -0.000 -2.538) 82.626 14.946 ( -4.992 -0.000 4.018) 6.408 15.448 ( -6.824 -0.000 -0.416) 6.837 15.813 ( 2.595 0.000 -1.739) 3.123 15.904 ( 84.598 0.000 -5.082) 84.750 20.685 ( 1.691 0.000 0.002) 1.691 20.689 ( -1.744 -0.000 -0.145) 1.750 21.675 ( 2.360 0.000 0.982) 2.556 21.800 ( -1.453 -0.000 -0.807) 1.662 25.054 ( -16.201 -0.000 1.742) 16.294 25.325 ( 2.513 0.000 -2.192) 3.335 32.356 ( 0.106 0.000 0.623) 0.632 32.428 ( -0.526 -0.000 -0.498) 0.725 42.296 ( -15.893 -0.000 3.516) 16.277 42.800 ( 73.528 0.000 -3.963) 73.635 44.113 ( 3.318 0.000 2.551) 4.185 44.448 ( -3.167 -0.000 -2.362) 3.951 ======================= Grid point 294 (123/355) ======================= q-point: ( 0.08 0.00 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.602 ( 25.734 -14.664 22.685) 37.308 1.657 ( -0.681 -4.348 32.321) 32.619 2.787 ( 38.419 -48.467 25.471) 66.887 2.957 ( 12.214 -6.041 2.083) 13.785 3.654 ( -5.936 -16.819 -8.805) 19.890 4.476 ( -9.335 3.131 5.605) 11.329 4.667 ( -12.967 -6.364 2.101) 14.597 6.106 ( -11.352 9.886 14.520) 20.915 6.403 ( 0.747 0.282 -3.754) 3.838 7.427 ( 1.538 -3.361 -16.505) 16.914 7.792 ( -15.598 12.679 -5.892) 20.947 8.894 ( 10.707 3.802 -2.712) 11.681 10.027 ( -6.172 1.016 6.922) 9.329 11.202 ( 8.839 6.348 -14.614) 18.221 12.305 ( -19.069 29.842 15.875) 38.810 12.783 ( -18.685 21.676 14.712) 32.178 13.106 ( 16.781 17.639 2.604) 24.484 13.326 ( -8.486 3.841 1.135) 9.384 13.759 ( -11.948 -4.848 -2.468) 13.129 14.097 ( 12.858 -4.498 3.747) 14.128 15.090 ( -18.172 -19.294 -0.945) 26.522 15.528 ( 2.484 -12.957 -1.283) 13.255 15.687 ( 0.156 6.435 -1.105) 6.531 16.785 ( 40.512 -16.002 -21.228) 48.456 20.647 ( -2.255 1.821 -0.045) 2.899 20.711 ( 1.621 -0.741 -0.014) 1.782 21.701 ( 2.950 0.923 0.956) 3.235 21.803 ( 0.985 -2.040 -1.775) 2.877 24.840 ( -13.687 6.097 7.430) 16.725 25.338 ( 2.192 0.230 -1.799) 2.845 32.374 ( 0.920 -1.083 0.412) 1.479 32.428 ( 0.811 -0.631 -0.736) 1.263 42.150 ( -13.082 0.397 0.431) 13.095 43.125 ( 48.132 24.961 -3.716) 54.346 44.235 ( 5.604 -7.187 4.480) 10.155 45.248 ( 18.406 -66.432 -32.149) 76.063 ======================= Grid point 295 (124/355) ======================= q-point: ( 0.17 0.00 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.903 ( -0.779 -9.734 29.728) 31.290 2.262 ( 21.185 -22.888 15.598) 34.871 3.116 ( 11.720 -5.765 -2.995) 13.400 3.816 ( 3.797 -24.566 -7.589) 25.991 4.327 ( 29.455 -38.306 19.596) 52.144 4.531 ( 4.301 -22.628 14.124) 27.019 4.668 ( -16.352 -11.800 -5.289) 20.847 5.840 ( -11.703 14.118 11.272) 21.525 6.350 ( -0.607 7.226 2.753) 7.757 7.295 ( -22.368 17.042 -10.106) 29.881 7.446 ( 0.937 -5.144 -12.146) 13.224 8.871 ( 7.617 7.387 -5.347) 11.882 9.991 ( -4.607 0.181 6.403) 7.890 11.055 ( 5.829 13.691 -7.911) 16.853 11.813 ( -11.570 16.526 13.146) 24.079 12.333 ( -11.401 22.780 8.429) 26.832 12.939 ( 3.622 15.692 2.947) 16.372 13.159 ( -4.958 8.241 -2.690) 9.986 13.730 ( 3.361 0.665 -1.599) 3.781 14.308 ( 20.010 3.744 3.842) 20.717 15.179 ( -22.292 -17.875 -4.001) 28.852 15.614 ( 4.490 0.967 3.379) 5.702 15.862 ( -6.199 -22.401 -0.041) 23.243 17.054 ( 15.231 2.691 -15.982) 22.241 20.596 ( -3.497 0.620 0.135) 3.554 20.744 ( 1.888 -1.295 -0.031) 2.290 21.704 ( 1.380 1.598 0.607) 2.197 21.870 ( 5.334 -2.765 -3.209) 6.811 24.690 ( -8.301 3.328 8.548) 12.371 25.343 ( 1.742 0.527 -1.777) 2.544 32.406 ( 0.653 -1.564 -0.047) 1.695 32.465 ( 2.559 -2.157 -0.969) 3.484 42.047 ( -8.748 -1.650 -0.695) 8.930 43.166 ( 28.371 12.444 -2.109) 31.052 44.489 ( 5.952 -12.214 7.382) 15.463 46.175 ( 12.651 -43.851 -39.433) 60.315 ======================= Grid point 296 (125/355) ======================= q-point: ( 0.25 0.00 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.234 ( 1.617 -14.002 24.687) 28.428 2.869 ( 14.871 -20.404 8.519) 26.647 3.346 ( 8.976 -10.125 -2.957) 13.850 4.084 ( 3.845 -8.899 3.742) 10.392 4.647 ( -13.268 -8.086 -7.232) 17.138 4.863 ( -2.476 -28.192 6.559) 29.051 5.483 ( -1.917 -1.519 19.348) 19.502 5.684 ( 18.266 -23.602 5.088) 30.275 6.152 ( -6.719 12.171 5.590) 14.984 6.751 ( -16.909 13.732 -6.001) 22.594 7.556 ( 4.817 -11.135 -11.698) 16.853 8.762 ( 5.100 9.179 -8.404) 13.449 9.993 ( -2.991 -1.490 6.149) 6.999 10.806 ( 3.052 17.750 -2.520) 18.186 11.578 ( -6.889 7.967 6.144) 12.193 11.891 ( -8.224 19.991 2.816) 21.800 12.709 ( -1.698 13.568 -0.171) 13.675 12.932 ( -4.779 9.862 -4.423) 11.818 13.814 ( 12.527 -1.291 0.779) 12.618 14.371 ( 18.227 11.647 0.884) 21.649 15.255 ( -17.987 -16.932 -1.425) 24.743 15.712 ( -0.406 -5.852 5.183) 7.828 16.109 ( -9.687 -15.655 -0.011) 18.409 16.969 ( 7.159 11.541 -9.061) 16.326 20.562 ( -3.780 -0.812 0.535) 3.903 20.793 ( 1.938 -2.220 0.108) 2.949 21.687 ( 0.983 1.791 -0.081) 2.045 21.949 ( 5.583 -1.649 -3.803) 6.953 24.625 ( -5.451 1.213 8.015) 9.768 25.339 ( 1.366 0.677 -2.097) 2.592 32.440 ( 0.524 -1.977 -0.705) 2.163 32.533 ( 2.872 -2.872 -0.696) 4.121 42.031 ( -4.721 -4.403 0.612) 6.485 43.260 ( 20.761 4.705 -2.827) 21.474 44.795 ( 4.020 -12.721 9.329) 16.279 46.666 ( 6.193 -25.978 -32.935) 42.402 ======================= Grid point 297 (126/355) ======================= q-point: ( 0.33 0.00 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.607 ( 2.808 -15.143 18.608) 24.155 3.287 ( 7.630 -12.351 -0.129) 14.518 3.581 ( 5.735 -10.796 0.443) 12.233 4.304 ( 3.730 -7.710 14.261) 16.635 4.522 ( -17.976 1.511 -5.684) 18.914 5.190 ( -16.489 -16.156 2.600) 23.230 5.470 ( 0.226 7.066 3.051) 7.700 5.679 ( 3.619 12.163 9.109) 15.621 6.055 ( -16.044 4.850 3.564) 17.136 6.935 ( 18.509 -25.759 5.498) 32.192 7.786 ( 6.851 -14.092 -11.178) 19.247 8.597 ( 4.227 10.484 -10.838) 15.660 10.035 ( -2.089 -2.947 6.214) 7.188 10.524 ( 1.474 16.936 -0.658) 17.013 11.408 ( -7.123 6.688 -1.711) 9.919 11.576 ( -3.795 11.047 4.210) 12.416 12.433 ( -5.299 12.494 -9.496) 16.563 12.761 ( -0.892 5.163 2.224) 5.692 14.009 ( 14.258 -4.024 2.034) 14.954 14.361 ( 16.304 8.264 -0.505) 18.286 15.331 ( -15.375 -10.855 0.541) 18.829 15.786 ( -1.427 -0.042 4.409) 4.635 16.210 ( -13.084 -12.193 -0.696) 17.899 16.783 ( 6.583 14.234 -4.819) 16.406 20.551 ( -2.957 -1.301 1.085) 3.408 20.852 ( 1.382 -2.392 0.176) 2.768 21.669 ( 1.154 1.381 -0.565) 1.886 21.997 ( 3.542 -0.819 -3.778) 5.243 24.603 ( -4.178 0.171 7.633) 8.703 25.330 ( 1.199 0.626 -2.535) 2.873 32.476 ( 0.473 -2.166 -1.094) 2.472 32.603 ( 2.176 -2.553 -0.366) 3.375 42.096 ( -2.582 -6.271 3.281) 7.534 43.382 ( 16.867 1.869 -3.251) 17.279 45.043 ( -0.319 -8.818 8.577) 12.306 46.932 ( 4.813 -16.724 -25.256) 30.672 ======================= Grid point 298 (127/355) ======================= q-point: ( 0.42 0.00 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.928 ( 1.612 -11.386 9.420) 14.865 3.423 ( -2.553 -3.476 -0.498) 4.341 3.849 ( 6.390 -11.729 1.021) 13.396 4.224 ( -20.953 7.090 1.267) 22.156 4.513 ( 0.433 -5.932 12.553) 13.891 4.995 ( -15.896 15.170 2.112) 22.075 5.372 ( -0.926 -7.522 7.712) 10.812 5.715 ( -6.201 3.484 -3.598) 7.971 6.055 ( 13.078 -4.609 18.982) 23.507 7.432 ( 6.819 -13.115 -0.474) 14.789 7.969 ( -2.373 -8.084 -14.853) 17.076 8.440 ( 11.061 8.850 -9.871) 17.265 10.095 ( -1.687 -2.401 5.953) 6.637 10.301 ( 0.829 9.927 1.057) 10.017 11.214 ( -4.946 5.431 -6.944) 10.108 11.463 ( -2.925 3.013 6.155) 7.451 12.138 ( -6.591 8.284 -12.712) 16.542 12.768 ( 4.603 -1.232 5.859) 7.552 14.190 ( 6.935 -2.620 1.312) 7.529 14.452 ( 16.574 1.383 -0.031) 16.632 15.292 ( -14.491 -2.872 0.529) 14.782 15.737 ( -2.458 3.887 3.702) 5.904 16.295 ( -9.127 -11.565 -0.743) 14.752 16.592 ( 8.414 14.869 -3.522) 17.444 20.554 ( -1.515 -0.975 1.530) 2.364 20.893 ( 0.455 -1.195 -0.083) 1.281 21.659 ( 0.913 0.714 -0.784) 1.400 22.018 ( 0.960 -1.123 -3.397) 3.704 24.600 ( -3.699 -0.262 7.537) 8.399 25.320 ( 1.233 0.495 -2.902) 3.192 32.508 ( 0.308 -1.731 -1.188) 2.122 32.652 ( 1.013 -1.426 -0.166) 1.757 42.204 ( -2.831 -6.844 5.814) 9.416 43.491 ( 14.148 2.309 -2.862) 14.618 45.141 ( -5.864 -2.685 5.204) 8.287 47.122 ( 6.497 -11.713 -18.657) 22.967 ======================= Grid point 299 (128/355) ======================= q-point: (-0.50 0.00 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.039 ( -3.551 1.328 -0.433) 3.816 3.416 ( -8.961 -2.674 4.684) 10.459 3.907 ( -21.014 0.922 4.763) 21.567 4.105 ( 2.962 -9.283 -5.270) 11.078 4.503 ( 2.407 13.457 4.025) 14.250 4.855 ( -3.666 -4.566 20.811) 21.620 5.479 ( -1.568 5.056 14.016) 14.982 5.690 ( 0.091 -14.373 -6.346) 15.712 6.356 ( 18.872 0.366 17.572) 25.789 7.482 ( -8.621 4.258 -4.060) 10.438 7.819 ( -11.863 4.386 -19.928) 23.603 8.457 ( 17.323 4.169 -9.023) 19.972 10.094 ( -0.533 3.357 3.625) 4.970 10.257 ( -0.849 -2.145 4.582) 5.130 11.092 ( -1.253 0.902 -8.124) 8.269 11.450 ( -3.115 -1.831 5.260) 6.382 11.942 ( -4.504 1.423 -11.150) 12.109 12.926 ( 7.376 -6.466 5.921) 11.458 14.242 ( -2.742 -0.107 0.825) 2.865 14.512 ( -0.069 4.289 -0.090) 4.290 15.247 ( 0.233 -2.785 0.068) 2.795 15.694 ( -0.835 0.629 4.182) 4.310 16.385 ( -3.112 -5.102 -1.866) 6.261 16.446 ( 11.554 10.307 -2.676) 15.713 20.566 ( 0.132 -0.346 1.784) 1.822 20.898 ( -0.104 0.547 -0.364) 0.665 21.652 ( -0.168 0.089 -0.935) 0.954 22.025 ( -1.626 -1.888 -3.119) 3.992 24.605 ( -3.600 -0.456 7.656) 8.472 25.312 ( 1.389 0.417 -3.152) 3.469 32.525 ( 0.030 -0.685 -1.190) 1.373 32.666 ( -0.197 0.191 -0.120) 0.299 42.309 ( -4.898 -6.458 7.223) 10.857 43.550 ( 11.102 4.735 -1.902) 12.219 45.072 ( -10.206 2.753 1.684) 10.704 47.283 ( 8.792 -7.283 -15.101) 18.931 ======================= Grid point 300 (129/355) ======================= q-point: (-0.42 0.00 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.819 ( -11.434 14.441 3.786) 18.805 3.387 ( -10.407 -4.120 -2.943) 11.574 3.744 ( -17.139 0.551 6.231) 18.245 4.143 ( -1.593 10.058 7.510) 12.653 4.436 ( 6.987 -3.155 2.310) 8.007 5.018 ( 8.202 -0.676 3.444) 8.922 5.422 ( -8.787 -0.103 20.830) 22.608 6.060 ( 11.092 -21.197 1.014) 23.945 6.504 ( 11.553 11.498 10.896) 19.606 7.099 ( -20.568 21.591 0.148) 29.820 7.559 ( -6.151 -0.042 -20.173) 21.090 8.491 ( 15.928 6.743 -11.162) 20.586 10.053 ( -2.029 1.649 3.514) 4.380 10.328 ( -0.641 -3.805 4.777) 6.141 11.090 ( 2.892 -3.713 -7.713) 9.035 11.512 ( -2.831 -6.649 3.975) 8.247 11.903 ( -1.040 -5.314 -8.313) 9.921 13.151 ( 6.394 -8.461 3.591) 11.197 14.133 ( -13.755 2.323 0.366) 13.954 14.359 ( -12.706 4.239 0.693) 13.412 15.348 ( 10.736 -0.628 -0.568) 10.770 15.724 ( 1.728 0.536 4.359) 4.720 16.350 ( 13.284 9.744 -0.680) 16.489 16.526 ( 5.189 -7.778 -3.741) 10.071 20.585 ( 1.678 0.188 1.791) 2.462 20.873 ( 0.055 2.056 -0.269) 2.074 21.645 ( -1.524 -0.755 -1.042) 1.994 22.014 ( -4.308 -1.914 -3.389) 5.806 24.614 ( -3.661 -0.755 8.026) 8.854 25.305 ( 1.601 0.411 -3.315) 3.704 32.519 ( -0.254 0.608 -1.317) 1.473 32.641 ( -1.108 1.835 -0.146) 2.149 42.381 ( -7.731 -5.645 7.252) 12.009 43.526 ( 6.219 7.894 -1.361) 10.141 44.886 ( -11.609 6.155 0.261) 13.142 47.387 ( 10.734 -1.497 -16.084) 19.395 ======================= Grid point 301 (130/355) ======================= q-point: (-0.33 0.00 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.437 ( -14.346 18.201 9.714) 25.128 3.300 ( -9.565 2.666 -3.681) 10.590 3.449 ( -13.623 19.422 4.518) 24.150 4.044 ( 0.255 5.657 18.911) 19.741 4.540 ( -0.557 1.443 -2.132) 2.634 5.079 ( 12.419 -1.765 -9.037) 15.460 5.532 ( -12.312 -5.362 26.195) 29.437 6.119 ( -18.760 31.175 -2.858) 36.497 6.401 ( -0.684 8.191 3.833) 9.069 6.724 ( 9.486 -8.442 4.205) 13.376 7.595 ( 5.122 -11.499 -10.224) 16.217 8.442 ( 13.250 9.940 -12.663) 20.849 10.035 ( -3.650 -0.856 4.074) 5.537 10.415 ( 0.758 -4.165 5.424) 6.881 11.180 ( 5.909 -5.232 -7.706) 11.030 11.659 ( -1.583 -11.797 3.383) 12.374 12.014 ( 2.673 -10.405 -5.627) 12.127 13.332 ( 3.317 -5.452 0.500) 6.402 13.984 ( -16.928 -4.398 2.198) 17.627 14.150 ( -17.442 2.162 -0.689) 17.589 15.432 ( 11.294 5.130 -0.112) 12.404 15.720 ( 4.895 5.146 5.080) 8.732 16.306 ( 10.488 10.499 -0.459) 14.847 16.765 ( 11.300 -12.126 -5.342) 17.415 20.608 ( 2.520 0.549 1.337) 2.905 20.835 ( 1.138 3.030 0.207) 3.243 21.637 ( -2.815 -1.550 -1.251) 3.449 21.968 ( -6.535 -1.082 -3.815) 7.644 24.634 ( -3.764 -1.606 8.852) 9.753 25.300 ( 1.846 0.407 -3.405) 3.895 32.489 ( -0.389 1.705 -1.655) 2.408 32.586 ( -1.529 2.970 -0.113) 3.342 42.409 ( -10.454 -4.916 6.147) 13.086 43.389 ( -1.366 10.385 -2.394) 10.745 44.661 ( -9.721 7.916 1.334) 12.607 47.376 ( 12.561 7.124 -22.310) 26.576 ======================= Grid point 302 (131/355) ======================= q-point: (-0.25 0.00 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.043 ( -14.127 18.201 15.086) 27.540 2.791 ( -8.459 39.094 5.911) 40.433 3.207 ( -15.151 0.487 -1.292) 15.214 4.035 ( 5.203 12.693 13.465) 19.222 4.354 ( -8.230 14.083 3.800) 16.748 4.917 ( -25.831 42.500 -3.742) 49.875 5.228 ( -3.197 -3.949 2.224) 5.546 5.887 ( -10.939 -7.837 18.710) 23.047 6.216 ( 8.293 8.061 2.178) 11.769 7.168 ( 12.674 -19.939 -0.363) 23.629 7.828 ( 5.437 -11.288 -13.014) 18.065 8.339 ( 13.509 9.468 -8.359) 18.493 10.044 ( -4.508 -2.214 5.859) 7.717 10.561 ( 3.696 -8.192 8.182) 12.154 11.297 ( 8.568 -4.620 -7.616) 12.360 11.907 ( 0.895 -15.826 4.810) 16.565 12.236 ( 5.152 -13.526 -3.670) 14.932 13.426 ( 2.239 -3.920 1.233) 4.680 13.946 ( -14.856 -0.102 0.902) 14.883 13.977 ( -19.026 -11.480 0.031) 22.221 15.366 ( 7.615 12.735 -0.812) 14.861 15.746 ( 8.827 3.812 7.002) 11.894 16.191 ( 7.997 13.889 -0.585) 16.037 17.025 ( 8.736 -8.466 -11.281) 16.590 20.625 ( 2.039 0.582 0.441) 2.166 20.799 ( 2.484 3.677 0.356) 4.452 21.627 ( -3.837 -2.003 -1.524) 4.588 21.893 ( -6.622 -0.249 -3.153) 7.338 24.683 ( -3.813 -3.876 10.441) 11.772 25.298 ( 2.113 0.324 -3.380) 3.999 32.443 ( -0.283 2.244 -1.971) 3.000 32.518 ( -1.439 3.158 0.016) 3.470 42.396 ( -12.727 -4.598 4.130) 14.148 43.135 ( -9.841 11.080 -4.454) 15.474 44.450 ( -6.193 8.897 3.232) 11.312 47.149 ( 14.089 22.272 -34.550) 43.454 ======================= Grid point 303 (132/355) ======================= q-point: (-0.17 0.00 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.684 ( -11.652 19.820 18.193) 29.319 2.040 ( -11.069 41.133 11.158) 44.033 2.976 ( -14.166 14.776 -0.923) 20.490 3.374 ( -23.451 51.009 7.090) 56.587 4.017 ( 4.620 18.662 9.524) 21.455 4.493 ( -10.695 -6.484 6.015) 13.878 5.117 ( -11.016 8.910 6.067) 15.413 6.021 ( -9.731 -10.872 17.580) 22.846 6.314 ( 11.258 -2.791 -2.308) 11.826 7.562 ( 6.218 -14.722 -7.007) 17.450 7.831 ( 3.005 1.878 -19.483) 19.803 8.430 ( 16.568 -2.302 0.671) 16.741 10.066 ( -5.254 -2.273 7.820) 9.692 10.874 ( 8.643 -16.808 6.210) 19.894 11.493 ( 15.094 -10.754 4.448) 19.059 12.232 ( 3.797 -15.932 7.709) 18.101 12.526 ( 4.687 -16.794 -1.623) 17.511 13.550 ( 3.248 -3.877 5.863) 7.743 13.820 ( -14.316 -6.485 -5.400) 16.618 14.012 ( -12.703 -8.972 4.957) 16.322 15.205 ( 6.750 13.168 -0.748) 14.816 15.783 ( 1.470 3.318 5.616) 6.686 16.011 ( 10.695 17.112 -0.114) 20.180 16.992 ( -1.992 11.425 -24.776) 27.356 20.637 ( 1.075 -0.224 -0.054) 1.099 20.758 ( 1.564 3.728 -0.474) 4.070 21.621 ( -2.784 -2.214 -0.666) 3.619 21.833 ( -3.778 -0.235 -1.210) 3.974 24.802 ( -3.801 -9.238 12.096) 15.687 25.301 ( 2.365 0.154 -3.164) 3.953 32.396 ( -0.133 1.922 -1.553) 2.474 32.459 ( -0.847 2.246 0.046) 2.400 42.347 ( -13.925 -4.031 0.841) 14.522 42.804 ( -14.626 10.464 -4.171) 18.460 44.271 ( -3.044 8.801 3.695) 10.019 46.505 ( 13.082 51.069 -48.323) 71.515 ======================= Grid point 304 (133/355) ======================= q-point: (-0.08 0.00 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.164 ( -7.026 35.902 16.058) 39.952 1.475 ( -4.094 27.786 23.836) 36.837 2.147 ( -11.800 45.972 28.549) 55.387 2.900 ( -8.306 5.574 1.604) 10.131 3.826 ( -2.157 8.556 -2.508) 9.173 4.606 ( -10.535 -11.297 8.383) 17.575 4.876 ( -9.998 8.099 4.642) 13.679 6.172 ( -10.757 -8.174 19.042) 23.348 6.420 ( 5.932 -1.435 -7.250) 9.477 7.547 ( 3.435 4.191 -24.710) 25.297 7.951 ( 2.928 -10.788 -1.393) 11.265 8.642 ( 15.667 -2.287 0.104) 15.833 10.081 ( -5.867 -1.586 8.193) 10.201 11.163 ( 9.064 -7.321 -14.859) 18.882 12.246 ( 20.912 -40.720 24.503) 51.921 12.576 ( 16.206 -11.347 9.533) 21.961 12.893 ( -1.515 -27.534 2.714) 27.709 13.556 ( -8.732 0.829 2.646) 9.162 13.854 ( 0.955 -3.131 -2.303) 4.002 14.156 ( -11.812 -22.131 8.575) 26.511 15.114 ( 13.847 7.120 -0.699) 15.586 15.641 ( -14.785 6.340 1.420) 16.150 15.895 ( 7.422 10.143 -0.826) 12.596 16.226 ( -1.464 60.587 -28.920) 67.151 20.658 ( 0.702 -1.271 -0.018) 1.452 20.712 ( -0.480 1.664 -0.359) 1.769 21.644 ( 0.446 -1.506 0.788) 1.757 21.813 ( -1.181 -0.388 -0.360) 1.295 25.014 ( -6.692 -14.270 7.385) 17.405 25.310 ( 2.528 0.007 -2.738) 3.726 32.365 ( -0.341 0.995 -0.139) 1.061 32.432 ( -0.164 0.338 -0.166) 0.411 42.295 ( -1.074 -2.806 1.077) 3.191 42.513 ( -7.745 7.966 1.843) 11.263 44.141 ( -0.113 6.085 2.746) 6.677 45.291 ( 7.194 74.312 -33.337) 81.764 ======================= Grid point 306 (134/355) ======================= q-point: ( 0.08 0.08 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 354 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.673 ( 2.650 0.000 28.836) 28.957 2.137 ( 33.893 0.000 25.718) 42.546 2.841 ( 41.392 0.000 24.638) 48.170 3.141 ( 26.516 0.000 -2.510) 26.634 3.396 ( 2.312 0.000 -1.527) 2.771 4.318 ( -12.698 -0.000 -17.793) 21.859 4.570 ( -11.622 -0.000 14.950) 18.936 6.163 ( -11.302 -0.000 14.505) 18.389 6.396 ( 4.162 0.000 -3.228) 5.267 7.325 ( -2.943 -0.000 -12.799) 13.133 7.673 ( -24.151 -0.000 -7.467) 25.278 9.010 ( 8.452 0.000 -3.838) 9.283 10.003 ( -6.343 -0.000 6.583) 9.142 11.278 ( 9.726 0.000 -15.237) 18.077 12.497 ( -17.382 -0.000 8.231) 19.232 12.603 ( -50.508 -0.000 24.133) 55.978 13.321 ( -1.414 -0.000 -0.948) 1.702 13.472 ( 2.703 0.000 -2.371) 3.596 13.600 ( 11.145 0.000 3.982) 11.835 14.140 ( 9.176 0.000 7.158) 11.638 14.815 ( -8.744 -0.000 1.567) 8.884 15.268 ( -9.382 -0.000 -3.326) 9.954 15.895 ( 6.097 0.000 -1.461) 6.269 16.981 ( 41.356 0.000 -27.814) 49.839 20.649 ( -1.373 -0.000 -0.768) 1.573 20.729 ( 2.412 0.000 0.383) 2.442 21.749 ( 3.764 0.000 0.675) 3.824 21.759 ( -1.619 -0.000 -1.332) 2.097 24.777 ( -13.643 -0.000 7.278) 15.463 25.353 ( 1.796 0.000 -1.218) 2.170 32.381 ( 1.631 0.000 0.643) 1.753 32.431 ( 1.653 0.000 -0.842) 1.856 42.021 ( -11.207 -0.000 -1.904) 11.367 44.135 ( 43.456 0.000 -18.042) 47.052 44.348 ( 35.774 0.000 -10.040) 37.156 44.390 ( 0.334 0.000 -3.714) 3.729 ======================= Grid point 307 (135/355) ======================= q-point: ( 0.17 0.08 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.898 ( 0.691 -7.213 30.750) 31.592 2.518 ( 37.226 2.840 20.898) 42.785 3.094 ( -1.237 -2.895 -6.397) 7.129 3.537 ( 27.583 -17.515 -3.739) 32.888 4.123 ( 22.583 -26.598 8.266) 35.857 4.166 ( 8.886 -17.206 -4.138) 19.802 4.530 ( -8.964 -1.501 13.319) 16.125 5.997 ( -10.548 11.356 9.039) 17.943 6.459 ( 4.746 0.857 4.192) 6.390 7.193 ( -17.992 5.708 -14.630) 23.881 7.330 ( -15.912 1.060 -5.348) 16.820 9.020 ( 5.822 4.735 -5.729) 9.441 9.972 ( -5.335 -0.023 6.341) 8.287 11.250 ( 8.331 6.839 -12.445) 16.464 11.994 ( -24.079 17.592 16.478) 34.070 12.436 ( -25.550 3.134 11.526) 28.205 13.245 ( -1.087 7.258 -4.297) 8.504 13.326 ( 5.462 17.640 1.847) 18.559 13.697 ( 3.156 -1.048 1.966) 3.863 14.410 ( 10.543 -12.688 8.292) 18.463 14.777 ( -10.019 -5.229 -2.182) 11.510 15.357 ( -11.805 -20.062 -1.680) 23.338 15.846 ( 8.443 9.289 -0.200) 12.554 17.184 ( 20.987 0.765 -23.293) 31.362 20.604 ( -1.391 2.919 -0.281) 3.246 20.756 ( 2.520 -0.195 0.261) 2.541 21.737 ( 0.199 0.583 -0.493) 0.789 21.826 ( 3.010 -4.219 -1.591) 5.421 24.679 ( -9.314 1.458 7.826) 12.252 25.360 ( 1.242 0.425 -1.075) 1.697 32.404 ( 1.713 -0.279 0.170) 1.744 32.459 ( 2.790 -1.262 -0.899) 3.191 41.931 ( -6.673 -1.507 -2.443) 7.264 43.839 ( 27.451 32.013 -5.810) 42.569 44.423 ( 9.075 -7.127 4.105) 12.248 45.388 ( 22.810 -47.677 -31.426) 61.490 ======================= Grid point 308 (136/355) ======================= q-point: ( 0.25 0.08 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.192 ( 2.308 -9.420 29.712) 31.255 2.977 ( 32.934 -1.979 14.015) 35.846 3.196 ( 4.065 -12.589 -4.741) 14.053 3.924 ( 0.943 -13.408 -20.220) 24.280 4.185 ( -12.004 -15.400 6.534) 20.590 4.610 ( 4.134 -12.055 4.786) 13.613 5.326 ( 32.973 -36.414 20.062) 53.063 5.721 ( -6.857 11.234 3.240) 13.554 6.387 ( -5.479 15.289 8.224) 18.205 6.727 ( -18.457 8.939 -7.123) 21.710 7.341 ( -0.197 -10.984 -10.565) 15.241 8.925 ( 3.894 8.337 -7.560) 11.909 9.963 ( -3.972 -1.220 6.193) 7.458 11.098 ( 5.075 13.932 -6.645) 16.248 11.654 ( -13.916 9.235 9.553) 19.240 12.082 ( -18.952 14.793 5.719) 24.712 12.985 ( 0.216 17.388 -8.443) 19.331 13.109 ( 3.110 15.099 2.588) 15.632 13.804 ( 2.549 -7.946 2.156) 8.619 14.658 ( 8.004 4.399 -0.223) 9.136 14.831 ( -6.381 -16.712 2.942) 18.130 15.534 ( -12.669 -15.041 1.838) 19.751 15.854 ( 2.009 -2.880 1.843) 3.965 17.177 ( 11.127 7.417 -15.307) 20.325 20.545 ( -1.623 1.911 0.624) 2.584 20.790 ( 2.424 -0.836 0.063) 2.565 21.724 ( 0.838 1.263 -0.757) 1.695 21.918 ( 2.596 -4.089 -3.204) 5.807 24.619 ( -6.122 0.744 7.601) 9.788 25.354 ( 0.810 0.739 -1.441) 1.811 32.426 ( 1.707 -0.600 -0.679) 1.933 32.516 ( 3.019 -2.275 -0.684) 3.842 41.924 ( -2.086 -3.738 -0.620) 4.326 43.674 ( 23.926 17.395 -2.249) 29.667 44.688 ( 8.019 -10.491 5.425) 14.276 46.076 ( 9.254 -34.172 -30.752) 46.894 ======================= Grid point 309 (137/355) ======================= q-point: ( 0.33 0.08 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.524 ( 4.173 -10.941 24.504) 27.158 3.257 ( 10.415 -3.859 -1.539) 11.213 3.518 ( 17.025 -7.727 3.699) 19.058 4.071 ( -10.025 -24.288 -19.157) 32.518 4.268 ( -13.746 -4.729 18.303) 23.373 4.877 ( -4.819 -7.350 2.066) 9.029 5.546 ( 0.464 2.961 -4.402) 5.326 5.905 ( -13.057 0.218 11.024) 17.090 6.063 ( 2.530 11.017 11.686) 16.258 6.767 ( 17.143 -17.027 3.909) 24.476 7.540 ( 4.687 -14.537 -12.368) 19.653 8.768 ( 3.704 9.718 -8.928) 13.706 9.991 ( -2.975 -2.718 6.402) 7.565 10.841 ( 2.781 18.210 -2.738) 18.624 11.430 ( -10.742 7.174 0.479) 12.926 11.710 ( -12.307 11.528 4.361) 17.418 12.632 ( -0.883 18.384 -11.709) 21.814 12.933 ( 5.548 11.445 3.959) 13.321 14.016 ( 6.210 -9.482 2.787) 11.672 14.596 ( 4.230 5.115 -3.136) 7.341 15.040 ( -4.126 -8.984 4.103) 10.704 15.688 ( -8.544 -14.987 4.850) 17.920 15.895 ( -9.557 -4.131 0.843) 10.446 17.055 ( 9.078 11.554 -9.636) 17.571 20.521 ( -1.113 -0.171 1.207) 1.650 20.833 ( 1.986 -1.623 -0.064) 2.566 21.706 ( 1.176 1.602 -1.018) 2.233 21.973 ( 0.973 -2.165 -3.632) 4.339 24.596 ( -4.501 0.021 7.334) 8.605 25.341 ( 0.683 0.745 -2.049) 2.284 32.454 ( 1.767 -1.123 -1.222) 2.424 32.581 ( 2.381 -2.452 -0.464) 3.449 41.998 ( 0.386 -5.188 2.361) 5.713 43.677 ( 22.154 9.807 -0.763) 24.240 44.939 ( 3.666 -8.483 4.800) 10.414 46.496 ( 3.333 -25.453 -25.007) 35.838 ======================= Grid point 310 (138/355) ======================= q-point: ( 0.42 0.08 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.834 ( 3.718 -9.283 14.966) 17.999 3.326 ( -2.896 -3.200 -6.255) 7.600 3.776 ( 6.883 -7.025 1.412) 9.936 4.123 ( -16.822 1.957 7.391) 18.478 4.423 ( 3.318 -12.894 3.895) 13.872 4.830 ( -19.211 -5.364 6.723) 21.048 5.331 ( -4.992 2.857 -10.781) 12.219 5.866 ( -4.831 14.791 13.288) 20.461 6.160 ( 16.490 -11.015 18.501) 27.121 7.247 ( 8.615 -15.586 -2.121) 17.934 7.730 ( -0.019 -10.000 -14.389) 17.523 8.629 ( 7.947 7.260 -9.427) 14.309 10.050 ( -2.339 -3.723 6.899) 8.181 10.552 ( 2.144 17.031 -1.128) 17.202 11.204 ( -8.576 5.493 -6.267) 11.958 11.504 ( -8.112 4.944 6.038) 11.256 12.279 ( 1.474 16.628 -11.742) 20.409 12.891 ( 8.957 4.911 5.117) 11.425 14.204 ( 3.684 -3.646 1.661) 5.442 14.608 ( 9.013 0.090 -1.518) 9.140 15.075 ( -12.062 -4.545 2.682) 13.166 15.777 ( -5.564 3.495 4.194) 7.795 15.938 ( -11.527 -18.959 0.845) 22.204 16.902 ( 10.056 13.147 -6.985) 17.965 20.535 ( -0.082 -1.223 1.509) 1.944 20.877 ( 1.332 -1.458 -0.236) 1.989 21.685 ( 0.736 1.483 -1.166) 2.025 21.982 ( -0.882 -0.889 -3.117) 3.359 24.591 ( -3.827 -0.356 7.264) 8.218 25.326 ( 0.825 0.533 -2.588) 2.768 32.486 ( 1.696 -1.290 -1.332) 2.513 32.635 ( 1.334 -1.826 -0.263) 2.277 42.110 ( 0.204 -5.313 4.837) 7.188 43.754 ( 21.136 7.531 0.545) 22.444 45.058 ( -3.048 -3.238 1.709) 4.764 46.806 ( 2.696 -20.695 -18.483) 27.878 ======================= Grid point 311 (139/355) ======================= q-point: (-0.50 0.08 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.003 ( 0.506 -3.308 1.842) 3.820 3.293 ( -9.114 -3.054 -3.238) 10.143 3.747 ( -22.689 5.791 7.934) 24.723 4.020 ( 1.354 -3.809 0.533) 4.078 4.686 ( 11.556 -6.386 9.649) 16.353 4.809 ( -9.878 -2.944 17.746) 20.522 5.411 ( 4.130 -14.585 -8.653) 17.454 5.651 ( -4.098 11.410 11.929) 17.008 6.572 ( 17.324 -6.459 16.265) 24.624 7.366 ( -9.653 -2.660 -6.689) 12.042 7.678 ( -9.114 1.930 -16.357) 18.824 8.625 ( 14.083 2.012 -10.438) 17.644 10.122 ( -1.562 -2.714 6.899) 7.576 10.336 ( 1.454 10.242 0.745) 10.371 11.048 ( -3.529 1.378 -8.133) 8.972 11.407 ( -7.319 0.748 4.932) 8.857 12.028 ( 6.555 11.926 -9.015) 16.324 12.979 ( 10.182 -0.637 4.830) 11.288 14.214 ( -5.665 1.347 0.445) 5.840 14.597 ( -4.253 8.460 0.144) 9.470 15.120 ( -1.083 -11.279 1.071) 11.382 15.689 ( -5.318 0.198 2.508) 5.883 16.149 ( -5.404 -14.322 1.399) 15.371 16.773 ( 13.301 11.913 -5.797) 18.774 20.569 ( 1.071 -1.228 1.597) 2.282 20.902 ( 1.023 -0.313 -0.368) 1.132 21.657 ( -0.750 1.229 -1.378) 1.993 21.964 ( -2.544 -0.652 -2.214) 3.434 24.595 ( -3.646 -0.491 7.359) 8.227 25.316 ( 1.091 0.319 -2.937) 3.149 32.514 ( 1.412 -0.757 -1.227) 2.019 32.663 ( 0.279 -0.559 -0.091) 0.631 42.211 ( -1.763 -4.506 6.048) 7.745 43.827 ( 19.344 9.286 1.332) 21.499 45.009 ( -8.954 1.355 -0.900) 9.100 47.076 ( 4.004 -16.402 -14.476) 22.240 ======================= Grid point 312 (140/355) ======================= q-point: (-0.42 0.08 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.952 ( -4.441 8.988 0.156) 10.027 3.223 ( -9.658 -2.209 -2.178) 10.144 3.510 ( -19.898 -3.903 5.465) 21.000 4.141 ( 0.581 -5.420 7.511) 9.281 4.808 ( 14.332 15.494 13.201) 24.895 4.978 ( 0.357 -12.488 18.138) 22.024 5.499 ( -1.881 7.693 4.476) 9.097 5.755 ( 5.222 -22.857 -3.214) 23.665 6.788 ( 3.772 5.356 6.615) 9.310 7.173 ( -12.981 7.512 3.601) 15.424 7.419 ( -8.537 3.488 -19.098) 21.208 8.679 ( 14.141 3.521 -12.520) 19.213 10.119 ( -0.313 5.288 3.773) 6.504 10.282 ( -1.611 -2.477 4.247) 5.174 11.023 ( 2.342 -3.190 -7.161) 8.182 11.380 ( -6.545 -3.925 2.801) 8.130 11.933 ( 11.233 5.976 -5.868) 14.012 13.137 ( 8.834 -4.110 2.908) 10.168 14.041 ( -17.341 5.472 -0.027) 18.184 14.331 ( -15.120 8.889 1.776) 17.629 15.347 ( 7.669 -9.051 -1.711) 11.986 15.711 ( -1.131 -4.333 3.809) 5.880 16.307 ( -2.441 -8.789 -0.197) 9.124 16.739 ( 17.896 7.358 -4.503) 19.867 20.609 ( 2.048 -0.752 1.467) 2.629 20.906 ( 1.458 1.020 -0.155) 1.786 21.618 ( -2.487 0.533 -1.502) 2.953 21.931 ( -4.307 -0.471 -1.671) 4.644 24.602 ( -3.695 -0.606 7.599) 8.472 25.310 ( 1.372 0.223 -3.129) 3.424 32.525 ( 1.037 0.339 -1.195) 1.618 32.657 ( -0.520 1.040 0.033) 1.163 42.275 ( -4.274 -3.309 6.114) 8.161 43.812 ( 14.151 13.602 -0.163) 19.629 44.860 ( -10.416 3.694 0.188) 11.053 47.289 ( 5.514 -10.924 -14.725) 19.146 ======================= Grid point 313 (141/355) ======================= q-point: (-0.33 0.08 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.655 ( -9.439 17.598 6.853) 21.113 3.157 ( -9.602 -2.140 -0.779) 9.868 3.503 ( -9.161 -4.396 4.973) 11.313 4.234 ( 0.084 2.309 13.409) 13.606 4.700 ( 11.329 15.109 9.052) 20.942 5.237 ( 11.077 -0.413 -2.731) 11.416 5.387 ( -12.514 -1.742 18.824) 22.671 6.198 ( 0.457 -19.156 -5.080) 19.823 6.453 ( -12.990 18.350 -0.274) 22.484 6.879 ( -4.876 16.174 1.537) 16.962 7.430 ( 5.143 -9.467 -4.806) 11.797 8.657 ( 12.073 7.304 -14.139) 19.975 10.042 ( -1.635 3.486 2.910) 4.827 10.357 ( -1.846 -5.247 5.099) 7.545 11.116 ( 5.803 -5.652 -5.682) 9.895 11.446 ( -4.393 -9.763 1.527) 10.814 11.996 ( 15.001 -0.169 -3.404) 15.384 13.300 ( 6.776 -4.683 -0.401) 8.247 13.755 ( -23.458 2.040 1.981) 23.630 14.044 ( -18.250 6.176 1.249) 19.307 15.531 ( 8.084 -4.058 -1.471) 9.164 15.792 ( 0.942 -1.963 4.541) 5.036 16.387 ( -0.421 -2.848 -1.834) 3.413 16.846 ( 19.320 0.362 -4.400) 19.818 20.644 ( 2.331 0.013 0.978) 2.528 20.901 ( 2.681 2.023 0.280) 3.371 21.579 ( -3.848 -0.484 -1.426) 4.132 21.878 ( -5.549 -0.039 -1.441) 5.734 24.613 ( -3.872 -1.000 8.065) 9.002 25.307 ( 1.635 0.209 -3.216) 3.614 32.512 ( 0.811 1.577 -1.355) 2.231 32.620 ( -0.988 2.500 0.066) 2.689 42.293 ( -6.403 -2.099 5.463) 8.675 43.635 ( 4.552 17.482 -4.323) 18.575 44.708 ( -6.231 5.547 4.861) 9.655 47.401 ( 7.107 -3.718 -19.318) 20.917 ======================= Grid point 314 (142/355) ======================= q-point: (-0.25 0.08 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.291 ( -10.142 18.777 12.738) 24.853 3.087 ( -9.572 0.404 2.304) 9.853 3.324 ( -2.665 23.730 3.562) 24.144 4.214 ( -3.200 3.482 20.231) 20.776 4.651 ( 10.098 11.452 -1.602) 15.352 5.127 ( -0.273 9.271 -7.516) 11.938 5.396 ( -15.359 14.968 15.319) 26.356 5.815 ( -9.961 12.582 9.535) 18.667 6.418 ( -0.969 8.050 -0.009) 8.108 6.903 ( 5.736 -20.066 -2.344) 21.001 7.640 ( 4.733 -10.630 -6.802) 13.478 8.567 ( 11.055 8.464 -12.897) 18.978 10.008 ( -2.614 0.057 4.137) 4.894 10.474 ( -0.545 -8.029 5.691) 9.857 11.256 ( 7.247 -6.183 -4.799) 10.666 11.641 ( -1.487 -15.899 2.129) 16.110 12.193 ( 18.014 -4.444 -1.693) 18.631 13.394 ( 1.143 -2.536 -1.815) 3.321 13.596 ( -21.541 -8.271 2.737) 23.236 13.803 ( -15.068 1.520 2.035) 15.280 15.595 ( 6.061 5.122 -0.789) 7.975 15.847 ( 2.151 -0.371 5.638) 6.045 16.373 ( 1.156 3.814 -2.551) 4.732 17.021 ( 13.442 -3.018 -7.877) 15.869 20.659 ( 1.717 0.906 0.341) 1.971 20.889 ( 2.757 3.109 -0.397) 4.174 21.551 ( -3.357 -1.423 -0.571) 3.690 21.819 ( -4.696 -0.084 -0.885) 4.779 24.636 ( -4.238 -2.141 8.917) 10.103 25.307 ( 1.887 0.168 -3.185) 3.706 32.478 ( 0.866 2.522 -1.569) 3.094 32.559 ( -1.140 3.282 -0.045) 3.475 42.272 ( -7.521 -1.130 4.508) 8.841 43.304 ( -3.410 18.430 -7.341) 20.130 44.587 ( -1.468 8.537 8.588) 12.197 47.353 ( 8.816 6.858 -28.320) 30.442 ======================= Grid point 315 (143/355) ======================= q-point: (-0.17 0.08 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.960 ( -9.276 17.540 18.888) 27.394 2.691 ( -7.874 39.930 5.308) 41.044 3.020 ( -3.415 5.633 2.278) 6.971 4.233 ( 1.956 22.077 15.044) 26.787 4.325 ( -1.051 21.031 3.216) 21.301 4.587 ( -0.894 36.095 0.676) 36.113 5.168 ( -6.674 5.255 8.323) 11.893 5.812 ( -12.199 -9.239 15.059) 21.470 6.347 ( 2.253 -0.088 -1.814) 2.894 7.289 ( 2.007 -20.277 -3.869) 20.740 7.739 ( 0.439 -3.470 -17.328) 17.677 8.551 ( 12.563 0.711 -5.733) 13.827 10.015 ( -3.909 -1.583 6.087) 7.405 10.696 ( 2.855 -14.430 4.943) 15.518 11.443 ( 8.409 -9.411 0.373) 12.626 11.957 ( 0.097 -20.648 3.977) 21.028 12.459 ( 17.511 -5.889 -0.132) 18.475 13.467 ( -15.587 -6.695 8.328) 18.898 13.526 ( -5.848 -10.045 -6.912) 13.523 13.781 ( -3.494 -5.818 3.576) 7.670 15.502 ( 6.442 11.694 0.360) 13.356 15.856 ( -3.573 3.511 4.666) 6.845 16.266 ( 1.646 9.037 -2.769) 9.594 17.073 ( 5.299 3.288 -14.768) 16.030 20.655 ( 0.927 1.064 0.079) 1.414 20.831 ( -0.618 4.365 -2.270) 4.959 21.571 ( 1.168 -2.208 1.372) 2.850 21.790 ( -1.771 -0.752 -0.305) 1.948 24.688 ( -5.219 -4.703 10.060) 12.270 25.311 ( 2.118 0.026 -2.961) 3.641 32.435 ( 1.001 2.826 -1.425) 3.319 32.494 ( -0.871 3.016 -0.327) 3.156 42.232 ( -6.780 -0.863 3.828) 7.834 42.930 ( -3.746 16.461 -6.834) 18.213 44.461 ( 1.099 11.153 9.040) 14.399 47.041 ( 10.404 24.785 -40.652) 48.736 ======================= Grid point 316 (144/355) ======================= q-point: (-0.08 0.08 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.697 ( -4.918 17.362 23.547) 29.666 1.964 ( -4.830 38.109 13.977) 40.877 2.923 ( 4.575 7.203 0.923) 8.583 3.433 ( 18.917 64.596 19.342) 70.033 4.078 ( -0.957 22.784 -12.680) 26.092 4.400 ( -6.622 -4.860 20.867) 22.426 4.956 ( -11.348 11.661 3.967) 16.748 5.960 ( -11.970 -12.789 15.673) 23.505 6.385 ( 0.388 -3.393 -5.065) 6.109 7.515 ( 2.305 -3.955 -12.963) 13.747 7.699 ( -6.547 -10.312 -11.618) 16.858 8.711 ( 12.173 -5.137 -2.498) 13.446 10.029 ( -5.221 -1.702 7.048) 8.935 11.006 ( 6.051 -14.529 -6.110) 16.883 11.811 ( 1.130 -25.447 15.154) 29.639 12.363 ( 0.556 -24.487 7.287) 25.555 12.738 ( 14.126 -8.681 2.450) 16.760 13.373 ( -16.735 -4.842 1.123) 17.458 13.777 ( -6.363 -15.471 1.975) 16.845 13.895 ( 13.731 -3.292 2.133) 14.280 15.397 ( 10.452 9.807 2.165) 14.495 15.647 ( -15.860 10.687 -0.999) 19.150 16.036 ( -7.705 15.850 -3.389) 17.947 16.896 ( 14.363 16.498 -19.375) 29.221 20.648 ( -0.615 0.022 0.089) 0.622 20.740 ( -1.257 2.995 -1.593) 3.618 21.642 ( 3.540 -1.720 1.574) 4.239 21.803 ( 1.652 -0.546 -0.700) 1.876 24.779 ( -8.295 -8.087 9.936) 15.262 25.321 ( 2.266 -0.166 -2.477) 3.361 32.395 ( 0.771 2.299 -0.544) 2.485 32.446 ( 0.022 1.788 -0.661) 1.907 42.217 ( -6.818 -2.714 3.675) 8.207 42.706 ( 12.966 7.919 -2.899) 15.467 44.327 ( 3.026 11.253 7.012) 13.600 46.314 ( 12.905 51.761 -47.056) 71.134 ======================= Grid point 319 (145/355) ======================= q-point: ( 0.17 0.17 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 355 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.994 ( 3.524 0.000 29.289) 29.500 2.970 ( -2.750 -0.000 -3.907) 4.778 3.025 ( 33.143 0.000 14.963) 36.364 3.718 ( 22.462 0.000 -18.053) 28.817 3.875 ( -0.351 -0.000 -7.294) 7.303 4.431 ( 38.549 0.000 16.617) 41.978 4.475 ( 4.084 0.000 18.308) 18.758 6.025 ( -12.610 -0.000 4.477) 13.381 6.544 ( 9.433 0.000 3.666) 10.120 7.043 ( -29.429 -0.000 -3.872) 29.683 7.081 ( -9.494 -0.000 -11.536) 14.940 9.078 ( 3.608 0.000 -7.186) 8.041 9.947 ( -5.063 -0.000 6.336) 8.111 11.336 ( 8.802 0.000 -12.955) 15.663 12.001 ( -33.662 -0.000 23.991) 41.337 12.170 ( -18.635 -0.000 1.409) 18.689 13.288 ( -0.515 -0.000 -2.193) 2.253 13.472 ( -3.168 -0.000 -0.614) 3.227 13.888 ( 10.664 0.000 7.859) 13.247 14.314 ( -1.060 -0.000 8.575) 8.640 14.736 ( 1.955 0.000 1.171) 2.278 15.012 ( -11.604 -0.000 -6.501) 13.302 16.003 ( 5.511 0.000 -0.888) 5.582 17.258 ( 14.756 0.000 -25.328) 29.313 20.629 ( 0.396 0.000 -1.236) 1.298 20.783 ( 2.722 0.000 0.091) 2.724 21.716 ( -1.336 -0.000 -1.271) 1.844 21.829 ( 3.560 0.000 0.549) 3.602 24.637 ( -7.815 -0.000 7.481) 10.819 25.369 ( 0.569 0.000 -0.746) 0.938 32.424 ( 2.035 0.000 0.142) 2.040 32.472 ( 3.151 0.000 -1.056) 3.323 41.860 ( -2.192 -0.000 -2.084) 3.024 44.395 ( 3.702 0.000 -3.977) 5.433 44.482 ( 14.015 0.000 1.878) 14.140 45.023 ( 37.461 0.000 -29.536) 47.704 ======================= Grid point 320 (146/355) ======================= q-point: ( 0.25 0.17 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.225 ( 4.283 -6.202 29.138) 30.096 3.024 ( 3.596 -8.709 -0.983) 9.473 3.347 ( 13.349 -5.824 -8.618) 16.923 3.636 ( 8.771 5.104 -5.687) 11.633 4.130 ( 13.809 -1.666 8.222) 16.158 4.469 ( 0.363 -10.459 3.948) 11.185 5.267 ( 37.749 -22.280 18.562) 47.602 5.804 ( -13.914 8.520 -3.062) 16.600 6.571 ( -12.245 12.533 6.295) 18.618 6.685 ( -2.891 3.683 -0.169) 4.685 7.087 ( -1.989 -11.965 -10.531) 16.063 9.027 ( 1.727 4.644 -8.677) 9.992 9.935 ( -4.159 -0.677 6.261) 7.547 11.299 ( 6.318 7.575 -9.508) 13.700 11.694 ( -19.555 8.656 13.554) 25.319 12.020 ( -22.671 0.871 3.714) 22.990 13.149 ( -4.046 11.563 -5.888) 13.592 13.405 ( 1.175 5.521 1.245) 5.781 13.821 ( 4.482 11.139 6.894) 13.845 14.528 ( -3.735 -15.592 3.420) 16.394 14.746 ( 4.051 -0.643 2.559) 4.835 15.089 ( -11.442 -18.934 -3.022) 22.328 15.974 ( 4.366 7.459 0.819) 8.682 17.258 ( 7.866 0.609 -20.401) 21.874 20.594 ( 0.758 3.691 -0.432) 3.792 20.810 ( 2.802 -0.024 -0.246) 2.813 21.717 ( -0.765 -1.439 -1.532) 2.237 21.880 ( 2.893 -1.929 -0.245) 3.486 24.601 ( -5.762 0.169 7.223) 9.241 25.364 ( 0.068 0.474 -0.999) 1.108 32.441 ( 2.097 0.170 -0.549) 2.174 32.512 ( 3.188 -1.346 -0.858) 3.565 41.874 ( 2.250 -2.000 0.499) 3.052 44.195 ( 14.473 19.676 -3.518) 24.677 44.680 ( 13.591 -5.153 2.522) 14.752 45.518 ( 16.143 -28.639 -26.610) 42.295 ======================= Grid point 321 (147/355) ======================= q-point: ( 0.33 0.17 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.529 ( 4.813 -8.424 27.623) 29.278 3.223 ( 2.390 -4.950 -6.705) 8.670 3.423 ( -11.672 -21.370 -18.755) 30.735 3.836 ( 36.146 4.032 12.169) 38.352 4.153 ( -14.125 -1.503 14.011) 19.952 4.773 ( 5.940 -8.038 -0.504) 10.007 5.488 ( -16.930 4.015 -13.049) 21.749 5.841 ( 3.468 -7.655 20.201) 21.879 6.291 ( -1.795 9.063 4.980) 10.495 6.772 ( 17.016 -5.416 5.868) 18.797 7.305 ( 8.119 -13.861 -11.294) 19.636 8.894 ( 1.093 7.250 -9.712) 12.169 9.948 ( -3.299 -2.009 6.381) 7.459 11.127 ( 2.069 13.820 -3.240) 14.344 11.450 ( -11.333 8.266 1.053) 14.067 11.735 ( -18.712 7.214 3.854) 20.421 12.845 ( -3.478 14.722 -9.131) 17.670 13.275 ( 8.620 15.578 3.481) 18.141 13.874 ( 1.445 -9.871 5.498) 11.391 14.596 ( -2.909 -0.684 -4.027) 5.015 14.952 ( 2.156 -11.119 6.832) 13.227 15.244 ( -14.890 -16.945 -2.265) 22.671 15.893 ( -1.087 5.447 4.282) 7.013 17.213 ( 6.466 3.662 -14.843) 16.599 20.544 ( 0.781 2.729 0.746) 2.935 20.839 ( 2.763 -0.408 -0.484) 2.834 21.718 ( -0.384 -0.144 -1.746) 1.793 21.934 ( 1.507 -1.942 -1.258) 2.761 24.583 ( -4.370 -0.137 7.049) 8.294 25.348 ( -0.017 0.659 -1.639) 1.766 32.459 ( 2.358 -0.219 -1.150) 2.633 32.566 ( 2.575 -1.917 -0.617) 3.269 41.965 ( 4.420 -3.151 3.919) 6.695 44.082 ( 18.461 12.584 -0.491) 22.347 44.906 ( 10.687 -4.826 1.106) 11.778 45.969 ( 4.458 -27.279 -22.628) 35.721 ======================= Grid point 322 (148/355) ======================= q-point: ( 0.42 0.17 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.826 ( 4.749 -6.860 20.061) 21.726 3.172 ( -9.064 -3.872 -13.640) 16.828 3.665 ( 0.295 -12.456 1.449) 12.543 4.048 ( -14.501 -0.547 12.766) 19.327 4.295 ( 25.290 -11.492 3.271) 27.971 4.722 ( -12.811 6.312 7.894) 16.318 5.206 ( -13.509 0.322 -11.462) 17.720 6.111 ( -6.832 11.270 12.393) 18.091 6.185 ( 14.595 -13.360 14.610) 24.596 7.121 ( 13.083 -9.179 -3.456) 16.352 7.535 ( 6.432 -9.180 -11.458) 16.029 8.750 ( 3.378 5.857 -10.544) 12.526 9.995 ( -2.674 -3.466 6.935) 8.201 10.865 ( 1.396 17.708 -1.291) 17.810 11.186 ( -9.730 7.285 -5.983) 13.548 11.513 ( -11.439 4.408 5.326) 13.366 12.538 ( 2.648 15.567 -8.973) 18.163 13.160 ( 11.812 11.744 4.423) 17.234 14.121 ( 1.135 -11.108 3.980) 11.854 14.575 ( -1.232 -4.359 -3.269) 5.587 15.023 ( -3.867 4.333 2.304) 6.248 15.432 ( -15.412 -23.713 -2.034) 28.355 15.808 ( -4.791 3.220 7.270) 9.283 17.131 ( 7.950 7.349 -11.387) 15.713 20.533 ( 0.865 0.204 1.269) 1.549 20.874 ( 2.467 -0.817 -0.576) 2.662 21.699 ( -0.830 0.809 -1.720) 2.074 21.957 ( 0.285 -0.376 -1.250) 1.336 24.580 ( -3.688 -0.390 7.029) 7.948 25.330 ( 0.267 0.502 -2.289) 2.359 32.486 ( 2.535 -0.666 -1.254) 2.906 32.617 ( 1.631 -1.821 -0.401) 2.477 42.085 ( 3.830 -2.949 6.367) 7.994 44.117 ( 20.759 8.079 2.471) 22.412 45.018 ( 3.123 -0.070 -2.913) 4.271 46.345 ( 0.885 -25.902 -16.521) 30.736 ======================= Grid point 323 (149/355) ======================= q-point: ( 0.50 0.17 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.969 ( -1.867 -1.729 0.662) 2.630 3.124 ( -5.790 -4.267 -0.729) 7.229 3.740 ( -11.528 6.884 11.107) 17.426 3.951 ( -5.138 -4.095 2.377) 6.987 4.588 ( -18.825 -5.980 21.509) 29.203 4.786 ( 23.457 -12.750 4.274) 27.038 5.194 ( 2.302 -10.086 -10.586) 14.802 5.907 ( -1.886 13.301 13.430) 18.996 6.619 ( 10.803 -12.355 11.732) 20.174 7.197 ( -6.969 -1.070 -9.735) 12.020 7.581 ( -1.559 1.170 -11.379) 11.545 8.706 ( 8.727 0.291 -12.242) 15.037 10.070 ( -2.247 -4.332 7.359) 8.830 10.587 ( 1.752 16.270 0.018) 16.364 11.004 ( -4.016 2.324 -7.089) 8.472 11.378 ( -8.919 2.655 4.628) 10.393 12.318 ( 10.835 14.207 -6.626) 19.056 13.156 ( 12.268 5.997 4.063) 14.247 14.173 ( -8.067 1.460 0.465) 8.211 14.691 ( -0.829 3.087 -1.899) 3.718 14.901 ( -5.905 -8.388 2.979) 10.682 15.561 ( -11.650 -8.840 -3.650) 15.073 15.868 ( -3.646 -12.103 7.624) 14.761 17.034 ( 10.381 8.782 -9.838) 16.783 20.561 ( 1.072 -1.461 1.370) 2.272 20.907 ( 2.045 -0.635 -0.616) 2.228 21.659 ( -1.873 1.425 -1.533) 2.809 21.946 ( -0.620 0.906 -0.563) 1.233 24.585 ( -3.469 -0.476 7.139) 7.952 25.317 ( 0.697 0.222 -2.738) 2.834 32.517 ( 2.384 -0.599 -1.018) 2.660 32.653 ( 0.691 -1.117 -0.172) 1.325 42.186 ( 1.589 -1.947 7.301) 7.721 44.214 ( 22.234 9.030 3.931) 24.317 44.950 ( -6.028 3.213 -5.469) 8.750 46.703 ( 1.232 -23.217 -12.397) 26.348 ======================= Grid point 324 (150/355) ======================= q-point: (-0.42 0.17 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.954 ( -4.737 -3.187 -3.375) 6.632 3.131 ( -1.284 0.314 2.022) 2.416 3.433 ( -14.031 11.919 6.562) 19.545 4.093 ( 0.584 -6.915 12.413) 14.222 4.718 ( -16.612 -15.313 28.563) 36.418 5.195 ( 19.678 -6.328 3.003) 20.888 5.413 ( 5.816 -16.383 -11.846) 21.037 5.744 ( 5.920 17.100 11.599) 21.494 6.764 ( -14.610 -0.798 -5.192) 15.526 7.144 ( 0.888 -6.208 3.748) 7.306 7.381 ( -7.027 10.056 -10.359) 16.056 8.760 ( 10.229 -1.072 -14.572) 17.836 10.155 ( -1.701 -3.962 6.822) 8.070 10.358 ( 0.001 12.431 1.157) 12.485 10.969 ( 2.530 -2.421 -5.993) 6.941 11.292 ( -7.320 -0.216 3.317) 8.039 12.220 ( 17.768 11.581 -4.225) 21.626 13.222 ( 10.102 1.765 2.497) 10.554 13.968 ( -17.979 6.866 -0.447) 19.251 14.386 ( -13.933 14.503 1.075) 20.140 15.197 ( 5.753 -16.237 -0.343) 17.229 15.591 ( -4.947 -7.670 0.011) 9.127 16.093 ( -3.269 -13.937 3.369) 14.706 16.973 ( 12.225 6.371 -9.032) 16.481 20.609 ( 1.475 -1.891 1.344) 2.749 20.929 ( 1.817 -0.122 -0.567) 1.907 21.604 ( -2.448 1.694 -1.000) 3.141 21.910 ( -1.819 1.746 -0.079) 2.523 24.591 ( -3.488 -0.477 7.335) 8.136 25.311 ( 1.097 0.031 -2.980) 3.176 32.540 ( 1.973 0.119 -0.764) 2.120 32.664 ( -0.042 0.110 0.011) 0.118 42.245 ( -0.983 -0.749 7.186) 7.292 44.227 ( 17.748 16.442 -1.637) 24.249 44.805 ( -8.762 1.216 0.485) 8.860 47.016 ( 2.518 -18.371 -12.427) 22.322 ======================= Grid point 325 (151/355) ======================= q-point: (-0.33 0.17 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.875 ( -3.617 11.206 2.302) 11.998 3.078 ( -4.313 2.684 4.620) 6.867 3.335 ( -1.818 -8.069 6.609) 10.588 4.254 ( -0.615 -4.455 14.717) 15.389 4.967 ( -14.085 -14.186 28.736) 35.006 5.284 ( 10.129 17.897 -2.126) 20.675 5.535 ( 2.368 9.155 -3.943) 10.245 5.784 ( 4.766 -23.699 -3.283) 24.396 6.531 ( -12.449 6.263 -2.375) 14.137 7.059 ( -7.226 13.817 -5.556) 16.552 7.341 ( 5.243 -8.062 3.806) 10.343 8.775 ( 8.547 2.349 -16.359) 18.606 10.154 ( 0.490 8.727 3.196) 9.306 10.259 ( -4.010 -4.528 4.020) 7.262 11.058 ( 5.596 -5.210 -4.071) 8.663 11.287 ( -4.464 -5.162 2.223) 7.178 12.247 ( 22.803 7.550 -2.422) 24.143 13.308 ( 6.053 -1.288 -0.054) 6.188 13.619 ( -23.213 8.289 0.784) 24.661 14.024 ( -15.159 11.369 1.330) 18.995 15.473 ( 6.225 -9.952 -1.630) 11.851 15.715 ( -1.739 -8.893 2.969) 9.535 16.275 ( -1.237 -9.288 0.573) 9.388 16.984 ( 10.719 1.540 -8.748) 13.922 20.659 ( 1.712 -1.211 1.182) 2.407 20.943 ( 1.595 0.299 -0.635) 1.742 21.552 ( -1.669 1.476 0.028) 2.229 21.852 ( -2.871 2.100 -0.051) 3.557 24.598 ( -3.624 -0.562 7.622) 8.458 25.309 ( 1.410 -0.025 -3.085) 3.392 32.543 ( 1.617 1.203 -0.676) 2.125 32.647 ( -0.569 1.611 0.011) 1.708 42.259 ( -3.078 0.341 6.545) 7.241 43.978 ( 3.683 21.131 -10.508) 23.885 44.770 ( -0.422 1.964 10.566) 10.755 47.240 ( 4.123 -11.825 -16.052) 20.359 ======================= Grid point 326 (152/355) ======================= q-point: (-0.25 0.17 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.586 ( -4.663 18.811 9.353) 21.520 3.066 ( 0.090 0.686 6.213) 6.252 3.511 ( 3.160 -1.697 6.552) 7.469 4.338 ( -4.595 2.690 15.052) 15.966 4.832 ( -6.238 14.826 0.581) 16.095 5.262 ( -17.097 -13.444 25.037) 33.165 5.387 ( 10.380 14.496 -13.726) 22.500 6.161 ( 5.128 1.076 3.437) 6.267 6.297 ( -5.708 -0.339 -1.372) 5.880 6.788 ( -3.390 6.679 -2.144) 7.791 7.528 ( 4.964 -6.956 -0.846) 8.588 8.708 ( 7.234 5.203 -16.713) 18.940 10.047 ( -0.818 4.843 3.481) 6.020 10.341 ( -3.384 -7.428 3.612) 8.926 11.197 ( 5.912 -6.411 -2.867) 9.180 11.406 ( -1.333 -11.218 1.902) 11.456 12.399 ( 25.309 2.582 -0.968) 25.459 13.306 ( -18.794 1.931 1.422) 18.946 13.353 ( -6.897 -2.463 -1.361) 7.449 13.763 ( -5.957 5.579 2.033) 8.411 15.641 ( 4.044 -4.231 -0.533) 5.877 15.837 ( -0.883 -4.744 3.929) 6.222 16.378 ( 1.037 -3.137 -1.094) 3.481 17.029 ( 4.078 -2.148 -9.710) 10.749 20.688 ( 1.268 0.225 0.932) 1.590 20.933 ( -0.589 1.412 -1.695) 2.284 21.536 ( 1.888 0.476 1.720) 2.598 21.793 ( -2.320 1.340 -0.195) 2.686 24.609 ( -3.889 -0.966 8.061) 9.002 25.311 ( 1.652 -0.042 -3.075) 3.491 32.526 ( 1.448 2.275 -0.712) 2.789 32.601 ( -0.807 2.877 -0.266) 3.000 42.237 ( -4.325 1.083 5.658) 7.204 43.566 ( -2.730 20.775 -12.427) 24.361 44.776 ( 3.148 6.590 13.938) 15.735 47.331 ( 5.740 -3.236 -22.593) 23.534 ======================= Grid point 327 (153/355) ======================= q-point: (-0.17 0.17 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.279 ( -4.050 18.949 15.555) 24.848 3.084 ( 6.374 5.338 6.340) 10.456 3.296 ( -4.521 29.210 1.751) 29.610 4.217 ( -10.670 2.358 12.758) 16.798 4.779 ( 4.318 1.049 0.118) 4.445 5.102 ( 4.324 19.780 -2.931) 20.459 5.383 ( -8.074 1.205 22.216) 23.669 5.819 ( 4.476 28.593 8.164) 30.071 6.322 ( -8.528 -0.046 -2.708) 8.948 6.889 ( -4.699 -21.002 -4.062) 21.901 7.639 ( 4.094 -2.505 -9.188) 10.366 8.638 ( 7.684 2.157 -12.938) 15.202 10.006 ( -1.912 1.218 4.991) 5.482 10.496 ( -0.922 -12.516 2.983) 12.899 11.369 ( 6.102 -7.918 -0.386) 10.004 11.641 ( -1.019 -17.112 1.777) 17.234 12.598 ( 15.683 0.194 0.444) 15.691 13.235 ( -14.560 -2.228 4.872) 15.514 13.267 ( -5.625 -10.219 -3.883) 12.294 13.772 ( 8.138 -2.122 2.130) 8.675 15.678 ( 2.421 3.376 0.520) 4.187 15.869 ( -4.907 1.069 3.407) 6.069 16.386 ( 2.544 4.016 -1.435) 4.966 17.022 ( -3.817 -2.613 -11.590) 12.479 20.684 ( -0.166 1.378 0.659) 1.536 20.861 ( -3.203 3.265 -2.625) 5.274 21.591 ( 5.131 -0.849 2.519) 5.778 21.775 ( 1.409 -0.390 -0.426) 1.523 24.629 ( -4.494 -1.928 8.656) 9.942 25.316 ( 1.835 -0.142 -2.897) 3.432 32.491 ( 0.946 2.997 -0.601) 3.200 32.540 ( -0.097 3.328 -0.801) 3.425 42.195 ( -4.859 1.108 4.593) 6.777 43.164 ( -0.286 17.554 -10.461) 20.436 44.727 ( 3.599 10.881 13.628) 17.807 47.230 ( 6.927 8.984 -31.305) 33.297 ======================= Grid point 328 (154/355) ======================= q-point: (-0.08 0.17 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.028 ( -2.965 16.663 22.204) 27.919 2.652 ( -0.258 37.905 7.226) 38.588 3.107 ( 10.831 6.478 1.861) 12.757 4.137 ( -9.146 4.000 0.018) 9.983 4.580 ( 12.375 27.262 4.050) 30.212 4.839 ( 12.617 30.104 14.013) 35.522 5.137 ( -2.934 27.561 11.128) 29.867 5.684 ( -12.131 -10.315 11.551) 19.672 6.260 ( -6.628 -5.623 -2.207) 8.968 7.161 ( -12.587 -22.299 -5.214) 26.132 7.592 ( 2.718 4.550 -15.972) 16.829 8.703 ( 8.431 -5.257 -7.267) 12.309 9.999 ( -3.310 -0.098 6.128) 6.965 10.765 ( 2.564 -16.886 -0.392) 17.084 11.580 ( 1.259 -11.398 5.858) 12.877 11.970 ( -2.562 -22.714 3.045) 23.060 12.724 ( 2.285 -5.997 3.320) 7.225 13.139 ( -12.238 -5.382 -2.634) 13.626 13.545 ( 9.263 -12.831 1.483) 15.895 13.976 ( 16.584 -6.881 2.390) 18.113 15.607 ( -1.679 6.341 -0.120) 6.561 15.681 ( -10.974 12.159 1.601) 16.458 16.240 ( -2.834 14.217 -1.063) 14.536 16.981 ( 1.134 -3.035 -12.467) 12.881 20.643 ( -3.221 1.488 0.029) 3.548 20.773 ( -0.503 2.965 -1.276) 3.267 21.657 ( 2.438 -1.294 1.364) 3.079 21.830 ( 6.839 -0.627 -1.445) 7.018 24.662 ( -5.951 -3.228 9.022) 11.279 25.327 ( 1.910 -0.353 -2.462) 3.136 32.442 ( 0.019 2.821 -0.299) 2.837 32.490 ( 1.748 2.932 -1.145) 3.601 42.142 ( -6.624 0.752 2.551) 7.138 42.949 ( 12.279 8.085 -5.661) 15.754 44.617 ( 4.072 13.267 11.063) 17.748 46.854 ( 8.249 26.279 -39.140) 47.860 ======================= Grid point 332 (155/355) ======================= q-point: ( 0.25 0.25 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 354 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.356 ( 6.608 0.000 27.240) 28.030 3.009 ( 6.167 0.000 4.125) 7.419 3.115 ( -10.031 -0.000 -28.044) 29.784 4.009 ( 30.493 0.000 15.865) 34.373 4.255 ( -17.462 -0.000 8.014) 19.213 4.445 ( 30.330 0.000 -2.222) 30.411 5.461 ( 10.987 0.000 7.833) 13.494 5.694 ( -8.363 -0.000 -0.341) 8.370 6.639 ( -15.476 -0.000 7.905) 17.378 6.727 ( 4.245 0.000 7.680) 8.775 6.936 ( 17.928 0.000 -15.575) 23.748 9.029 ( -0.416 -0.000 -10.181) 10.190 9.918 ( -3.733 -0.000 6.253) 7.283 11.385 ( 6.954 0.000 -10.951) 12.973 11.631 ( -24.762 -0.000 19.894) 31.764 11.807 ( -16.305 -0.000 -3.327) 16.641 13.265 ( 0.482 0.000 -2.464) 2.510 13.314 ( -11.104 -0.000 -0.756) 11.130 14.150 ( 6.911 0.000 10.544) 12.607 14.309 ( -2.287 -0.000 2.346) 3.276 14.694 ( -12.436 -0.000 -9.823) 15.847 14.853 ( 3.445 0.000 5.694) 6.656 16.095 ( 3.978 0.000 0.434) 4.001 17.206 ( 2.707 0.000 -20.274) 20.453 20.643 ( 2.097 0.000 -1.336) 2.487 20.836 ( 2.893 0.000 -0.741) 2.987 21.686 ( -0.792 -0.000 -0.638) 1.017 21.897 ( 2.872 0.000 0.282) 2.886 24.581 ( -4.770 -0.000 6.982) 8.456 25.361 ( -0.508 -0.000 -1.048) 1.165 32.461 ( 1.942 0.000 -0.670) 2.054 32.529 ( 3.327 0.000 -0.939) 3.457 41.910 ( 6.146 0.000 3.812) 7.232 44.462 ( 6.049 0.000 -3.055) 6.777 44.788 ( 14.247 0.000 2.381) 14.444 45.331 ( 20.387 0.000 -25.157) 32.381 ======================= Grid point 333 (156/355) ======================= q-point: ( 0.33 0.25 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.595 ( 6.163 -5.111 27.776) 28.907 2.950 ( -9.840 -6.531 -23.073) 25.920 3.187 ( 9.409 -8.504 5.866) 13.973 4.065 ( -17.221 2.870 7.819) 19.130 4.357 ( 32.814 5.607 12.044) 35.401 4.741 ( 14.222 -4.833 -1.809) 15.129 5.267 ( -23.823 1.623 -10.972) 26.278 5.854 ( 2.699 -6.164 17.503) 18.752 6.391 ( -11.933 8.391 2.241) 14.758 6.949 ( 24.268 -1.667 6.131) 25.086 7.181 ( 19.545 -9.741 -10.735) 24.334 8.935 ( -1.782 3.645 -11.218) 11.929 9.920 ( -3.153 -0.999 6.238) 7.061 11.297 ( -3.822 8.727 -0.491) 9.540 11.484 ( -6.511 4.238 1.438) 7.900 11.616 ( -19.169 1.669 0.446) 19.247 12.995 ( -5.893 13.216 -4.084) 15.036 13.414 ( -0.615 -7.023 0.667) 7.081 13.992 ( 6.337 15.743 5.908) 17.970 14.485 ( -2.131 -9.702 0.997) 9.983 14.644 ( -12.519 -12.773 -5.864) 18.822 14.981 ( -1.425 -8.032 4.285) 9.214 16.047 ( 1.535 8.913 2.581) 9.406 17.171 ( 1.603 -3.490 -16.848) 17.280 20.623 ( 2.302 3.857 -0.521) 4.522 20.863 ( 3.070 -0.124 -1.093) 3.261 21.689 ( -0.804 -1.114 -0.791) 1.585 21.931 ( 2.226 -0.706 -0.071) 2.337 24.571 ( -3.864 -0.137 6.875) 7.888 25.346 ( -0.610 0.339 -1.538) 1.689 32.476 ( 2.188 -0.002 -1.039) 2.423 32.565 ( 2.815 -0.958 -0.742) 3.065 42.019 ( 7.625 -0.993 7.720) 10.896 44.409 ( 9.810 9.457 -0.895) 13.655 44.991 ( 15.661 -3.289 0.280) 16.005 45.540 ( 8.430 -16.757 -21.637) 28.636 ======================= Grid point 334 (157/355) ======================= q-point: ( 0.42 0.25 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.860 ( 0.865 -5.451 14.683) 15.686 2.913 ( -3.586 -8.100 -4.335) 9.862 3.508 ( 9.293 -13.039 7.362) 17.623 3.901 ( -17.738 -0.563 7.748) 19.364 4.554 ( 17.486 7.541 0.831) 19.061 4.809 ( 2.468 5.664 8.796) 10.749 5.007 ( -13.273 -1.546 -6.556) 14.884 6.129 ( 5.568 -12.863 15.094) 20.598 6.178 ( -10.893 3.368 2.026) 11.580 7.208 ( 19.784 1.347 -3.330) 20.107 7.468 ( 15.771 -6.401 -7.907) 18.767 8.793 ( -1.209 4.129 -12.030) 12.776 9.949 ( -2.643 -2.527 6.726) 7.656 11.090 ( -6.939 9.430 3.263) 12.154 11.242 ( -4.679 13.449 -8.511) 16.589 11.467 ( -10.230 0.965 3.140) 10.744 12.741 ( 0.227 10.877 -4.770) 11.879 13.469 ( 6.995 5.612 2.444) 9.295 13.980 ( 4.540 -5.072 5.534) 8.773 14.489 ( -5.161 -0.272 -4.743) 7.015 14.848 ( -13.437 -25.429 -3.005) 28.917 15.044 ( -3.900 -0.262 1.323) 4.127 15.897 ( -3.370 9.131 6.746) 11.843 17.178 ( 3.842 -1.757 -13.955) 14.581 20.580 ( 1.963 3.201 0.560) 3.796 20.891 ( 3.093 -0.186 -1.174) 3.314 21.686 ( -1.195 -0.027 -0.913) 1.504 21.958 ( 1.326 -0.327 -0.285) 1.395 24.571 ( -3.336 -0.312 6.901) 7.672 25.327 ( -0.248 0.334 -2.153) 2.193 32.498 ( 2.571 -0.397 -1.070) 2.813 32.606 ( 1.920 -1.302 -0.523) 2.378 42.147 ( 6.394 -0.500 10.163) 12.017 44.406 ( 12.631 4.584 3.245) 13.823 45.119 ( 12.771 4.969 -7.038) 15.405 45.847 ( 0.772 -24.855 -14.136) 28.604 ======================= Grid point 335 (158/355) ======================= q-point: ( 0.50 0.25 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.874 ( -4.406 -2.823 -4.057) 6.622 3.102 ( 4.532 -2.802 13.213) 14.246 3.774 ( -6.917 -1.171 12.841) 14.633 3.822 ( -2.420 -6.552 5.157) 8.682 4.454 ( -16.244 4.465 13.076) 21.325 4.803 ( 4.520 -8.229 -2.296) 9.665 5.107 ( 14.527 -2.361 1.173) 14.764 6.048 ( -6.067 -0.221 5.438) 8.151 6.511 ( 4.317 -14.122 9.589) 17.607 7.189 ( 1.915 10.274 -8.746) 13.628 7.592 ( 7.698 1.779 -8.702) 11.754 8.701 ( 2.673 -0.304 -13.859) 14.117 10.012 ( -2.358 -3.858 7.468) 8.730 10.862 ( -3.263 13.936 3.020) 14.628 10.998 ( -1.428 5.691 -7.307) 9.371 11.358 ( -7.173 3.053 2.099) 8.073 12.596 ( 8.560 9.445 -3.524) 13.225 13.439 ( 11.608 9.335 2.932) 15.182 14.106 ( -6.264 -0.602 2.100) 6.634 14.524 ( -0.515 -14.837 -2.127) 14.997 14.891 ( -9.059 7.843 -2.320) 12.205 15.140 ( -8.998 -21.298 -4.447) 23.545 15.786 ( -5.766 1.561 9.790) 11.469 17.163 ( 6.523 2.435 -12.641) 14.431 20.569 ( 1.408 0.614 1.207) 1.953 20.918 ( 2.449 -0.248 -1.197) 2.737 21.659 ( -1.285 1.208 -0.409) 1.811 21.962 ( 0.448 0.863 -0.143) 0.983 24.577 ( -3.152 -0.387 7.032) 7.716 25.312 ( 0.317 0.094 -2.631) 2.652 32.529 ( 2.627 -0.571 -0.725) 2.785 32.640 ( 1.010 -1.189 -0.294) 1.588 42.245 ( 3.754 0.689 10.663) 11.326 44.525 ( 14.024 0.885 7.868) 16.104 45.007 ( 3.816 11.948 -13.233) 18.233 46.240 ( 0.790 -26.507 -9.215) 28.074 ======================= Grid point 336 (159/355) ======================= q-point: (-0.42 0.25 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.871 ( 0.127 -1.073 1.847) 2.140 3.197 ( 5.954 1.951 6.009) 8.681 3.580 ( -7.918 12.630 1.969) 15.036 4.040 ( 2.309 -7.926 17.094) 18.983 4.411 ( -21.705 -12.157 27.705) 37.235 5.089 ( 6.860 -14.918 -5.030) 17.173 5.252 ( 4.851 -6.375 -3.715) 8.830 6.158 ( 16.180 -0.622 10.472) 19.283 6.544 ( -20.470 7.654 -7.762) 23.192 7.062 ( 3.175 -4.357 -0.186) 5.395 7.478 ( -1.185 10.486 -7.255) 12.806 8.720 ( 5.481 -4.117 -16.599) 17.959 10.092 ( -2.407 -4.297 7.320) 8.823 10.608 ( -1.289 14.889 2.765) 15.198 10.948 ( 4.069 -0.620 -4.914) 6.410 11.252 ( -6.210 2.253 1.765) 6.838 12.556 ( 15.476 8.525 -1.826) 17.763 13.423 ( 10.943 7.611 1.624) 13.428 13.911 ( -16.366 7.796 -0.377) 18.132 14.537 ( -9.168 16.526 -1.831) 18.987 14.915 ( 2.201 -22.297 1.259) 22.441 15.343 ( -5.181 -14.556 -5.720) 16.476 15.853 ( -5.409 -10.660 8.097) 14.438 17.115 ( 7.590 4.641 -12.265) 15.152 20.597 ( 1.120 -1.552 1.630) 2.514 20.936 ( 1.341 -0.320 -1.287) 1.886 21.622 ( -0.343 2.135 0.582) 2.239 21.935 ( -0.605 2.226 -0.039) 2.307 24.584 ( -3.172 -0.362 7.222) 7.897 25.306 ( 0.841 -0.146 -2.911) 3.033 32.559 ( 2.275 -0.181 -0.282) 2.300 32.661 ( 0.282 -0.576 -0.111) 0.651 42.295 ( 1.058 1.809 10.069) 10.285 44.667 ( 16.131 16.920 -5.776) 24.080 44.737 ( -6.408 -0.569 1.821) 6.686 46.635 ( 2.364 -23.341 -9.511) 25.315 ======================= Grid point 337 (160/355) ======================= q-point: (-0.33 0.25 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.940 ( 4.932 -0.734 4.909) 6.997 3.237 ( 4.839 7.573 4.989) 10.279 3.335 ( 0.705 5.774 6.406) 8.653 4.241 ( -0.985 -4.679 18.122) 18.742 4.624 ( -19.075 -19.446 30.282) 40.731 5.295 ( -5.131 -15.665 -6.536) 17.732 5.438 ( 6.523 -5.437 -9.441) 12.698 5.946 ( -14.221 23.218 -5.540) 27.784 6.478 ( 12.512 -6.226 6.122) 15.258 7.197 ( -6.449 13.760 -5.191) 16.058 7.253 ( 5.151 -9.395 2.031) 10.905 8.753 ( 4.277 -2.823 -18.631) 19.322 10.165 ( -3.310 -3.927 5.743) 7.705 10.372 ( -0.450 13.521 3.097) 13.878 11.027 ( 6.571 -3.528 -2.448) 7.850 11.196 ( -4.057 -1.618 1.254) 4.544 12.596 ( 19.634 7.050 -0.678) 20.872 13.401 ( 4.545 5.335 -1.882) 7.257 13.567 ( -18.020 11.393 1.553) 21.376 14.146 ( -8.398 16.772 -0.257) 18.759 15.299 ( 3.895 -17.826 0.093) 18.247 15.507 ( -2.526 -12.320 -1.527) 12.668 16.054 ( -4.008 -14.450 3.443) 15.385 17.052 ( 4.968 3.702 -12.097) 13.592 20.650 ( 0.966 -2.188 1.853) 3.026 20.943 ( 0.119 -0.333 -1.504) 1.545 21.594 ( 1.891 2.468 1.829) 3.608 21.877 ( -1.462 3.160 -0.239) 3.490 24.591 ( -3.286 -0.317 7.443) 8.142 25.306 ( 1.222 -0.254 -3.040) 3.287 32.575 ( 1.778 0.634 0.033) 1.888 32.661 ( -0.242 0.592 -0.137) 0.654 42.301 ( -1.048 2.684 9.076) 9.522 44.267 ( -4.342 20.184 -17.006) 26.748 44.879 ( 7.424 0.176 15.178) 16.898 46.964 ( 4.392 -17.655 -12.860) 22.279 ======================= Grid point 338 (161/355) ======================= q-point: (-0.25 0.25 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.890 ( 0.872 15.002 6.140) 16.233 3.172 ( 7.454 2.860 8.583) 11.722 3.519 ( 10.910 -7.136 9.471) 16.114 4.343 ( -5.277 -2.333 16.365) 17.352 4.897 ( -17.088 -15.562 25.217) 34.206 5.060 ( -20.065 18.783 -7.052) 28.375 5.544 ( 5.774 -4.171 -9.264) 11.686 5.756 ( -7.454 -15.650 -6.697) 18.583 6.643 ( 14.758 10.294 6.143) 19.013 6.895 ( -6.508 10.753 0.893) 12.601 7.471 ( 8.768 -7.516 -0.019) 11.549 8.721 ( 2.766 0.167 -19.615) 19.810 10.173 ( -2.952 6.529 3.668) 8.049 10.228 ( -1.487 -1.174 3.536) 4.012 11.147 ( 5.160 -4.688 -0.707) 7.008 11.254 ( -0.233 -6.990 0.830) 7.043 12.693 ( 16.450 4.316 0.408) 17.012 13.187 ( -17.038 4.908 -5.115) 18.454 13.347 ( -0.258 9.221 4.097) 10.094 13.879 ( 2.014 9.533 0.168) 9.745 15.563 ( 3.564 -9.329 0.024) 9.986 15.687 ( -3.475 -11.815 1.675) 12.428 16.259 ( -1.101 -11.457 0.585) 11.525 16.973 ( -1.771 1.442 -11.743) 11.963 20.694 ( -0.055 -1.142 1.753) 2.093 20.927 ( -1.540 0.709 -1.969) 2.598 21.603 ( 4.681 1.582 2.840) 5.699 21.812 ( -0.342 2.633 -0.591) 2.720 24.598 ( -3.463 -0.376 7.697) 8.449 25.310 ( 1.467 -0.264 -3.063) 3.406 32.572 ( 1.167 1.630 0.142) 2.010 32.635 ( -0.274 1.976 -0.454) 2.046 42.271 ( -2.390 3.279 7.854) 8.841 43.801 ( -5.619 19.619 -15.877) 25.856 44.982 ( 5.289 4.053 16.220) 17.535 47.181 ( 6.181 -9.987 -18.000) 21.493 ======================= Grid point 339 (162/355) ======================= q-point: (-0.17 0.25 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.641 ( 0.155 18.580 11.749) 21.984 3.270 ( 11.279 2.767 5.791) 12.977 3.662 ( 4.552 11.785 6.482) 14.200 4.263 ( -11.755 9.813 8.490) 17.509 4.679 ( -7.099 -6.056 6.622) 11.442 5.169 ( -13.767 -16.077 20.574) 29.518 5.442 ( 6.684 14.671 -7.281) 17.690 5.992 ( -14.581 -20.234 -7.893) 26.159 6.462 ( -0.043 15.104 0.047) 15.104 6.738 ( 6.183 14.292 8.465) 17.724 7.655 ( 11.380 -2.041 -2.989) 11.941 8.643 ( 2.478 0.616 -18.326) 18.502 10.066 ( -1.251 4.924 4.640) 6.880 10.306 ( -2.339 -8.745 1.884) 9.247 11.300 ( 5.337 -7.298 0.928) 9.089 11.400 ( -0.929 -10.556 0.019) 10.597 12.685 ( -6.446 3.120 2.298) 7.521 13.021 ( -12.760 -2.634 -8.681) 15.656 13.299 ( 18.138 3.445 6.785) 19.669 13.864 ( 10.623 1.316 0.125) 10.705 15.689 ( 0.410 -2.851 1.117) 3.089 15.804 ( -5.488 -5.347 1.854) 7.883 16.409 ( 2.413 -5.061 -0.097) 5.607 16.855 ( -9.734 -0.799 -10.679) 14.472 20.691 ( -2.916 0.668 1.116) 3.193 20.874 ( -1.255 2.447 -1.628) 3.196 21.641 ( 2.486 0.527 1.910) 3.179 21.808 ( 6.045 0.188 -0.565) 6.074 24.606 ( -3.783 -0.651 7.980) 8.855 25.316 ( 1.603 -0.300 -2.956) 3.376 32.541 ( -0.206 2.670 -0.063) 2.679 32.594 ( 1.138 2.814 -0.776) 3.133 42.218 ( -3.257 3.569 6.209) 7.868 43.390 ( -1.231 16.297 -12.708) 20.703 44.994 ( 3.174 8.164 15.415) 17.730 47.237 ( 6.804 -0.026 -24.182) 25.120 ======================= Grid point 340 (163/355) ======================= q-point: (-0.08 0.25 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.402 ( 0.489 18.040 17.902) 25.419 3.204 ( -0.770 23.336 -0.599) 23.356 3.395 ( 12.842 13.196 5.718) 19.281 4.147 ( -3.475 3.238 9.832) 10.919 4.802 ( -4.776 -3.759 -1.468) 6.253 5.220 ( 4.797 16.319 7.018) 18.401 5.369 ( -8.681 -8.542 19.212) 22.747 5.897 ( -12.336 5.034 -7.711) 15.394 6.234 ( 4.907 19.470 6.414) 21.078 6.681 ( -6.514 -7.858 -1.047) 10.260 7.695 ( 9.389 6.994 -8.630) 14.544 8.634 ( 4.095 -5.155 -12.920) 14.501 10.019 ( -1.792 2.216 5.662) 6.339 10.505 ( 0.376 -15.444 0.621) 15.461 11.466 ( 1.020 -6.616 3.288) 7.458 11.613 ( -2.302 -17.238 -0.217) 17.393 12.610 ( -8.771 -4.347 2.125) 10.018 12.912 ( -11.166 -4.826 -6.037) 13.580 13.588 ( 23.924 -4.135 3.461) 24.524 14.029 ( 15.319 -5.942 0.557) 16.440 15.630 ( -11.306 6.540 -0.332) 13.066 15.778 ( -2.269 2.860 2.749) 4.570 16.401 ( -3.023 8.496 -0.699) 9.045 16.796 ( -4.594 -9.402 -7.726) 13.008 20.630 ( -4.969 1.716 0.358) 5.269 20.822 ( 1.053 2.925 -0.369) 3.130 21.657 ( 0.444 -0.745 0.457) 0.980 21.894 ( 8.773 -0.597 -1.807) 8.978 24.617 ( -4.440 -1.075 8.162) 9.353 25.325 ( 1.604 -0.457 -2.646) 3.128 32.486 ( -0.574 2.934 -0.518) 3.034 32.559 ( 2.428 3.052 -0.762) 3.974 42.141 ( -4.465 3.949 3.568) 6.947 43.165 ( 9.208 8.327 -7.519) 14.515 44.920 ( 2.480 11.518 12.958) 17.514 47.077 ( 6.213 12.557 -30.073) 33.176 ======================= Grid point 345 (164/355) ======================= q-point: ( 0.33 0.33 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 355 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.742 ( 5.025 0.000 29.479) 29.904 2.744 ( -3.455 -0.000 -16.103) 16.469 3.244 ( 10.710 0.000 7.809) 13.254 3.938 ( -17.942 -0.000 3.485) 18.278 4.743 ( 27.930 0.000 12.113) 30.444 4.880 ( 15.233 0.000 -4.609) 15.915 4.988 ( -24.064 -0.000 -8.158) 25.410 5.858 ( -4.639 -0.000 17.279) 17.890 6.316 ( -17.830 -0.000 1.503) 17.893 7.258 ( 30.978 0.000 5.669) 31.492 7.279 ( 26.084 0.000 -12.920) 29.109 8.880 ( -4.127 -0.000 -12.324) 12.997 9.909 ( -2.902 -0.000 5.920) 6.593 11.350 ( -20.233 -0.000 15.899) 25.733 11.359 ( -4.908 -0.000 -7.953) 9.346 11.534 ( -1.201 -0.000 -7.542) 7.637 13.072 ( -11.098 -0.000 -0.759) 11.124 13.269 ( 2.133 0.000 -1.967) 2.902 14.282 ( -0.751 -0.000 -2.499) 2.609 14.318 ( -9.690 -0.000 2.115) 9.918 14.386 ( 1.812 0.000 -3.237) 3.710 14.921 ( -2.357 -0.000 6.508) 6.922 16.168 ( 2.121 0.000 1.937) 2.872 17.050 ( -0.699 -0.000 -15.522) 15.537 20.682 ( 2.776 0.000 -1.158) 3.008 20.884 ( 2.875 0.000 -1.638) 3.309 21.674 ( -0.244 -0.000 0.315) 0.398 21.946 ( 1.881 0.000 -0.246) 1.897 24.565 ( -3.312 -0.000 6.828) 7.589 25.334 ( -0.782 -0.000 -1.801) 1.963 32.492 ( 2.053 0.000 -1.045) 2.304 32.582 ( 2.642 0.000 -0.696) 2.732 42.141 ( 8.384 0.000 12.209) 14.811 44.573 ( 6.762 0.000 -1.134) 6.856 45.073 ( 11.725 0.000 1.727) 11.851 45.429 ( 12.126 0.000 -21.696) 24.855 ======================= Grid point 346 (165/355) ======================= q-point: ( 0.42 0.33 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.719 ( 1.885 -3.749 -6.882) 8.061 2.950 ( 1.287 -4.193 30.369) 30.684 3.466 ( 11.011 -8.105 8.052) 15.867 3.779 ( -12.897 0.976 2.844) 13.243 4.698 ( -14.195 4.915 -4.852) 15.786 4.887 ( -2.410 7.827 -0.567) 8.209 5.073 ( 24.137 -1.971 8.245) 25.583 5.991 ( -4.604 -10.658 14.450) 18.536 6.104 ( -14.063 2.601 -0.150) 14.302 7.466 ( 25.399 3.261 -9.241) 27.224 7.569 ( 21.290 -0.877 -2.188) 21.421 8.753 ( -5.175 1.916 -13.051) 14.170 9.919 ( -2.629 -1.431 6.091) 6.787 11.131 ( -11.472 6.549 3.629) 13.699 11.284 ( -14.585 1.173 1.267) 14.687 11.474 ( 5.812 5.223 -6.780) 10.345 12.871 ( -3.517 8.146 -1.273) 8.964 13.411 ( 0.326 -10.720 -0.160) 10.727 14.154 ( 5.930 8.208 -0.805) 10.158 14.298 ( -13.443 -12.315 -9.033) 20.346 14.464 ( -1.300 -2.368 3.595) 4.497 14.967 ( -4.153 -4.456 4.340) 7.480 16.085 ( -0.736 11.088 3.971) 11.801 17.053 ( 1.412 -6.960 -13.410) 15.174 20.668 ( 2.440 3.779 -0.488) 4.524 20.909 ( 2.791 -0.509 -1.877) 3.402 21.676 ( -0.287 -0.023 0.529) 0.602 21.963 ( 1.224 -0.367 -0.496) 1.371 24.567 ( -2.950 -0.153 6.892) 7.498 25.316 ( -0.469 0.108 -2.251) 2.301 32.511 ( 2.220 -0.362 -0.914) 2.428 32.608 ( 1.945 -0.548 -0.574) 2.101 42.277 ( 6.612 0.801 15.066) 16.473 44.582 ( 7.062 4.346 1.848) 8.495 45.292 ( 15.247 -4.140 -2.309) 15.967 45.466 ( 2.598 -8.909 -18.080) 20.322 ======================= Grid point 347 (166/355) ======================= q-point: ( 0.50 0.33 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.814 ( 5.417 -3.513 1.889) 6.727 3.169 ( 1.392 -4.960 24.114) 24.658 3.665 ( -10.130 -2.825 8.173) 13.319 3.782 ( 7.976 -6.993 7.495) 12.989 4.525 ( -6.103 5.797 2.086) 8.672 4.672 ( -8.099 3.948 4.036) 9.873 5.330 ( 18.363 2.949 2.853) 18.815 5.867 ( -17.206 -4.191 -2.560) 17.894 6.331 ( 0.793 -15.856 10.454) 19.008 7.465 ( 10.296 15.890 -5.343) 19.673 7.701 ( 14.403 2.779 -9.722) 17.598 8.626 ( -3.174 -0.472 -14.674) 15.021 9.963 ( -2.475 -3.120 7.067) 8.111 10.950 ( -7.600 5.401 2.176) 9.574 11.095 ( -6.368 6.839 -0.756) 9.375 11.400 ( 3.024 6.398 -3.827) 8.045 12.768 ( 4.355 4.604 -0.374) 6.348 13.567 ( 1.198 -5.449 0.265) 5.585 14.145 ( 4.194 5.463 2.396) 7.292 14.275 ( -7.563 -8.378 -5.340) 12.486 14.597 ( -6.375 -17.713 -5.766) 19.689 14.975 ( -3.691 0.483 0.824) 3.812 15.883 ( -4.771 11.103 8.014) 14.500 17.134 ( 4.564 -4.980 -12.720) 14.403 20.624 ( 1.654 3.369 0.589) 3.799 20.932 ( 2.079 -0.147 -1.984) 2.878 21.671 ( 0.013 0.757 0.975) 1.235 21.973 ( 0.435 0.067 -0.576) 0.725 24.574 ( -2.826 -0.235 7.039) 7.589 25.302 ( 0.114 -0.043 -2.666) 2.669 32.540 ( 2.228 -0.742 -0.506) 2.402 32.632 ( 1.127 -0.805 -0.431) 1.451 42.372 ( 3.735 2.455 15.429) 16.064 44.630 ( 4.891 -0.486 6.080) 7.818 45.248 ( 9.935 13.074 -17.102) 23.709 45.784 ( 3.164 -25.132 -4.690) 25.761 ======================= Grid point 348 (167/355) ======================= q-point: (-0.42 -0.67 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.937 ( 8.477 -0.082 8.022) 11.671 3.351 ( 8.919 0.073 13.453) 16.142 3.603 ( -10.101 0.475 1.007) 10.162 4.024 ( -0.154 -9.667 21.729) 23.783 4.298 ( -8.731 10.822 17.366) 22.246 4.848 ( 5.816 -18.273 -1.460) 19.231 5.274 ( -3.171 8.519 -2.748) 9.496 5.939 ( -9.772 -16.387 -6.260) 20.080 6.563 ( -2.703 -5.687 7.717) 9.960 7.204 ( 6.637 16.068 -2.440) 17.555 7.637 ( 5.254 11.037 -9.951) 15.762 8.592 ( 0.737 -5.186 -17.716) 18.474 10.033 ( -2.680 -3.997 7.730) 9.106 10.785 ( -7.073 8.305 4.393) 11.760 10.991 ( 4.024 2.104 -3.270) 5.595 11.290 ( 0.845 7.008 -1.861) 7.300 12.777 ( 9.486 3.508 1.193) 10.184 13.589 ( -1.251 2.517 -2.525) 3.778 13.966 ( -4.561 11.477 1.874) 12.491 14.531 ( 1.803 -21.322 -0.113) 21.399 14.676 ( -6.050 4.180 -6.955) 10.122 15.003 ( -1.422 -13.864 -4.398) 14.614 15.753 ( -6.479 1.473 10.236) 12.203 17.167 ( 5.829 0.561 -13.036) 14.291 20.606 ( 0.793 0.689 1.643) 1.950 20.936 ( 0.652 0.051 -2.095) 2.195 21.665 ( 1.458 1.455 1.878) 2.788 21.960 ( -0.351 1.314 -0.665) 1.514 24.582 ( -2.870 -0.231 7.232) 7.784 25.296 ( 0.696 -0.281 -2.942) 3.037 32.572 ( 1.827 -0.684 0.011) 1.951 32.652 ( 0.453 -0.765 -0.299) 0.938 42.412 ( 1.117 3.773 14.348) 14.877 44.686 ( -5.090 0.870 1.373) 5.343 45.028 ( 10.708 13.144 -9.510) 19.439 46.227 ( 5.627 -24.729 -6.150) 26.096 ======================= Grid point 349 (168/355) ======================= q-point: (-0.33 -0.67 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.072 ( 12.115 1.136 10.274) 15.926 3.427 ( 1.988 7.101 2.554) 7.804 3.499 ( 6.390 4.248 5.088) 9.207 4.246 ( -15.734 -7.785 28.000) 33.048 4.312 ( 2.408 -7.858 23.900) 25.274 5.064 ( -5.303 -1.722 -7.426) 9.286 5.268 ( 4.470 -16.069 -2.708) 16.897 5.822 ( -31.348 2.756 -13.551) 34.262 6.677 ( 13.631 -3.305 9.660) 17.030 7.137 ( -4.844 1.701 1.875) 5.465 7.434 ( 12.742 11.850 -9.295) 19.727 8.611 ( 0.428 -5.782 -20.145) 20.963 10.101 ( -3.564 -3.367 7.132) 8.655 10.583 ( -4.186 10.913 3.861) 12.310 11.049 ( 7.642 -2.256 -1.442) 8.097 11.186 ( -0.067 4.572 -0.874) 4.655 12.830 ( 9.890 3.455 2.635) 10.802 13.409 ( -15.224 6.587 -6.352) 17.763 13.779 ( 7.794 13.591 4.186) 16.217 14.385 ( -2.117 17.690 -3.836) 18.224 14.937 ( -1.535 -24.981 0.759) 25.040 15.263 ( 2.611 -16.130 -5.829) 17.349 15.804 ( -6.345 -9.726 7.507) 13.827 17.107 ( 3.435 4.831 -13.210) 14.479 20.630 ( 0.030 -1.697 2.328) 2.881 20.928 ( -0.494 -0.214 -2.114) 2.182 21.671 ( 3.375 1.942 2.742) 4.762 21.916 ( -0.557 2.760 -0.901) 2.957 24.590 ( -2.995 -0.172 7.431) 8.014 25.298 ( 1.125 -0.433 -3.087) 3.314 32.596 ( 1.098 -0.153 0.422) 1.187 32.662 ( 0.055 -0.208 -0.313) 0.380 42.405 ( -0.765 4.566 12.881) 13.688 44.406 ( -10.069 14.905 -15.368) 23.658 45.041 ( 8.054 1.296 10.216) 13.074 46.645 ( 8.170 -20.848 -9.656) 24.385 ======================= Grid point 350 (169/355) ======================= q-point: (-0.25 0.33 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.165 ( 7.121 10.186 6.195) 13.887 3.319 ( 2.803 1.598 5.104) 6.039 3.641 ( 17.875 -0.407 10.123) 20.546 4.349 ( -8.171 -1.725 25.242) 26.588 4.565 ( -10.106 -14.566 21.185) 27.624 5.025 ( -13.268 1.585 -12.942) 18.602 5.299 ( -18.939 -2.661 -2.064) 19.236 5.584 ( 1.351 -7.938 -5.405) 9.698 6.865 ( -17.169 11.036 -5.482) 21.134 6.968 ( 14.054 -5.871 10.185) 18.323 7.538 ( 22.487 -0.534 -2.641) 22.648 8.595 ( -1.299 -4.300 -21.514) 21.978 10.130 ( -5.001 -1.881 5.169) 7.433 10.384 ( -1.839 10.837 3.693) 11.595 11.148 ( 1.279 -0.181 -0.358) 1.341 11.177 ( 6.426 -4.184 0.168) 7.670 12.851 ( 1.772 4.810 4.365) 6.733 13.072 ( -18.631 6.647 -7.910) 21.304 13.680 ( 15.631 14.610 3.553) 21.689 14.109 ( 5.376 13.632 -2.161) 14.813 15.310 ( -3.640 -21.589 0.754) 21.907 15.496 ( 3.038 -9.755 -1.122) 10.279 15.997 ( -3.978 -15.940 2.187) 16.574 16.962 ( -2.015 6.092 -12.234) 13.814 20.667 ( -1.623 -1.874 2.236) 3.339 20.914 ( -0.806 0.047 -1.892) 2.057 21.688 ( 3.175 1.968 2.614) 4.559 21.866 ( 2.303 2.836 -0.840) 3.748 24.596 ( -3.153 -0.116 7.614) 8.242 25.304 ( 1.380 -0.459 -3.133) 3.454 32.600 ( -0.002 0.712 0.477) 0.857 32.657 ( 0.338 0.793 -0.446) 0.971 42.366 ( -1.903 5.066 11.257) 12.490 43.959 ( -8.850 16.884 -16.396) 25.144 45.140 ( 2.794 0.940 13.763) 14.075 46.980 ( 10.036 -14.207 -13.951) 22.297 ======================= Grid point 351 (170/355) ======================= q-point: (-0.17 0.33 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.991 ( 2.082 15.762 7.509) 17.582 3.414 ( 6.695 -0.088 4.297) 7.956 3.890 ( 15.089 0.881 9.820) 18.025 4.352 ( -6.026 6.327 11.927) 14.785 4.573 ( -19.774 5.539 3.938) 20.910 4.836 ( -11.069 -17.278 15.128) 25.493 5.456 ( -10.109 -21.063 -3.805) 23.671 5.644 ( 5.641 4.031 -0.352) 6.942 6.466 ( -21.096 9.193 -6.207) 23.835 7.177 ( 16.449 6.381 9.053) 19.830 7.769 ( 20.117 -1.410 -1.692) 20.237 8.534 ( -2.346 -2.757 -21.550) 21.851 10.123 ( -4.477 -0.493 3.738) 5.853 10.243 ( -0.936 4.773 3.267) 5.860 11.213 ( 0.901 -6.411 -0.743) 6.516 11.305 ( 4.621 -3.700 1.376) 6.077 12.657 ( -15.433 7.060 -1.427) 17.032 12.858 ( -9.755 1.340 -3.011) 10.296 13.683 ( 25.423 10.137 3.889) 27.644 14.029 ( 11.090 5.695 -1.314) 12.536 15.574 ( -6.732 -14.842 0.363) 16.301 15.633 ( 0.174 -4.742 1.986) 5.144 16.244 ( -0.068 -14.873 -0.441) 14.880 16.763 ( -7.607 5.698 -9.459) 13.409 20.663 ( -4.346 -0.080 1.356) 4.553 20.895 ( 0.267 0.975 -0.902) 1.355 21.675 ( -0.241 1.825 0.656) 1.954 21.887 ( 7.866 0.734 -0.282) 7.905 24.601 ( -3.364 -0.120 7.755) 8.454 25.311 ( 1.487 -0.437 -3.085) 3.452 32.573 ( -1.072 1.869 -0.101) 2.157 32.642 ( 1.305 1.629 -0.347) 2.116 42.302 ( -2.602 5.496 9.165) 10.999 43.559 ( -3.637 13.953 -13.541) 19.781 45.178 ( -0.445 3.524 13.583) 14.040 47.173 ( 9.936 -5.255 -18.521) 21.665 ======================= Grid point 352 (171/355) ======================= q-point: (-0.08 0.33 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.783 ( 2.090 16.723 12.789) 21.156 3.431 ( 2.851 5.825 -1.892) 6.756 3.777 ( 1.128 18.683 2.234) 18.850 4.280 ( 5.394 4.309 14.772) 16.306 4.563 ( -14.166 -10.315 6.106) 18.557 5.138 ( -4.685 -19.782 13.618) 24.470 5.537 ( -10.042 -0.277 -2.553) 10.365 5.621 ( 0.693 3.774 1.841) 4.256 6.142 ( -19.425 -0.721 -3.369) 19.728 7.143 ( 17.160 21.466 7.470) 28.479 7.907 ( 14.703 6.513 -4.828) 16.790 8.487 ( -0.326 -6.325 -17.776) 18.871 10.080 ( -1.853 3.426 5.305) 6.581 10.289 ( -0.655 -9.492 1.134) 9.582 11.344 ( -2.860 -9.528 -3.565) 10.567 11.414 ( 2.482 -5.035 4.401) 7.133 12.441 ( -12.720 -1.779 -6.172) 14.250 12.751 ( -7.112 -0.360 0.489) 7.138 13.859 ( 24.898 3.591 3.639) 25.418 14.111 ( 14.514 -1.395 -0.871) 14.607 15.584 ( -12.907 0.855 0.208) 12.937 15.739 ( -1.124 -5.398 2.322) 5.983 16.453 ( 0.159 -1.966 -0.593) 2.060 16.567 ( -7.544 -3.903 -5.704) 10.231 20.608 ( -4.759 1.245 0.891) 5.000 20.877 ( 1.106 1.974 0.028) 2.262 21.654 ( -0.009 0.230 -0.306) 0.382 21.960 ( 7.237 -0.081 -1.867) 7.474 24.604 ( -3.708 -0.178 7.788) 8.627 25.320 ( 1.447 -0.482 -2.899) 3.276 32.522 ( -0.779 2.527 -0.732) 2.744 32.624 ( 1.866 2.234 -0.298) 2.926 42.211 ( -3.245 6.101 6.163) 9.259 43.337 ( 6.239 7.200 -8.392) 12.696 45.139 ( -1.568 6.644 11.655) 13.507 47.168 ( 7.726 5.483 -22.705) 24.602 ======================= Grid point 358 (172/355) ======================= q-point: ( 0.42 0.42 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 354 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.736 ( 9.520 0.000 0.783) 9.552 3.032 ( -8.284 -0.000 36.077) 37.016 3.557 ( 12.512 0.000 7.753) 14.719 3.696 ( -4.147 -0.000 -1.792) 4.518 4.562 ( -14.660 -0.000 2.527) 14.876 4.981 ( 1.390 0.000 -6.351) 6.501 5.296 ( 17.867 0.000 6.578) 19.039 5.915 ( -4.104 -0.000 18.358) 18.811 5.958 ( -17.807 -0.000 -3.081) 18.072 7.697 ( 27.240 0.000 -14.034) 30.642 7.774 ( 15.129 0.000 -0.384) 15.134 8.640 ( -7.989 -0.000 -13.492) 15.680 9.907 ( -2.573 -0.000 5.643) 6.202 11.107 ( -17.054 -0.000 12.233) 20.988 11.140 ( -5.596 -0.000 -7.812) 9.610 11.561 ( 7.090 0.000 -6.589) 9.679 12.893 ( -5.957 -0.000 0.051) 5.957 13.311 ( 3.088 0.000 -1.036) 3.257 13.990 ( -10.839 -0.000 -12.084) 16.233 14.216 ( -2.125 -0.000 -6.344) 6.690 14.550 ( 5.179 0.000 9.155) 10.519 14.897 ( -4.661 -0.000 5.352) 7.097 16.211 ( 0.099 0.000 2.524) 2.526 16.933 ( 2.184 0.000 -11.516) 11.721 20.724 ( 2.186 0.000 -0.896) 2.363 20.917 ( 2.165 0.000 -2.240) 3.115 21.681 ( 0.227 0.000 1.286) 1.306 21.966 ( 0.728 0.000 -0.923) 1.176 24.570 ( -2.685 -0.000 6.986) 7.484 25.302 ( -0.282 -0.000 -2.519) 2.535 32.525 ( 2.002 0.000 -0.705) 2.123 32.618 ( 1.439 0.000 -0.602) 1.560 42.422 ( 4.500 0.000 18.878) 19.407 44.700 ( 5.592 0.000 1.287) 5.738 45.233 ( 2.877 0.000 -2.631) 3.899 45.481 ( 12.728 0.000 -16.826) 21.098 ======================= Grid point 359 (173/355) ======================= q-point: (-0.50 -0.58 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.889 ( 12.837 -1.411 7.679) 15.025 3.132 ( -14.189 -7.003 33.005) 36.602 3.608 ( -5.340 -0.166 5.506) 7.672 3.840 ( 20.597 -3.842 1.716) 21.022 4.468 ( -7.568 -0.184 8.699) 11.531 4.851 ( -1.292 10.904 -0.430) 10.988 5.480 ( 9.336 -3.564 1.106) 10.054 5.682 ( -17.919 7.661 -4.294) 19.955 6.120 ( -1.292 -14.191 14.108) 20.052 7.762 ( 3.456 10.681 -4.313) 12.026 7.874 ( 20.997 2.943 -12.892) 24.814 8.492 ( -8.010 -0.672 -14.596) 16.663 9.925 ( -2.455 -1.918 6.335) 7.060 10.958 ( -10.864 3.744 5.954) 12.942 11.072 ( -4.469 0.538 -3.665) 5.805 11.555 ( 7.435 5.949 -5.047) 10.777 12.838 ( 0.185 1.063 1.222) 1.631 13.419 ( 0.306 -8.553 -0.858) 8.601 13.939 ( -10.606 -10.299 -11.307) 18.612 14.186 ( -0.530 -4.571 -7.375) 8.693 14.553 ( 4.766 8.345 7.907) 12.445 14.924 ( -2.598 -3.459 2.958) 5.240 16.092 ( -2.175 12.775 4.179) 13.616 17.007 ( 5.469 -8.194 -10.764) 14.592 20.704 ( 1.367 3.648 -0.274) 3.906 20.932 ( 1.310 -0.557 -2.480) 2.859 21.690 ( 0.656 0.208 1.748) 1.878 21.969 ( 0.084 -0.286 -1.169) 1.206 24.577 ( -2.596 -0.083 7.155) 7.612 25.290 ( 0.194 -0.099 -2.825) 2.833 32.546 ( 1.719 -0.568 -0.330) 1.841 32.630 ( 0.730 -0.421 -0.630) 1.052 42.524 ( 1.510 2.254 20.017) 20.200 44.715 ( 3.349 3.288 3.856) 6.074 45.316 ( -2.560 -5.103 -14.424) 15.513 45.553 ( 14.795 -5.602 -6.300) 17.028 ======================= Grid point 360 (174/355) ======================= q-point: (-0.42 -0.58 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.066 ( 5.748 -1.743 14.317) 15.526 3.296 ( -9.040 -11.517 18.952) 23.949 3.592 ( -1.856 0.455 6.056) 6.350 4.077 ( 15.226 2.396 11.146) 19.021 4.529 ( -0.155 -0.291 14.407) 14.410 4.709 ( 6.308 1.969 4.505) 7.998 5.331 ( -19.039 8.273 -6.007) 21.610 5.604 ( -1.815 -6.462 -6.847) 9.588 6.392 ( -3.511 -12.761 10.582) 16.945 7.493 ( -4.243 14.765 -5.047) 16.170 7.864 ( 11.632 11.005 -10.981) 19.417 8.411 ( -2.688 -5.086 -17.868) 18.771 9.977 ( -2.733 -3.395 7.427) 8.611 10.819 ( -9.633 4.069 5.158) 11.660 11.028 ( 2.985 0.728 -4.185) 5.192 11.475 ( 6.915 9.668 -2.969) 12.252 12.884 ( 5.615 -0.880 3.406) 6.626 13.503 ( -6.842 -3.383 -3.990) 8.612 13.942 ( -9.303 -8.150 -4.707) 13.234 14.356 ( 5.227 -14.473 -6.055) 16.536 14.515 ( 3.367 1.594 1.338) 3.958 14.939 ( 0.498 1.340 -0.838) 1.657 15.861 ( -4.559 11.969 7.935) 15.067 17.140 ( 7.312 -4.489 -11.686) 14.498 20.650 ( 0.106 3.197 0.994) 3.350 20.929 ( -0.157 0.139 -2.703) 2.711 21.709 ( 2.091 0.237 2.413) 3.201 21.963 ( -0.439 0.144 -1.328) 1.407 24.585 ( -2.652 -0.089 7.362) 7.825 25.284 ( 0.731 -0.322 -3.067) 3.169 32.573 ( 1.081 -0.910 0.120) 1.418 32.641 ( 0.174 -0.751 -0.621) 0.990 42.561 ( -0.898 4.279 19.018) 19.514 44.690 ( -3.152 3.805 2.267) 5.436 45.190 ( -0.162 5.387 -13.905) 14.913 45.911 ( 12.547 -19.789 -4.255) 23.815 ======================= Grid point 361 (175/355) ======================= q-point: (-0.33 -0.58 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.192 ( -5.705 -5.689 13.875) 16.045 3.416 ( 0.922 -0.498 0.988) 1.441 3.674 ( 4.848 -3.546 15.087) 16.238 4.172 ( 4.409 4.200 16.497) 17.585 4.550 ( 9.951 7.215 24.533) 27.439 4.980 ( -6.221 -2.655 -4.795) 8.291 5.040 ( -0.567 -10.186 1.538) 10.317 5.501 ( -19.961 1.804 -13.620) 24.232 6.584 ( -5.702 -11.764 9.233) 16.005 7.220 ( -5.713 9.438 -5.765) 12.448 7.737 ( 14.632 10.635 -7.884) 19.732 8.403 ( -2.063 -6.183 -20.658) 21.662 10.042 ( -3.493 -3.469 7.819) 9.239 10.673 ( -7.671 5.452 3.649) 10.094 11.071 ( 6.531 -1.490 -3.185) 7.417 11.358 ( 6.571 10.625 -0.696) 12.512 12.969 ( 6.741 1.641 5.485) 8.844 13.325 ( -15.833 6.049 -7.207) 18.417 14.001 ( 1.964 -1.934 1.740) 3.259 14.553 ( 1.499 -0.193 -3.819) 4.107 14.606 ( 4.722 -8.754 -2.892) 10.359 14.984 ( 3.671 -12.655 -5.117) 14.135 15.728 ( -4.828 2.646 9.704) 11.157 17.160 ( 5.264 3.341 -12.717) 14.163 20.622 ( -1.180 0.332 2.145) 2.470 20.907 ( -1.070 0.003 -2.583) 2.796 21.741 ( 3.145 0.795 2.753) 4.254 21.943 ( 0.241 1.154 -1.405) 1.834 24.594 ( -2.791 -0.041 7.564) 8.063 25.287 ( 1.154 -0.517 -3.212) 3.452 32.595 ( 0.071 -0.769 0.430) 0.884 32.652 ( -0.055 -0.801 -0.591) 0.997 42.545 ( -2.354 5.400 17.257) 18.235 44.464 ( -10.436 12.401 -10.626) 19.381 45.122 ( 0.154 -0.711 1.484) 1.653 46.367 ( 14.197 -20.837 -7.120) 26.200 ======================= Grid point 362 (176/355) ======================= q-point: (-0.25 -0.58 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.247 ( -13.061 -6.406 3.362) 14.930 3.428 ( 9.835 5.919 8.221) 14.119 3.867 ( 10.420 -2.406 10.875) 15.252 4.264 ( -1.180 -4.917 18.457) 19.138 4.609 ( -1.480 8.868 19.870) 21.809 4.877 ( -0.051 -3.845 -3.864) 5.451 5.084 ( -25.127 7.369 -8.188) 27.436 5.416 ( 6.702 -15.140 4.304) 17.107 6.673 ( -22.204 -3.296 3.801) 22.767 7.072 ( 8.310 -1.260 -4.465) 9.517 7.783 ( 20.543 2.714 -4.655) 21.238 8.374 ( -4.387 -6.063 -22.234) 23.460 10.080 ( -4.643 -1.671 6.840) 8.434 10.519 ( -5.117 7.079 2.778) 9.166 11.136 ( 3.320 -0.581 -3.408) 4.793 11.287 ( 8.445 5.453 2.131) 10.276 12.973 ( -15.637 7.148 -6.928) 18.537 12.990 ( -0.788 8.165 5.685) 9.980 14.037 ( 11.737 6.270 2.601) 13.558 14.394 ( 6.403 13.802 -5.505) 16.180 14.895 ( -1.875 -21.157 0.839) 21.256 15.317 ( 6.582 -17.917 -4.299) 19.565 15.758 ( -4.109 -7.102 6.758) 10.630 17.021 ( -0.074 8.830 -12.300) 15.141 20.627 ( -2.633 -1.457 2.274) 3.772 20.892 ( -0.793 -0.649 -1.946) 2.200 21.751 ( 0.667 2.083 1.505) 2.655 21.935 ( 4.428 1.417 -0.594) 4.687 24.600 ( -2.966 0.031 7.721) 8.272 25.294 ( 1.405 -0.590 -3.268) 3.606 32.600 ( -1.062 -0.147 0.311) 1.117 32.661 ( 0.133 -0.463 -0.465) 0.669 42.497 ( -3.081 5.971 15.259) 16.673 44.049 ( -11.202 14.968 -15.058) 24.005 45.173 ( -3.147 -3.104 8.048) 9.182 46.794 ( 15.595 -16.481 -10.507) 25.005 ======================= Grid point 363 (177/355) ======================= q-point: (-0.17 -0.58 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.189 ( -5.423 2.403 -0.249) 5.936 3.475 ( 2.301 2.233 11.299) 11.745 4.064 ( 9.414 -3.200 7.830) 12.656 4.442 ( -8.070 -6.751 7.146) 12.719 4.524 ( 3.762 8.729 8.666) 12.863 4.559 ( -22.026 3.021 0.820) 22.247 5.149 ( 1.482 -10.571 10.419) 14.916 5.696 ( 6.691 -7.042 8.333) 12.798 6.349 ( -23.559 8.047 -5.968) 25.601 7.311 ( 11.630 -8.795 2.285) 14.759 7.957 ( 19.702 -0.766 -4.059) 20.131 8.316 ( -6.245 -5.593 -22.602) 24.107 10.075 ( -4.430 -0.719 4.545) 6.387 10.363 ( -3.378 7.776 3.405) 9.136 11.144 ( 1.210 -1.371 -3.613) 4.049 11.344 ( 6.495 0.228 3.238) 7.261 12.586 ( -18.761 8.823 -9.486) 22.799 12.895 ( -1.690 8.337 6.771) 10.872 14.078 ( 16.870 6.913 2.830) 18.450 14.262 ( 11.637 9.602 -3.324) 15.449 15.215 ( -5.205 -19.097 0.568) 19.802 15.567 ( 2.996 -6.505 1.956) 7.424 15.964 ( 0.485 -16.955 0.296) 16.964 16.785 ( -4.893 9.295 -9.521) 14.177 20.621 ( -4.123 -0.609 1.559) 4.450 20.895 ( 0.033 -0.765 -0.865) 1.155 21.706 ( -1.251 2.530 -0.172) 2.828 21.976 ( 7.028 0.932 -0.333) 7.098 24.604 ( -3.173 0.105 7.793) 8.415 25.303 ( 1.497 -0.553 -3.245) 3.616 32.581 ( -1.572 0.785 -0.245) 1.774 32.665 ( 0.447 0.110 -0.235) 0.517 42.424 ( -3.507 6.469 12.676) 14.657 43.661 ( -6.467 11.686 -13.297) 18.847 45.213 ( -5.703 -1.979 8.949) 10.795 47.105 ( 14.622 -8.580 -13.952) 21.956 ======================= Grid point 364 (178/355) ======================= q-point: (-0.08 0.42 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.069 ( -0.415 9.105 3.938) 9.929 3.482 ( -3.062 1.310 5.736) 6.633 4.059 ( 1.184 15.441 -4.133) 16.029 4.257 ( -14.434 -7.724 4.290) 16.923 4.525 ( 0.879 4.081 13.985) 14.595 4.739 ( -6.098 -19.182 8.279) 21.764 5.353 ( -1.408 -6.596 10.516) 12.493 5.877 ( 12.479 4.544 9.859) 16.540 5.966 ( -19.200 4.533 -4.527) 20.241 7.492 ( 8.436 1.993 1.604) 8.815 8.117 ( 11.249 3.468 -5.799) 13.123 8.259 ( -0.422 -8.813 -20.040) 21.896 10.085 ( -2.142 -2.513 3.231) 4.620 10.247 ( -1.849 3.878 4.077) 5.922 11.182 ( -0.939 -4.809 -5.282) 7.205 11.410 ( 2.077 -0.883 4.654) 5.172 12.261 ( -14.886 2.711 -11.565) 19.045 12.783 ( -0.143 6.275 6.427) 8.983 14.149 ( 11.892 4.414 2.380) 12.906 14.287 ( 18.027 3.599 -1.199) 18.421 15.380 ( -10.819 -8.745 -0.111) 13.912 15.667 ( -0.089 -3.684 3.716) 5.234 16.275 ( 5.000 -16.369 -1.853) 17.216 16.547 ( -7.089 8.186 -4.795) 11.842 20.586 ( -3.577 0.534 1.324) 3.851 20.901 ( 0.270 0.118 -0.170) 0.341 21.662 ( -0.333 1.130 -0.710) 1.375 22.019 ( 4.807 0.921 -1.882) 5.244 24.605 ( -3.430 0.176 7.736) 8.464 25.312 ( 1.447 -0.496 -3.129) 3.483 32.545 ( -1.006 1.551 -0.813) 2.020 32.663 ( 0.710 0.792 -0.136) 1.072 42.324 ( -3.880 7.060 9.048) 12.115 43.449 ( 3.320 5.010 -8.270) 10.223 45.202 ( -6.643 0.410 7.678) 10.161 47.226 ( 11.115 1.331 -16.926) 20.293 ======================= Grid point 371 (179/355) ======================= q-point: (-0.50 -0.50 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 355 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.011 ( -24.672 -0.000 31.574) 40.071 3.080 ( 17.863 0.000 9.523) 20.243 3.565 ( -6.408 -0.000 4.577) 7.875 4.087 ( 30.226 0.000 4.614) 30.576 4.483 ( -2.461 -0.000 16.537) 16.719 4.851 ( -9.246 -0.000 -6.863) 11.515 5.490 ( -9.783 -0.000 -2.147) 10.016 5.638 ( 1.316 0.000 -4.957) 5.129 6.055 ( 0.006 0.000 20.289) 20.289 7.790 ( -10.511 -0.000 -7.419) 12.866 8.060 ( 18.975 0.000 -12.402) 22.668 8.324 ( -8.859 -0.000 -15.298) 17.679 9.915 ( -1.986 -0.000 6.526) 6.821 10.896 ( -13.600 -0.000 8.603) 16.093 11.041 ( 2.972 0.000 -8.064) 8.594 11.661 ( 7.523 0.000 -3.907) 8.477 12.847 ( 0.801 0.000 1.481) 1.683 13.337 ( -0.307 -0.000 -2.524) 2.542 13.723 ( -4.380 -0.000 -9.361) 10.335 14.077 ( -4.522 -0.000 -8.898) 9.981 14.758 ( 7.615 0.000 8.496) 11.409 14.861 ( -2.439 -0.000 3.174) 4.003 16.219 ( -1.458 -0.000 2.226) 2.661 16.943 ( 8.488 0.000 -9.179) 12.502 20.747 ( 0.796 0.000 -0.704) 1.063 20.923 ( 0.528 0.000 -2.567) 2.620 21.705 ( 0.625 0.000 2.055) 2.148 21.958 ( -0.397 -0.000 -1.576) 1.625 24.584 ( -2.501 -0.000 7.363) 7.776 25.279 ( 0.520 0.000 -3.044) 3.088 32.555 ( 1.200 0.000 -0.091) 1.203 32.626 ( 0.002 0.000 -0.883) 0.883 42.643 ( -1.626 -0.000 22.604) 22.662 44.808 ( 2.776 0.000 3.442) 4.422 45.157 ( -4.056 -0.000 -7.840) 8.828 45.613 ( 12.731 0.000 -13.154) 18.306 ======================= Grid point 372 (180/355) ======================= q-point: (-0.42 -0.50 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.931 ( -27.265 -6.296 24.698) 37.323 3.324 ( 17.563 -2.035 8.630) 19.674 3.542 ( -7.338 -2.538 7.388) 10.717 4.442 ( 32.623 0.947 8.052) 33.615 4.539 ( -0.334 1.321 20.580) 20.625 4.729 ( -13.613 -4.159 -5.711) 15.337 5.271 ( -9.378 8.552 -1.923) 12.837 5.608 ( 2.494 5.292 -5.059) 7.735 6.238 ( -1.710 -8.489 16.908) 18.997 7.520 ( -20.130 6.726 -9.913) 23.425 8.042 ( -3.085 4.450 -8.438) 10.026 8.259 ( 8.216 -1.045 -19.524) 21.208 9.944 ( -1.855 -1.693 7.524) 7.933 10.788 ( -11.102 1.861 5.905) 12.712 11.054 ( 6.590 -0.233 -7.608) 10.068 11.672 ( 7.471 5.814 -2.095) 9.696 12.907 ( 4.901 -3.188 3.506) 6.817 13.354 ( -5.005 -4.220 -5.529) 8.569 13.714 ( -3.245 -5.295 -5.081) 8.024 14.072 ( -1.956 -11.120 -9.146) 14.530 14.733 ( 5.504 8.842 4.985) 11.547 14.948 ( 3.145 -2.721 2.768) 4.996 16.081 ( -2.473 13.170 3.594) 13.874 17.078 ( 10.919 -6.749 -9.741) 16.113 20.713 ( -0.368 3.661 -0.024) 3.680 20.913 ( -0.734 -0.012 -2.805) 2.900 21.732 ( 1.494 -0.923 2.418) 2.988 21.947 ( -0.820 -0.344 -1.808) 2.015 24.593 ( -2.528 0.014 7.628) 8.036 25.273 ( 0.941 -0.226 -3.251) 3.392 32.568 ( 0.408 -0.545 0.192) 0.708 32.623 ( -0.589 -0.626 -1.085) 1.384 42.695 ( -4.047 2.815 22.646) 23.177 44.773 ( -1.338 6.794 3.409) 7.718 45.103 ( -6.601 -2.138 -11.434) 13.375 45.767 ( 14.024 -11.163 -9.995) 20.523 ======================= Grid point 373 (181/355) ======================= q-point: (-0.33 -0.50 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.902 ( -26.628 -10.912 16.852) 33.349 3.518 ( 6.541 -0.516 4.588) 8.006 3.615 ( 0.293 -7.478 11.359) 13.603 4.464 ( -7.867 8.693 2.915) 12.082 4.668 ( -4.141 -6.350 13.969) 15.894 4.879 ( 17.913 -5.434 8.233) 20.449 5.102 ( 7.237 9.141 9.039) 14.752 5.439 ( -3.799 10.567 -10.907) 15.655 6.389 ( -8.217 -7.396 13.226) 17.238 7.170 ( -20.166 3.233 -10.786) 23.096 7.917 ( -0.334 2.006 -6.868) 7.163 8.238 ( 5.314 0.794 -21.718) 22.372 9.998 ( -2.132 -2.542 8.377) 9.011 10.670 ( -8.695 2.788 3.082) 9.637 11.109 ( 8.737 -0.754 -6.602) 10.977 11.607 ( 7.412 9.849 0.321) 12.331 13.066 ( 8.045 -2.831 6.568) 10.765 13.237 ( -11.501 4.074 -8.024) 14.603 13.796 ( -4.289 -11.774 -0.676) 12.549 14.343 ( 3.530 -22.145 -8.489) 23.977 14.676 ( 6.649 6.933 2.741) 9.989 14.981 ( 4.942 3.548 -2.084) 6.431 15.856 ( -2.725 11.215 7.075) 13.538 17.206 ( 9.537 -0.149 -11.394) 14.859 20.641 ( -2.075 3.072 1.306) 3.931 20.884 ( -1.597 0.242 -2.746) 3.186 21.781 ( 2.127 -0.648 2.292) 3.193 21.942 ( 0.313 -0.835 -1.756) 1.969 24.602 ( -2.643 0.099 7.891) 8.322 25.275 ( 1.305 -0.468 -3.394) 3.666 32.580 ( -0.712 -0.765 0.290) 1.085 32.627 ( -0.813 -1.232 -1.080) 1.829 42.683 ( -5.212 4.748 21.150) 22.294 44.542 ( -9.164 14.061 -7.036) 18.199 45.037 ( -6.646 -3.944 -3.608) 8.529 46.154 ( 16.764 -19.860 -8.437) 27.324 ======================= Grid point 374 (182/355) ======================= q-point: (-0.25 -0.50 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.916 ( -23.271 -13.038 9.984) 28.482 3.590 ( 1.556 -0.396 9.396) 9.532 3.813 ( 0.874 -8.994 6.214) 10.967 4.235 ( -19.912 -0.823 -3.276) 20.197 4.782 ( 2.706 0.992 9.847) 10.260 5.018 ( 11.207 8.421 29.230) 32.418 5.073 ( -6.033 15.489 -16.132) 23.164 5.343 ( 17.462 -7.729 8.385) 20.856 6.438 ( -16.262 -4.071 9.976) 19.508 6.974 ( -10.128 -6.992 -9.956) 15.831 7.930 ( 7.351 -2.311 -5.661) 9.561 8.152 ( -0.122 -0.522 -23.858) 23.864 10.049 ( -2.915 -1.515 8.456) 9.072 10.552 ( -6.386 3.421 1.086) 7.326 11.167 ( 6.725 0.472 -6.262) 9.201 11.516 ( 7.491 9.993 3.079) 12.862 12.915 ( -15.665 9.666 -8.464) 20.260 13.188 ( 7.642 6.140 8.556) 13.012 14.013 ( -1.163 -15.623 1.262) 15.717 14.575 ( 4.822 2.437 -7.332) 9.108 14.719 ( 5.742 -5.182 2.318) 8.075 15.051 ( 7.822 -13.335 -5.185) 16.306 15.753 ( -0.681 3.431 8.321) 9.026 17.138 ( 3.746 9.501 -12.013) 15.767 20.595 ( -3.058 0.227 1.998) 3.660 20.860 ( -1.309 -0.724 -2.038) 2.528 21.786 ( -0.786 1.720 0.524) 1.962 21.981 ( 4.613 -1.325 -0.708) 4.851 24.609 ( -2.826 0.213 8.072) 8.555 25.283 ( 1.531 -0.616 -3.451) 3.826 32.580 ( -1.713 -0.606 0.014) 1.817 32.638 ( -0.826 -1.505 -0.815) 1.901 42.633 ( -5.552 5.762 18.967) 20.586 44.116 ( -12.777 15.759 -13.364) 24.294 45.056 ( -8.177 -6.352 2.752) 10.714 46.629 ( 18.914 -19.177 -9.886) 28.692 ======================= Grid point 375 (183/355) ======================= q-point: (-0.17 -0.50 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.963 ( -17.421 -12.701 4.702) 22.066 3.625 ( 0.015 4.205 11.610) 12.348 3.973 ( -7.206 -9.924 5.594) 13.480 4.119 ( -18.568 -11.921 -4.693) 22.559 4.655 ( 0.743 19.846 -13.081) 23.781 4.813 ( 8.585 6.283 10.795) 15.156 5.184 ( 3.733 -0.483 27.413) 27.670 5.679 ( 12.729 -8.446 10.795) 18.706 6.264 ( -13.862 6.745 1.422) 15.482 7.133 ( -2.712 -19.081 -2.735) 19.466 8.039 ( -7.417 -6.522 -17.272) 19.896 8.070 ( 14.470 -1.262 -13.379) 19.748 10.060 ( -3.341 0.447 6.798) 7.587 10.437 ( -4.601 4.508 1.321) 6.576 11.158 ( 3.407 2.520 -6.316) 7.606 11.473 ( 6.134 5.592 4.649) 9.513 12.530 ( -16.502 11.286 -9.526) 22.146 13.121 ( 3.793 11.989 8.018) 14.914 14.215 ( 2.861 -4.770 2.514) 6.104 14.485 ( 5.830 6.921 -5.581) 10.632 14.930 ( 4.864 -12.698 2.473) 13.820 15.429 ( 7.619 -17.905 -2.379) 19.604 15.797 ( 3.204 -4.351 5.417) 7.652 16.890 ( -2.313 13.182 -10.311) 16.895 20.580 ( -3.129 -0.680 1.748) 3.648 20.865 ( -0.708 -1.743 -1.064) 2.161 21.732 ( -1.810 2.573 -0.570) 3.197 22.045 ( 5.315 -0.080 -0.999) 5.408 24.613 ( -3.077 0.318 8.096) 8.667 25.294 ( 1.612 -0.625 -3.425) 3.837 32.566 ( -1.979 -0.180 -0.445) 2.037 32.651 ( -0.775 -1.368 -0.514) 1.654 42.554 ( -5.791 6.515 15.798) 18.044 43.707 ( -9.586 10.871 -12.535) 19.162 45.090 ( -9.827 -6.318 4.085) 12.376 47.038 ( 18.195 -12.513 -12.186) 25.221 ======================= Grid point 376 (184/355) ======================= q-point: (-0.08 -0.50 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.021 ( -10.390 -8.775 0.801) 13.623 3.542 ( -5.991 6.528 8.783) 12.476 4.019 ( -15.786 -5.634 5.319) 17.585 4.226 ( -10.257 -17.077 -2.200) 20.042 4.337 ( 6.086 15.318 -6.185) 17.605 4.846 ( 5.617 5.346 13.442) 15.518 5.340 ( -1.195 -3.821 20.196) 20.589 5.906 ( 0.267 3.751 4.015) 5.501 6.099 ( 10.270 2.380 8.749) 13.700 7.398 ( -5.014 -15.417 -1.578) 16.288 7.940 ( -9.979 -5.724 -22.681) 25.432 8.249 ( 16.559 -4.434 -7.981) 18.909 10.052 ( -1.974 -0.536 4.287) 4.750 10.326 ( -3.005 5.153 3.522) 6.927 11.122 ( 1.337 0.748 -6.870) 7.038 11.470 ( 2.138 2.969 5.122) 6.294 12.156 ( -13.542 8.340 -11.046) 19.364 12.990 ( 4.235 11.158 6.943) 13.808 14.261 ( 0.032 0.807 1.618) 1.808 14.460 ( 5.439 1.039 -2.154) 5.942 15.180 ( 3.055 -8.652 1.199) 9.253 15.646 ( 2.228 -3.007 3.900) 5.405 16.063 ( 10.520 -15.808 -0.670) 19.000 16.613 ( -4.633 10.155 -6.343) 12.839 20.568 ( -1.900 -0.132 1.645) 2.516 20.886 ( -0.493 -1.575 -0.492) 1.722 21.675 ( -1.042 1.696 -0.857) 2.167 22.066 ( 2.223 1.393 -2.311) 3.496 24.611 ( -3.369 0.398 7.939) 8.633 25.304 ( 1.562 -0.534 -3.323) 3.710 32.545 ( -1.292 0.314 -0.893) 1.602 32.662 ( -0.582 -0.886 -0.274) 1.095 42.441 ( -6.179 7.135 11.118) 14.584 43.494 ( -0.008 2.684 -7.355) 7.829 45.100 ( -10.517 -4.829 3.373) 12.054 47.272 ( 14.247 -2.882 -14.199) 20.319 ======================= Grid point 384 (185/355) ======================= q-point: (-0.42 -0.42 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 354 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.692 ( -30.525 -0.000 22.962) 38.197 3.478 ( -8.126 -0.000 9.242) 12.307 3.514 ( 15.468 0.000 4.244) 16.040 4.434 ( -24.448 -0.000 -7.477) 25.565 4.607 ( 2.789 0.000 19.797) 19.992 4.913 ( 34.629 0.000 13.488) 37.163 5.228 ( -6.567 -0.000 -6.755) 9.421 5.712 ( 5.329 0.000 -1.513) 5.540 6.253 ( -0.369 -0.000 21.635) 21.638 7.244 ( -32.823 -0.000 -13.216) 35.384 7.892 ( -14.994 -0.000 -9.465) 17.731 8.333 ( 14.980 0.000 -18.106) 23.500 9.953 ( -1.161 -0.000 8.496) 8.575 10.722 ( -10.071 -0.000 5.149) 11.311 11.083 ( 8.466 0.000 -10.115) 13.190 11.787 ( 7.153 0.000 -0.469) 7.168 12.953 ( 7.458 0.000 3.139) 8.092 13.241 ( -3.001 -0.000 -7.499) 8.077 13.662 ( 1.546 0.000 -1.343) 2.048 13.894 ( -4.418 -0.000 -9.768) 10.721 14.858 ( -0.106 -0.000 1.041) 1.046 14.998 ( 8.621 0.000 7.540) 11.453 16.196 ( -2.533 -0.000 1.549) 2.969 17.097 ( 14.917 0.000 -9.412) 17.638 20.743 ( -0.592 -0.000 -0.641) 0.873 20.890 ( -1.413 -0.000 -2.739) 3.082 21.742 ( 0.862 0.000 2.470) 2.617 21.924 ( -1.325 -0.000 -2.073) 2.460 24.605 ( -2.472 -0.000 8.026) 8.398 25.267 ( 1.244 0.000 -3.445) 3.662 32.565 ( -0.363 -0.000 0.304) 0.473 32.601 ( -1.336 -0.000 -1.558) 2.052 42.772 ( -6.773 -0.000 24.132) 25.064 44.866 ( -0.864 -0.000 4.671) 4.750 44.959 ( -8.114 -0.000 -8.133) 11.488 45.715 ( 10.801 0.000 -17.052) 20.185 ======================= Grid point 385 (186/355) ======================= q-point: (-0.33 -0.42 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.543 ( -30.159 -6.948 19.200) 36.421 3.464 ( -8.169 -2.451 11.319) 14.173 3.641 ( 3.813 -2.769 -2.624) 5.394 4.193 ( -23.929 -2.811 -6.590) 24.978 4.710 ( -2.656 -0.411 21.876) 22.041 5.162 ( 8.842 -0.741 -0.707) 8.901 5.293 ( 23.605 2.930 10.141) 25.857 5.656 ( 5.525 11.500 0.377) 12.764 6.336 ( -4.797 0.380 18.932) 19.534 6.836 ( -33.975 -1.690 -13.712) 36.677 7.754 ( -10.793 -5.008 -8.039) 14.359 8.327 ( 10.988 5.769 -19.661) 23.250 9.994 ( -0.996 -1.132 9.552) 9.670 10.636 ( -7.939 1.703 2.979) 8.649 11.141 ( 9.537 -1.796 -10.817) 14.532 11.815 ( 7.068 5.401 1.743) 9.065 13.100 ( 9.174 -4.713 4.346) 11.192 13.166 ( -4.660 1.759 -7.760) 9.221 13.667 ( -1.216 -0.574 0.487) 1.430 13.983 ( 1.828 -17.993 -7.928) 19.747 14.825 ( 1.550 4.089 0.840) 4.453 15.098 ( 7.413 2.366 3.913) 8.710 16.060 ( -2.632 11.656 2.719) 12.255 17.247 ( 14.806 -2.694 -10.971) 18.624 20.690 ( -1.797 4.189 0.113) 4.560 20.857 ( -2.149 0.221 -2.738) 3.487 21.785 ( 1.272 -1.958 2.208) 3.214 21.909 ( -0.907 -1.405 -2.143) 2.719 24.617 ( -2.467 0.172 8.482) 8.835 25.267 ( 1.530 -0.281 -3.593) 3.916 32.561 ( -1.417 -0.294 0.133) 1.453 32.587 ( -1.652 -1.117 -1.621) 2.570 42.783 ( -8.137 2.675 23.541) 25.051 44.694 ( -7.108 16.419 -4.772) 18.517 44.871 ( -8.785 -3.415 -3.044) 9.905 45.923 ( 13.062 -19.370 -15.670) 28.131 ======================= Grid point 386 (187/355) ======================= q-point: (-0.25 -0.42 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.496 ( -27.444 -12.418 14.496) 33.429 3.513 ( -8.202 -7.377 9.115) 14.309 3.648 ( -16.788 -7.711 -1.668) 18.549 3.984 ( -12.866 1.047 -6.258) 14.345 4.786 ( -6.657 -2.970 18.382) 19.775 5.226 ( 7.831 6.213 -10.526) 14.516 5.441 ( 12.531 8.799 15.554) 21.826 5.561 ( 11.081 6.005 10.120) 16.164 6.346 ( -6.210 -1.085 16.324) 17.499 6.567 ( -24.450 -8.589 -12.160) 28.626 7.772 ( -3.480 -8.587 -7.264) 11.773 8.208 ( 9.109 7.856 -21.017) 24.216 10.049 ( -1.487 -1.122 10.103) 10.273 10.540 ( -5.588 2.474 0.452) 6.128 11.209 ( 8.347 -0.502 -10.233) 13.215 11.771 ( 6.730 9.356 4.029) 12.209 12.911 ( -10.268 10.434 -8.905) 17.135 13.378 ( 12.383 -2.325 8.675) 15.297 13.719 ( -3.050 -12.293 1.081) 12.711 14.374 ( 6.177 -23.377 -5.802) 24.866 14.774 ( 1.890 3.763 0.769) 4.281 15.094 ( 7.776 6.057 -2.105) 10.079 15.880 ( -0.973 7.750 5.782) 9.718 17.290 ( 9.094 7.030 -12.225) 16.780 20.601 ( -2.717 3.128 1.403) 4.375 20.824 ( -2.007 -0.448 -2.166) 2.987 21.800 ( -1.315 1.055 0.060) 1.687 21.967 ( 3.162 -4.549 -1.158) 5.660 24.626 ( -2.571 0.466 8.827) 9.206 25.273 ( 1.726 -0.512 -3.654) 4.073 32.549 ( -2.228 -0.593 -0.441) 2.348 32.590 ( -1.810 -1.912 -1.182) 2.886 42.743 ( -8.418 4.446 21.575) 23.582 44.221 ( -13.409 20.181 -12.263) 27.156 44.855 ( -10.406 -6.405 0.313) 12.223 46.399 ( 17.721 -24.891 -14.346) 33.755 ======================= Grid point 387 (188/355) ======================= q-point: (-0.17 -0.42 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.544 ( -22.447 -16.262 10.371) 29.595 3.551 ( -23.868 -16.317 -2.616) 29.031 3.682 ( -8.575 -5.171 17.129) 19.841 3.850 ( -5.810 -1.795 -9.732) 11.475 4.819 ( -10.933 -4.135 8.046) 14.191 5.021 ( 13.196 20.554 -12.537) 27.454 5.452 ( 1.201 7.470 24.829) 25.957 5.754 ( 9.990 -6.704 12.450) 17.313 6.372 ( 8.294 9.229 7.908) 14.714 6.577 ( -23.400 -27.520 -4.336) 36.383 7.822 ( -2.372 -3.260 -13.069) 13.677 8.130 ( 11.886 0.594 -16.454) 20.307 10.078 ( -2.768 0.670 9.082) 9.518 10.452 ( -3.338 2.601 -0.285) 4.241 11.215 ( 5.521 2.631 -9.294) 11.126 11.688 ( 5.359 9.890 5.594) 12.563 12.553 ( -11.943 13.541 -8.656) 20.023 13.388 ( 3.090 10.054 5.694) 11.960 14.041 ( 2.078 -16.794 4.139) 17.420 14.557 ( -1.880 2.682 -6.129) 6.949 14.878 ( 9.011 -8.052 4.132) 12.771 15.201 ( 10.983 -13.783 -3.680) 18.004 15.854 ( 3.925 0.778 5.914) 7.140 17.085 ( 1.587 15.925 -11.130) 19.494 20.559 ( -1.763 0.307 1.875) 2.592 20.818 ( -1.450 -1.821 -1.285) 2.659 21.749 ( -2.109 2.201 -0.738) 3.137 22.060 ( 3.250 -2.546 -2.060) 4.614 24.630 ( -2.882 0.746 8.855) 9.342 25.284 ( 1.800 -0.611 -3.613) 4.083 32.534 ( -2.337 -0.749 -0.811) 2.585 32.603 ( -1.836 -2.317 -0.866) 3.080 42.664 ( -8.660 5.852 17.935) 20.758 43.732 ( -13.213 13.116 -12.204) 22.261 44.869 ( -11.752 -7.894 0.953) 14.190 46.904 ( 19.431 -19.660 -15.228) 31.559 ======================= Grid point 388 (189/355) ======================= q-point: (-0.08 -0.42 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.672 ( -16.678 -16.818 7.020) 24.704 3.576 ( -13.657 1.216 -0.798) 13.734 3.686 ( -13.648 -17.173 3.078) 22.151 3.927 ( -3.953 -8.678 9.375) 13.373 4.671 ( -1.243 16.664 -6.525) 17.939 4.895 ( 6.529 -2.406 -3.888) 7.971 5.445 ( -4.815 6.542 29.357) 30.460 6.062 ( 11.635 -8.155 12.715) 19.067 6.305 ( 12.576 12.027 1.829) 17.497 6.860 ( -21.381 -30.696 -0.027) 37.408 7.715 ( -3.803 1.359 -19.380) 19.796 8.269 ( 14.800 -6.515 -11.225) 19.685 10.061 ( -3.132 1.370 5.954) 6.866 10.383 ( -1.694 3.284 2.083) 4.242 11.160 ( 3.805 4.163 -8.231) 9.978 11.606 ( 2.407 7.735 5.615) 9.857 12.171 ( -10.017 12.907 -9.127) 18.714 13.253 ( 3.101 11.035 4.279) 12.235 14.198 ( -6.757 -3.562 2.417) 8.012 14.434 ( -7.723 0.882 -3.109) 8.372 15.153 ( 13.764 -7.611 2.701) 15.958 15.572 ( 6.871 -13.183 1.313) 14.924 16.004 ( 13.650 -7.571 2.763) 15.852 16.759 ( -1.494 15.540 -7.905) 17.498 20.562 ( -0.021 -0.416 1.849) 1.895 20.840 ( -0.873 -2.538 -0.617) 2.754 21.689 ( -1.766 2.012 -0.880) 2.818 22.080 ( -0.443 0.545 -3.325) 3.398 24.625 ( -3.335 0.845 8.522) 9.190 25.295 ( 1.753 -0.562 -3.489) 3.945 32.522 ( -1.566 -0.774 -1.126) 2.079 32.621 ( -1.597 -2.289 -0.502) 2.836 42.534 ( -9.335 6.867 11.825) 16.557 43.473 ( -4.552 1.373 -6.437) 8.002 44.885 ( -12.135 -7.726 0.642) 14.400 47.260 ( 16.403 -9.372 -16.194) 24.882 ======================= Grid point 397 (190/355) ======================= q-point: (-0.33 -0.33 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 355 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.266 ( -30.627 -0.000 19.126) 36.108 3.442 ( -5.890 -0.000 15.041) 16.153 3.452 ( -24.195 -0.000 -12.689) 27.320 4.007 ( -8.137 -0.000 -4.067) 9.097 4.783 ( -3.787 -0.000 20.506) 20.853 5.156 ( 4.094 0.000 1.234) 4.276 5.532 ( -4.735 -0.000 6.615) 8.135 5.789 ( 1.856 0.000 -2.367) 3.008 6.434 ( -2.501 -0.000 19.538) 19.698 6.475 ( -11.835 -0.000 -7.060) 13.781 7.572 ( -6.858 -0.000 -5.853) 9.016 8.380 ( 7.523 0.000 -20.898) 22.211 10.023 ( -0.955 -0.000 11.038) 11.079 10.599 ( -5.688 -0.000 3.520) 6.690 11.156 ( 9.552 0.000 -14.286) 17.185 11.942 ( 6.894 0.000 3.752) 7.849 13.140 ( 0.232 0.000 -7.119) 7.122 13.169 ( 9.643 0.000 3.052) 10.114 13.701 ( 1.107 0.000 2.355) 2.602 13.761 ( 0.381 0.000 -7.597) 7.607 14.862 ( -0.315 -0.000 -0.077) 0.324 15.220 ( 6.830 0.000 6.348) 9.324 16.146 ( -3.600 -0.000 0.744) 3.676 17.334 ( 17.983 0.000 -12.986) 22.182 20.717 ( -1.244 -0.000 -0.613) 1.387 20.822 ( -2.634 -0.000 -2.730) 3.794 21.782 ( 0.817 0.000 2.445) 2.578 21.870 ( -1.970 -0.000 -2.391) 3.098 24.636 ( -2.185 -0.000 9.330) 9.583 25.264 ( 1.762 0.000 -3.756) 4.149 32.543 ( -2.150 -0.000 0.343) 2.178 32.547 ( -2.173 -0.000 -2.349) 3.200 42.823 ( -10.056 -0.000 23.944) 25.970 44.698 ( -10.515 -0.000 -7.260) 12.778 44.857 ( -4.237 -0.000 4.731) 6.351 45.704 ( 7.306 0.000 -27.093) 28.060 ======================= Grid point 398 (191/355) ======================= q-point: (-0.25 -0.33 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.114 ( -28.825 -7.531 16.782) 34.194 3.143 ( -34.065 -6.888 -11.283) 36.540 3.483 ( -5.501 -1.924 17.068) 18.035 3.892 ( -8.767 0.936 -7.334) 11.468 4.790 ( -7.994 2.264 17.669) 19.525 5.250 ( -17.156 -5.608 -3.018) 18.300 5.389 ( -13.660 -12.156 4.075) 18.734 5.711 ( -2.635 5.961 -2.974) 7.164 6.283 ( -8.664 9.456 9.170) 15.766 6.627 ( 22.937 4.944 11.803) 26.266 7.602 ( 2.795 -7.435 -3.204) 8.565 8.297 ( 5.465 4.792 -22.439) 23.587 10.069 ( -1.748 -0.622 11.686) 11.833 10.548 ( -2.644 2.888 2.892) 4.867 11.211 ( 9.121 -2.655 -14.680) 17.485 11.985 ( 6.516 5.510 5.630) 10.223 12.989 ( -3.128 11.727 -7.769) 14.411 13.386 ( 11.463 -12.074 4.921) 17.361 13.639 ( -2.481 3.029 1.569) 4.218 14.023 ( 7.109 -22.171 -2.876) 23.459 14.835 ( -0.395 2.167 -0.084) 2.204 15.270 ( 6.263 4.852 2.643) 8.352 16.020 ( -3.635 8.624 1.925) 9.554 17.427 ( 14.082 2.899 -15.418) 21.081 20.653 ( -1.744 4.683 0.325) 5.008 20.785 ( -2.493 -0.297 -2.319) 3.418 21.799 ( -1.318 0.577 0.083) 1.441 21.890 ( 0.814 -5.745 -1.175) 5.920 24.656 ( -1.914 0.616 10.175) 10.372 25.268 ( 1.941 -0.289 -3.824) 4.298 32.513 ( -2.543 -0.237 -1.379) 2.903 32.534 ( -2.538 -1.439 -0.880) 3.047 42.806 ( -10.773 2.295 22.567) 25.112 44.416 ( -11.716 22.555 -11.951) 28.085 44.680 ( -10.984 1.050 1.011) 11.081 45.981 ( 10.919 -31.912 -25.275) 42.148 ======================= Grid point 399 (192/355) ======================= q-point: (-0.17 -0.33 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.102 ( -24.255 -14.605 13.588) 31.405 2.948 ( -33.686 -16.841 -5.052) 37.999 3.580 ( -4.705 -6.891 17.484) 19.373 3.742 ( -9.680 1.081 -8.552) 12.962 4.699 ( -15.345 1.987 9.540) 18.178 5.191 ( -32.233 -26.767 -1.033) 41.911 5.450 ( 10.658 16.359 -8.983) 21.492 5.727 ( -3.537 -16.538 11.179) 20.273 6.091 ( -11.970 5.725 13.856) 19.185 6.778 ( 25.113 11.909 8.192) 28.976 7.770 ( 9.171 -4.001 -2.518) 10.317 8.165 ( 5.711 3.253 -22.202) 23.154 10.101 ( -3.499 0.268 10.499) 11.070 10.487 ( 0.157 3.904 2.107) 4.439 11.257 ( 7.564 0.234 -12.867) 14.927 11.939 ( 5.077 10.051 6.607) 13.056 12.669 ( -6.128 15.778 -7.540) 18.529 13.527 ( -2.977 5.040 1.935) 6.165 13.827 ( 9.023 -17.841 6.469) 21.014 14.430 ( 0.126 -14.157 -3.291) 14.535 14.857 ( 8.570 -5.399 3.042) 10.576 15.225 ( 7.487 4.938 -2.756) 9.382 15.912 ( -0.771 1.452 4.484) 4.776 17.319 ( 5.635 13.454 -14.601) 20.639 20.578 ( -0.670 2.498 1.646) 3.066 20.768 ( -1.847 -1.373 -1.471) 2.731 21.756 ( -2.257 1.631 -0.902) 2.927 22.003 ( 1.266 -5.546 -2.662) 6.281 24.666 ( -2.158 1.535 10.441) 10.771 25.277 ( 2.030 -0.486 -3.767) 4.306 32.490 ( -2.543 -0.837 -1.412) 3.027 32.536 ( -2.459 -2.360 -0.854) 3.514 42.738 ( -11.169 4.510 19.059) 22.546 43.795 ( -17.296 20.701 -13.946) 30.367 44.625 ( -12.246 -6.419 -0.455) 13.834 46.578 ( 17.351 -32.430 -24.214) 44.035 ======================= Grid point 400 (193/355) ======================= q-point: (-0.08 -0.33 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.238 ( -17.996 -18.695 11.853) 28.528 3.044 ( -21.349 -28.385 2.004) 35.574 3.538 ( -13.383 1.887 -4.657) 14.295 3.827 ( 1.465 -10.490 14.361) 17.844 4.571 ( -14.361 -3.338 0.581) 14.755 5.200 ( 9.738 18.157 -7.323) 21.866 5.435 ( -19.879 -25.879 9.359) 33.948 5.933 ( -6.239 -2.729 11.868) 13.682 6.124 ( -11.040 -22.111 7.257) 25.757 6.799 ( 20.762 16.561 5.295) 27.081 7.772 ( 7.453 10.131 -9.402) 15.703 8.212 ( 10.711 -8.928 -14.656) 20.229 10.081 ( -4.606 1.890 7.117) 8.686 10.445 ( 1.486 3.705 3.620) 5.389 11.237 ( 6.246 3.633 -10.289) 12.573 11.823 ( 2.664 11.601 6.127) 13.387 12.300 ( -5.531 16.180 -7.151) 18.534 13.414 ( -1.411 5.829 1.231) 6.122 14.087 ( -4.223 -5.036 5.106) 8.322 14.359 ( -12.759 5.102 -5.100) 14.657 15.167 ( 12.924 -9.560 3.086) 16.369 15.432 ( 14.226 -14.386 2.224) 20.354 16.009 ( 7.599 -7.452 2.833) 11.014 17.016 ( 2.258 17.992 -10.319) 20.864 20.573 ( 1.406 -0.034 1.760) 2.252 20.784 ( -0.724 -2.702 -0.543) 2.850 21.698 ( -2.328 1.955 -0.996) 3.199 22.040 ( -2.745 -1.329 -4.357) 5.318 24.657 ( -3.053 1.975 9.834) 10.485 25.289 ( 1.995 -0.519 -3.607) 4.155 32.480 ( -1.718 -1.413 -1.569) 2.722 32.555 ( -2.068 -2.923 -0.514) 3.618 42.593 ( -12.462 6.855 11.438) 18.251 43.393 ( -11.345 2.551 -7.311) 13.736 44.629 ( -11.684 -8.271 -0.259) 14.318 47.100 ( 17.637 -20.651 -24.081) 36.296 ======================= Grid point 410 (194/355) ======================= q-point: (-0.25 -0.25 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 354 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.840 ( -28.371 -0.000 16.860) 33.003 2.650 ( -39.907 -0.000 -11.075) 41.415 3.537 ( -0.413 -0.000 19.231) 19.236 3.745 ( -14.188 -0.000 -7.693) 16.139 4.576 ( -63.805 -0.000 -7.068) 64.195 4.826 ( -12.258 -0.000 16.168) 20.289 5.327 ( -2.137 -0.000 9.095) 9.343 5.744 ( 7.521 0.000 -9.927) 12.454 6.380 ( -8.234 -0.000 15.457) 17.514 7.017 ( 30.811 0.000 10.466) 32.540 7.589 ( 10.525 0.000 -1.042) 10.577 8.265 ( 2.740 0.000 -24.384) 24.538 10.096 ( -3.107 -0.000 12.077) 12.470 10.606 ( 2.324 0.000 9.311) 9.597 11.196 ( 9.239 0.000 -17.774) 20.032 12.129 ( 6.547 0.000 7.576) 10.013 13.127 ( 3.622 0.000 -3.836) 5.276 13.316 ( 3.987 0.000 -1.362) 4.213 13.737 ( -0.560 -0.000 4.478) 4.513 13.820 ( 8.673 0.000 -0.799) 8.710 14.840 ( -1.564 -0.000 -0.087) 1.566 15.379 ( 4.050 0.000 4.547) 6.090 16.065 ( -4.868 -0.000 -0.030) 4.868 17.513 ( 13.886 0.000 -22.124) 26.121 20.690 ( -0.845 -0.000 -0.290) 0.893 20.745 ( -2.513 -0.000 -2.414) 3.484 21.803 ( -2.360 -0.000 -2.589) 3.503 21.816 ( 0.447 0.000 1.967) 2.017 24.701 ( -0.611 -0.000 12.000) 12.016 25.268 ( 2.130 0.000 -3.897) 4.441 32.479 ( -2.113 -0.000 -2.691) 3.422 32.489 ( -3.363 -0.000 0.222) 3.370 42.812 ( -12.218 -0.000 21.786) 24.978 44.423 ( -10.465 -0.000 -6.296) 12.213 44.788 ( -6.458 -0.000 3.722) 7.454 45.434 ( -3.179 -0.000 -47.313) 47.420 ======================= Grid point 411 (195/355) ======================= q-point: (-0.17 -0.25 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.714 ( -25.492 -9.218 14.351) 30.672 2.306 ( -38.943 -12.751 -5.196) 41.305 3.526 ( -14.376 1.260 2.933) 14.726 3.643 ( -2.597 -0.698 8.519) 8.934 4.110 ( -63.740 -26.908 -3.947) 69.300 4.722 ( -11.305 4.156 12.545) 17.391 5.370 ( -18.335 -10.910 5.605) 22.059 5.809 ( 23.378 5.258 -6.563) 24.844 6.261 ( -9.464 10.387 18.240) 23.025 7.268 ( 26.714 9.658 6.930) 29.239 7.786 ( 13.935 -8.078 -2.020) 16.234 8.156 ( 3.456 3.448 -22.838) 23.354 10.112 ( -4.440 0.044 10.770) 11.649 10.640 ( 6.377 7.470 12.131) 15.609 11.248 ( 9.243 -3.393 -15.953) 18.747 12.172 ( 5.533 6.836 8.644) 12.332 12.899 ( -0.239 19.035 -4.646) 19.595 13.557 ( 0.149 -4.609 0.383) 4.627 13.682 ( 7.333 -7.689 5.858) 12.134 14.146 ( 2.793 -18.545 0.696) 18.767 14.854 ( 3.356 -4.014 1.521) 5.449 15.391 ( 4.844 5.376 0.050) 7.237 15.946 ( -5.482 5.067 1.688) 7.654 17.459 ( 5.510 5.776 -25.244) 26.476 20.637 ( -0.254 3.918 0.725) 3.992 20.724 ( -1.697 -0.956 -1.486) 2.449 21.751 ( -2.366 1.213 -1.456) 3.031 21.894 ( -0.046 -6.169 -1.275) 6.299 24.742 ( 0.216 2.362 13.154) 13.367 25.274 ( 2.258 -0.268 -3.821) 4.446 32.447 ( -2.382 -0.287 -1.779) 2.987 32.473 ( -2.653 -1.690 -0.511) 3.187 42.763 ( -12.959 2.278 19.067) 23.166 43.990 ( -19.327 34.411 -19.625) 44.077 44.430 ( -12.998 0.076 -1.695) 13.108 45.864 ( 6.080 -52.289 -38.257) 65.075 ======================= Grid point 412 (196/355) ======================= q-point: (-0.08 -0.25 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.810 ( -17.008 -19.001 14.436) 29.303 2.324 ( -25.878 -29.809 3.697) 39.648 3.366 ( -18.190 -2.058 -2.890) 18.532 3.733 ( 0.636 -8.777 8.767) 12.422 4.161 ( -40.976 -36.912 4.879) 55.365 4.660 ( -13.631 -9.317 4.540) 17.124 5.335 ( -13.980 -2.509 2.011) 14.345 5.963 ( 14.943 0.298 -0.078) 14.946 6.085 ( -5.499 8.997 19.020) 21.747 7.303 ( 19.871 16.098 3.108) 25.762 8.007 ( 3.324 5.467 -21.506) 22.437 8.069 ( 16.042 -7.376 -1.683) 17.736 10.096 ( -5.191 1.541 8.445) 10.032 10.611 ( 6.500 9.205 10.275) 15.249 11.302 ( 9.233 0.959 -11.547) 14.815 12.091 ( 3.500 12.447 7.821) 15.111 12.534 ( -1.678 19.426 -4.736) 20.065 13.484 ( -1.151 4.727 2.003) 5.261 13.984 ( -0.170 -7.015 4.641) 8.413 14.264 ( -12.012 -0.737 -3.265) 12.469 15.104 ( 6.732 -10.630 1.898) 12.725 15.441 ( 18.837 -6.195 1.701) 19.903 15.929 ( -0.886 -7.187 3.340) 7.975 17.229 ( 0.537 10.723 -19.302) 22.087 20.604 ( 1.540 1.154 1.187) 2.261 20.735 ( -0.143 -2.328 -0.333) 2.356 21.697 ( -2.740 1.593 -1.386) 3.459 21.948 ( -3.618 -2.977 -4.000) 6.160 24.734 ( -1.654 4.608 12.311) 13.249 25.286 ( 2.263 -0.380 -3.616) 4.283 32.431 ( -1.678 -1.341 -1.835) 2.826 32.485 ( -1.890 -2.629 -0.240) 3.247 42.623 ( -14.998 6.998 10.941) 19.840 43.274 ( -21.658 8.892 -13.068) 26.813 44.389 ( -9.893 -7.061 -0.165) 12.156 46.625 ( 15.560 -42.101 -38.117) 58.886 ======================= Grid point 423 (197/355) ======================= q-point: (-0.17 -0.17 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 355 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.439 ( -26.349 -0.000 12.646) 29.227 1.746 ( -42.015 -0.000 -3.510) 42.161 3.118 ( -71.741 -0.000 0.833) 71.746 3.348 ( -19.385 -0.000 -3.201) 19.648 3.760 ( 1.894 0.000 17.238) 17.342 4.734 ( -9.536 -0.000 15.263) 17.997 5.090 ( -18.266 -0.000 2.692) 18.463 6.056 ( 22.917 0.000 -5.835) 23.648 6.334 ( -11.899 -0.000 19.016) 22.432 7.632 ( 21.878 0.000 4.773) 22.393 7.767 ( 6.919 0.000 -17.245) 18.581 8.177 ( 11.703 0.000 -10.378) 15.642 10.116 ( -4.679 -0.000 10.461) 11.460 10.962 ( 19.463 0.000 29.479) 35.325 11.206 ( 9.062 0.000 -19.267) 21.291 12.336 ( 5.521 0.000 10.901) 12.220 13.216 ( 6.426 0.000 1.147) 6.528 13.367 ( 4.081 0.000 -2.003) 4.546 13.784 ( 1.001 0.000 8.754) 8.811 13.966 ( 3.037 0.000 0.359) 3.058 14.831 ( 1.251 0.000 1.549) 1.991 15.462 ( 1.133 0.000 1.818) 2.142 15.954 ( -5.679 -0.000 -0.681) 5.720 17.346 ( -6.916 -0.000 -41.029) 41.608 20.684 ( 0.228 0.000 0.631) 0.670 20.686 ( -1.240 -0.000 -1.734) 2.132 21.729 ( -2.671 -0.000 -2.464) 3.634 21.833 ( -0.183 -0.000 1.122) 1.136 24.863 ( 4.978 0.000 15.552) 16.329 25.278 ( 2.434 0.000 -3.725) 4.450 32.422 ( -3.322 -0.000 0.203) 3.328 32.426 ( -0.805 -0.000 -1.715) 1.895 42.729 ( -14.255 -0.000 17.327) 22.437 44.153 ( -11.398 -0.000 -17.664) 21.022 44.548 ( -33.524 -0.000 -64.344) 72.554 44.676 ( -7.037 -0.000 1.911) 7.292 ======================= Grid point 424 (198/355) ======================= q-point: (-0.08 -0.17 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.355 ( -20.891 -20.586 9.635) 30.871 1.630 ( -27.435 -24.109 10.529) 38.010 2.780 ( -57.581 -35.257 4.727) 67.683 3.190 ( -19.976 -6.978 0.953) 21.181 3.800 ( 0.428 0.487 10.799) 10.818 4.661 ( -5.682 7.364 12.738) 15.773 5.048 ( -14.947 -10.570 4.430) 18.835 6.189 ( 4.777 7.695 6.401) 11.091 6.246 ( 2.898 3.920 8.451) 9.756 7.712 ( 10.250 8.285 -7.238) 15.037 7.802 ( 6.423 -5.207 -18.035) 19.841 8.291 ( 17.647 2.139 0.409) 17.780 10.107 ( -5.056 1.019 9.499) 10.809 11.019 ( 14.863 17.837 8.210) 24.626 11.400 ( 20.933 1.264 6.676) 22.008 12.359 ( 4.052 9.124 10.902) 14.782 12.885 ( 0.946 25.482 -1.029) 25.520 13.556 ( 0.491 0.405 1.892) 1.996 13.930 ( 7.951 -4.993 6.431) 11.380 14.079 ( -6.510 -7.857 1.710) 10.346 14.984 ( 4.638 -10.691 2.222) 11.864 15.524 ( 12.156 -6.593 -1.206) 13.881 15.833 ( -7.658 1.786 2.240) 8.176 17.066 ( -18.003 -8.681 -39.471) 44.243 20.648 ( 0.510 2.099 0.011) 2.161 20.703 ( 0.417 -1.426 0.272) 1.510 21.683 ( -2.806 1.015 -1.669) 3.418 21.857 ( -2.109 -2.216 -1.178) 3.278 24.914 ( 3.453 8.748 14.285) 17.103 25.288 ( 2.510 -0.195 -3.455) 4.274 32.392 ( -1.801 -0.371 -0.827) 2.016 32.434 ( -0.643 -1.642 -0.132) 1.768 42.621 ( -16.330 4.954 11.144) 20.382 43.139 ( -40.142 22.149 -31.291) 55.507 44.203 ( -7.464 -4.390 -0.191) 8.661 45.555 ( 1.913 -73.055 -41.021) 83.806 ======================= Grid point 436 (199/355) ======================= q-point: (-0.08 -0.08 0.22) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 354 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.923 ( -32.973 -0.000 8.774) 34.120 1.071 ( -24.115 -0.000 16.805) 29.393 1.996 ( -45.490 -0.000 30.046) 54.517 2.968 ( -15.336 -0.000 0.215) 15.338 3.827 ( -4.822 -0.000 2.396) 5.384 4.809 ( -10.961 -0.000 0.898) 10.997 4.812 ( -0.759 -0.000 12.497) 12.520 6.268 ( -11.928 -0.000 19.871) 23.176 6.375 ( 12.623 0.000 -6.716) 14.299 7.589 ( 2.616 0.000 -28.304) 28.424 7.976 ( 10.336 0.000 1.847) 10.500 8.486 ( 17.844 0.000 0.592) 17.854 10.110 ( -5.199 -0.000 9.212) 10.578 11.212 ( 9.280 0.000 -19.008) 21.152 12.067 ( 55.908 0.000 30.900) 63.879 12.537 ( 2.424 0.000 14.122) 14.329 13.359 ( 3.714 0.000 2.308) 4.373 13.454 ( 5.170 0.000 -1.137) 5.293 13.920 ( -4.396 -0.000 -2.260) 4.943 14.206 ( 39.637 0.000 27.634) 48.319 14.917 ( 3.056 0.000 4.002) 5.035 15.428 ( -6.611 -0.000 -6.320) 9.146 15.843 ( -3.750 -0.000 -1.373) 3.993 16.232 ( -64.153 -0.000 -45.610) 78.713 20.666 ( 0.398 0.000 -0.825) 0.916 20.702 ( 0.243 0.000 0.813) 0.849 21.664 ( -1.712 -0.000 -0.534) 1.794 21.828 ( -0.899 -0.000 0.106) 0.905 25.143 ( 6.982 0.000 7.254) 10.068 25.297 ( 2.637 0.000 -3.138) 4.099 32.370 ( -1.931 -0.000 0.378) 1.967 32.426 ( 1.123 0.000 0.077) 1.125 42.555 ( -16.082 -0.000 10.817) 19.381 42.674 ( -54.797 -0.000 -42.485) 69.337 44.105 ( -3.997 -0.000 0.316) 4.009 44.552 ( -5.853 -0.000 -0.299) 5.860 ======================= Grid point 437 (200/355) ======================= q-point: ( 0.00 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 355 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.675 ( 17.783 0.000 24.683) 30.421 1.878 ( 19.816 0.000 26.231) 32.874 2.665 ( 8.381 0.000 36.822) 37.764 2.799 ( 2.563 0.000 -3.277) 4.161 3.452 ( -12.306 -0.000 -13.033) 17.925 4.423 ( -16.130 -0.000 -15.348) 22.265 5.010 ( -13.107 -0.000 18.527) 22.695 6.200 ( 5.930 0.000 -13.338) 14.597 6.625 ( -14.362 -0.000 18.824) 23.677 7.118 ( 11.191 0.000 -11.715) 16.202 7.976 ( -11.079 -0.000 -0.786) 11.107 8.679 ( 16.370 0.000 -11.795) 20.176 10.238 ( -8.444 -0.000 9.107) 12.419 10.908 ( 10.386 0.000 -14.743) 18.034 12.924 ( -10.723 -0.000 12.720) 16.637 13.055 ( 20.067 0.000 3.804) 20.425 13.385 ( -1.323 -0.000 -4.841) 5.018 13.387 ( 0.539 0.000 -1.076) 1.203 13.941 ( 14.621 0.000 0.885) 14.648 14.021 ( -52.711 -0.000 -2.595) 52.774 15.050 ( -7.499 -0.000 6.382) 9.847 15.426 ( -4.190 -0.000 -2.248) 4.755 15.774 ( 1.870 0.000 -2.020) 2.752 15.798 ( 45.666 0.000 -4.872) 45.925 20.684 ( 2.240 0.000 -0.018) 2.240 20.686 ( -2.287 -0.000 -0.113) 2.290 21.698 ( 2.282 0.000 1.309) 2.631 21.781 ( -1.943 -0.000 -1.153) 2.259 25.096 ( -11.103 -0.000 2.470) 11.375 25.273 ( 4.082 0.000 -2.863) 4.986 32.370 ( 0.234 0.000 0.760) 0.795 32.416 ( -0.602 -0.000 -0.661) 0.894 42.380 ( -23.359 -0.000 4.780) 23.843 42.708 ( 50.980 0.000 -5.179) 51.243 44.173 ( 4.423 0.000 3.385) 5.570 44.391 ( -4.295 -0.000 -3.222) 5.369 ======================= Grid point 438 (201/355) ======================= q-point: ( 0.08 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.038 ( 15.393 -13.384 19.747) 28.390 2.249 ( 11.458 -2.777 26.615) 29.110 2.854 ( 13.318 -3.108 -5.873) 14.884 3.206 ( 1.868 -18.715 -3.588) 19.148 3.610 ( 25.064 -33.647 17.403) 45.422 4.302 ( -18.327 -15.237 -16.535) 29.008 4.959 ( -13.086 0.480 20.769) 24.552 6.181 ( 3.228 4.269 -8.673) 10.192 6.518 ( -10.021 4.106 13.905) 17.625 7.151 ( 3.084 0.491 -10.518) 10.971 7.723 ( -18.442 10.674 0.774) 21.322 8.729 ( 12.929 4.834 -13.366) 19.214 10.186 ( -7.764 1.044 8.739) 11.736 10.919 ( 9.936 3.511 -13.261) 16.938 12.544 ( -18.268 25.360 8.761) 32.459 13.003 ( -5.503 27.295 6.116) 28.508 13.140 ( 9.770 11.129 1.947) 14.936 13.344 ( -5.015 7.335 0.456) 8.897 13.719 ( -17.494 -5.541 -1.384) 18.403 14.170 ( 19.034 -3.082 3.574) 19.610 15.081 ( -19.227 -12.799 0.076) 23.097 15.504 ( 6.723 -11.120 -1.224) 13.052 15.692 ( -3.178 -1.178 1.649) 3.769 16.427 ( 28.850 -17.715 -15.304) 37.153 20.648 ( -2.647 1.232 0.125) 2.923 20.710 ( 2.294 -0.253 -0.087) 2.310 21.723 ( 2.013 0.866 1.136) 2.468 21.769 ( 0.109 -1.234 -1.584) 2.011 24.966 ( -10.668 3.325 5.522) 12.464 25.295 ( 3.540 0.667 -2.431) 4.346 32.385 ( 0.793 -0.643 0.625) 1.197 32.414 ( 0.595 -0.509 -0.656) 1.021 42.175 ( -18.529 0.046 1.888) 18.625 43.018 ( 42.244 15.592 -6.553) 45.504 44.335 ( 5.006 -10.738 5.498) 13.061 44.789 ( 8.591 -42.145 -16.300) 45.997 ======================= Grid point 439 (202/355) ======================= q-point: ( 0.17 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.446 ( 1.159 -9.008 22.274) 24.054 2.604 ( 19.903 -12.086 19.020) 30.066 3.022 ( 8.066 -9.208 -5.878) 13.580 3.512 ( 10.703 -20.731 -21.429) 31.678 4.441 ( -16.525 -30.651 -8.597) 35.867 4.739 ( 23.400 -33.966 17.414) 44.772 4.988 ( -0.957 -14.446 25.197) 29.060 5.982 ( -9.239 12.253 0.172) 15.347 6.470 ( 2.078 5.357 9.093) 10.756 6.972 ( -13.757 9.278 -18.209) 24.635 7.408 ( -10.897 5.493 6.442) 13.799 8.658 ( 10.157 9.160 -15.542) 20.703 10.143 ( -5.903 0.337 8.569) 10.411 10.856 ( 7.892 8.299 -10.616) 15.616 12.037 ( -13.136 19.656 8.332) 25.066 12.455 ( -7.620 30.388 3.121) 31.484 12.945 ( -5.044 13.837 -3.626) 15.168 13.143 ( -3.353 11.404 2.836) 12.220 13.711 ( 4.238 -1.511 -0.216) 4.505 14.361 ( 20.709 7.697 1.208) 22.126 15.121 ( -19.653 -17.657 -1.315) 26.452 15.689 ( 6.987 -2.322 3.840) 8.304 15.889 ( -9.032 -23.276 2.833) 25.127 16.746 ( 14.096 -4.227 -14.593) 20.725 20.604 ( -3.277 0.396 0.637) 3.362 20.742 ( 2.401 -1.076 -0.155) 2.636 21.709 ( -0.086 1.605 -0.270) 1.630 21.817 ( 4.216 -2.002 -1.836) 5.015 24.852 ( -8.098 2.432 7.597) 11.366 25.298 ( 2.772 1.338 -2.753) 4.129 32.402 ( 0.047 -0.969 -0.421) 1.058 32.452 ( 2.676 -2.159 -0.228) 3.446 42.058 ( -11.272 -3.433 1.735) 11.910 43.100 ( 28.888 11.601 -4.234) 31.417 44.650 ( 3.084 -16.860 8.501) 19.132 45.511 ( 12.742 -38.894 -27.038) 49.052 ======================= Grid point 440 (203/355) ======================= q-point: ( 0.25 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.696 ( 2.404 -8.114 19.194) 20.977 3.019 ( 12.040 -10.391 4.743) 16.596 3.298 ( 8.190 -13.831 -0.219) 16.075 3.880 ( 8.655 -23.184 -17.249) 30.165 4.813 ( -15.795 -18.494 14.206) 28.166 4.952 ( -6.248 -16.749 6.046) 18.871 5.651 ( -10.949 10.106 -2.409) 15.094 5.907 ( 22.631 -21.920 13.137) 34.135 6.329 ( -10.549 9.773 14.353) 20.318 6.628 ( -4.417 1.521 -8.446) 9.652 7.390 ( -0.009 -6.782 -2.201) 7.130 8.499 ( 8.740 11.552 -17.554) 22.759 10.141 ( -3.841 -1.229 8.412) 9.329 10.698 ( 4.892 13.164 -7.284) 15.820 11.664 ( -11.234 14.752 0.439) 18.547 11.957 ( -4.613 21.305 4.263) 22.212 12.589 ( -8.245 15.689 -9.855) 20.279 12.953 ( -3.048 8.910 5.094) 10.707 13.841 ( 13.113 -2.754 1.888) 13.531 14.355 ( 16.322 12.262 -2.343) 20.549 15.259 ( -13.862 -16.728 1.625) 21.786 15.822 ( 1.141 -5.141 5.841) 7.864 16.123 ( -11.490 -14.582 1.221) 18.605 16.775 ( 7.537 5.329 -9.910) 13.543 20.580 ( -3.285 -0.957 1.133) 3.604 20.794 ( 2.084 -2.365 -0.009) 3.152 21.676 ( 0.271 1.854 -1.048) 2.146 21.882 ( 4.399 -1.567 -2.567) 5.329 24.791 ( -6.074 0.952 8.328) 10.351 25.283 ( 2.203 1.529 -3.560) 4.457 32.422 ( 0.094 -1.721 -1.048) 2.017 32.524 ( 2.873 -2.971 -0.133) 4.135 42.079 ( -5.361 -6.950 4.110) 9.692 43.195 ( 23.245 6.096 -3.472) 24.280 44.986 ( -1.190 -15.751 8.964) 18.162 46.062 ( 10.836 -28.163 -26.028) 39.850 ======================= Grid point 441 (204/355) ======================= q-point: ( 0.33 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.922 ( 1.124 -7.764 10.047) 12.746 3.255 ( 5.065 -7.573 -2.255) 9.385 3.599 ( 8.082 -12.398 1.428) 14.868 4.277 ( 3.948 -19.313 -3.821) 20.079 4.790 ( -21.431 2.424 18.192) 28.216 5.222 ( -13.289 -15.273 3.768) 20.593 5.348 ( -8.322 9.246 -11.051) 16.640 5.932 ( 7.948 10.997 13.817) 19.366 6.322 ( -7.574 1.920 17.057) 18.762 6.979 ( 13.103 -24.602 -0.859) 27.887 7.563 ( 3.279 -12.808 -9.028) 16.010 8.304 ( 9.797 12.065 -18.100) 23.857 10.180 ( -2.179 -2.126 7.866) 8.434 10.475 ( 2.258 13.266 -3.700) 13.956 11.317 ( -9.285 11.559 -6.686) 16.264 11.698 ( -2.295 10.283 6.377) 12.316 12.207 ( -7.956 13.424 -11.360) 19.302 12.853 ( -0.084 3.756 5.961) 7.046 14.053 ( 13.500 -4.125 2.276) 14.299 14.329 ( 16.331 7.204 -2.517) 18.026 15.359 ( -13.435 -9.345 1.953) 16.481 15.888 ( -0.305 2.210 5.743) 6.161 16.201 ( -13.198 -11.892 -0.486) 17.772 16.665 ( 5.356 10.414 -6.616) 13.450 20.578 ( -2.526 -1.435 1.539) 3.288 20.853 ( 1.060 -2.448 -0.028) 2.668 21.650 ( 1.067 1.367 -1.267) 2.147 21.929 ( 2.882 -1.181 -2.745) 4.152 24.768 ( -4.941 -0.004 8.577) 9.898 25.262 ( 2.013 1.260 -4.333) 4.941 32.452 ( 0.226 -2.191 -1.216) 2.517 32.598 ( 2.126 -2.708 -0.087) 3.444 42.198 ( -2.997 -8.524 6.564) 11.168 43.322 ( 20.567 3.553 -2.512) 21.022 45.194 ( -6.935 -9.461 5.341) 12.889 46.462 ( 10.165 -20.411 -19.641) 30.095 ======================= Grid point 442 (205/355) ======================= q-point: ( 0.42 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.043 ( -1.851 -3.881 1.687) 4.619 3.369 ( -2.687 -6.236 -4.466) 8.127 3.873 ( 10.521 -7.334 1.097) 12.872 4.381 ( -23.954 5.277 12.828) 27.680 4.591 ( -2.097 -1.025 -0.508) 2.389 5.257 ( 1.379 -0.565 11.408) 11.505 5.311 ( -13.792 -13.832 -0.184) 19.534 5.863 ( 0.792 9.993 13.120) 16.511 6.452 ( 10.408 -3.596 18.827) 21.811 7.324 ( 1.136 -10.038 -11.114) 15.019 7.685 ( -5.104 -4.845 -10.756) 12.853 8.184 ( 15.630 6.456 -15.519) 22.953 10.208 ( 0.362 2.750 3.849) 4.744 10.330 ( -0.451 2.685 3.058) 4.094 11.054 ( -5.912 6.396 -8.558) 12.211 11.579 ( -3.051 4.324 4.119) 6.706 11.912 ( -5.209 7.674 -8.627) 12.667 12.883 ( 3.836 -1.648 5.588) 6.975 14.212 ( 6.353 -2.031 0.756) 6.712 14.442 ( 16.626 0.351 -0.822) 16.651 15.309 ( -13.059 -0.952 0.882) 13.123 15.830 ( -3.572 3.155 5.619) 7.368 16.284 ( -7.361 -9.836 -0.390) 12.291 16.495 ( 6.599 12.568 -5.971) 15.400 20.588 ( -1.286 -1.050 1.751) 2.413 20.888 ( 0.068 -1.091 -0.362) 1.152 21.638 ( 0.958 0.699 -1.197) 1.685 21.957 ( 0.880 -1.409 -2.420) 2.935 24.766 ( -4.421 -0.467 8.714) 9.783 25.243 ( 2.096 0.885 -4.823) 5.333 32.483 ( 0.209 -1.800 -1.171) 2.158 32.650 ( 0.970 -1.523 -0.034) 1.806 42.341 ( -3.815 -8.219 7.305) 11.639 43.450 ( 18.061 3.649 -0.881) 18.447 45.214 ( -11.311 -2.557 1.276) 11.667 46.773 ( 9.945 -13.826 -14.577) 22.417 ======================= Grid point 443 (206/355) ======================= q-point: (-0.50 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.039 ( -4.198 1.599 0.387) 4.508 3.358 ( -7.593 -2.124 -6.532) 10.239 3.955 ( -9.765 -0.860 -4.006) 10.590 4.220 ( -5.073 -4.656 14.845) 16.364 4.613 ( 6.403 7.078 8.061) 12.493 5.204 ( -4.514 10.960 12.783) 17.433 5.552 ( 3.654 -19.947 -5.526) 21.019 5.864 ( -6.295 -4.576 22.573) 23.877 6.684 ( 14.568 2.958 13.096) 19.811 7.279 ( -4.417 1.126 -18.790) 19.335 7.520 ( -14.017 7.584 -5.017) 16.708 8.212 ( 16.351 3.710 -15.093) 22.559 10.159 ( 0.183 3.585 2.599) 4.431 10.363 ( -1.481 -2.952 5.771) 6.649 10.919 ( -0.786 0.611 -8.677) 8.734 11.526 ( -4.591 -1.393 0.904) 4.882 11.779 ( -1.313 1.030 -3.855) 4.201 13.014 ( 5.554 -5.261 2.964) 8.204 14.259 ( -3.145 -0.008 0.794) 3.244 14.514 ( 1.284 3.470 0.187) 3.705 15.240 ( -0.540 -1.537 -0.688) 1.768 15.805 ( -2.709 -0.814 6.806) 7.371 16.353 ( 1.737 0.998 -1.494) 2.499 16.364 ( 7.719 4.369 -5.187) 10.275 20.602 ( 0.118 -0.346 1.693) 1.732 20.890 ( -0.097 0.519 -0.458) 0.699 21.631 ( -0.256 0.018 -1.111) 1.140 21.970 ( -1.348 -1.493 -2.211) 2.989 24.774 ( -4.219 -0.753 8.867) 9.849 25.230 ( 2.298 0.658 -5.072) 5.608 32.500 ( -0.009 -0.588 -1.212) 1.347 32.665 ( -0.162 0.186 0.051) 0.252 42.450 ( -6.073 -6.791 6.214) 11.028 43.534 ( 13.190 5.540 0.383) 14.312 45.093 ( -12.413 2.460 0.337) 12.658 46.977 ( 9.389 -6.498 -14.157) 18.188 ======================= Grid point 444 (207/355) ======================= q-point: (-0.42 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.887 ( -7.880 10.237 3.323) 13.339 3.286 ( -6.070 -1.870 -4.694) 7.898 3.846 ( -17.590 -1.286 2.070) 17.758 4.385 ( 3.772 -4.200 12.762) 13.955 4.566 ( 9.057 9.084 10.777) 16.753 4.978 ( 1.867 15.589 -2.830) 15.953 5.911 ( -2.905 -15.091 15.789) 22.034 6.084 ( 0.318 -16.828 9.159) 19.161 6.612 ( -0.196 18.702 -0.951) 18.727 7.069 ( -15.156 14.288 -12.546) 24.316 7.291 ( 3.158 -1.801 4.355) 5.673 8.207 ( 14.909 6.847 -16.771) 23.461 10.122 ( -2.990 0.589 3.259) 4.462 10.434 ( -0.047 -3.485 5.357) 6.391 10.934 ( 4.748 -3.592 -7.389) 9.489 11.554 ( -4.707 -7.771 -0.149) 9.086 11.805 ( 1.747 -4.898 -1.031) 5.302 13.168 ( 4.631 -5.959 -1.648) 7.725 14.150 ( -13.621 1.406 1.375) 13.762 14.385 ( -11.801 4.838 1.589) 12.853 15.332 ( 9.591 -2.428 -0.774) 9.924 15.836 ( 0.725 1.167 6.478) 6.623 16.334 ( 11.120 6.999 -0.744) 13.160 16.431 ( 7.499 -5.317 -5.735) 10.835 20.617 ( 1.299 0.330 1.266) 1.844 20.870 ( 0.549 1.859 -0.068) 1.940 21.623 ( -1.774 -0.835 -1.028) 2.214 21.955 ( -3.644 -0.875 -2.322) 4.409 24.789 ( -4.116 -1.278 9.121) 10.088 25.220 ( 2.550 0.581 -5.180) 5.803 32.489 ( -0.273 0.932 -1.451) 1.746 32.642 ( -1.017 1.859 0.196) 2.128 42.500 ( -8.256 -4.925 4.079) 10.443 43.511 ( 4.251 8.025 -0.306) 9.086 44.916 ( -9.666 5.818 3.090) 11.697 47.032 ( 8.711 2.337 -17.980) 20.115 ======================= Grid point 445 (208/355) ======================= q-point: (-0.33 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.610 ( -9.759 14.124 7.932) 18.911 3.240 ( -3.645 1.816 -1.495) 4.338 3.553 ( -15.298 18.149 4.810) 24.219 4.418 ( 4.207 14.937 9.622) 18.259 4.600 ( -5.425 1.184 13.462) 14.563 4.912 ( 13.482 -9.549 -6.265) 17.669 5.890 ( -21.479 28.236 6.141) 36.005 6.177 ( -7.968 2.055 7.739) 11.297 6.397 ( 1.130 3.551 -4.248) 5.651 6.805 ( 0.988 -9.442 7.804) 12.289 7.460 ( 7.248 -6.688 -2.969) 10.299 8.140 ( 14.054 7.929 -17.179) 23.569 10.124 ( -4.204 -3.232 4.853) 7.188 10.530 ( 1.056 -4.690 4.582) 6.641 11.039 ( 8.509 -4.336 -5.216) 10.881 11.703 ( -2.459 -14.310 1.334) 14.580 11.958 ( 4.398 -9.712 -0.217) 10.664 13.279 ( 3.251 -4.840 -5.309) 7.885 14.035 ( -16.369 -5.334 2.753) 17.435 14.167 ( -16.570 3.797 1.929) 17.108 15.426 ( 9.789 4.704 -0.393) 10.868 15.847 ( 5.341 3.346 7.372) 9.699 16.284 ( 6.416 8.630 -1.830) 10.909 16.637 ( 12.822 -7.702 -6.962) 16.498 20.626 ( 1.735 0.868 0.479) 1.998 20.841 ( 1.571 2.932 0.337) 3.343 21.613 ( -3.098 -1.488 -0.979) 3.574 21.908 ( -4.991 -0.138 -2.068) 5.404 24.822 ( -3.971 -2.537 9.507) 10.610 25.214 ( 2.858 0.510 -5.169) 5.929 32.453 ( -0.320 2.074 -1.665) 2.679 32.589 ( -1.545 2.937 0.323) 3.334 42.489 ( -9.671 -2.963 1.379) 10.208 43.344 ( -6.819 9.336 -2.154) 11.760 44.745 ( -5.062 8.805 7.423) 12.580 46.887 ( 7.897 13.970 -24.660) 29.422 ======================= Grid point 446 (209/355) ======================= q-point: (-0.25 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.320 ( -8.600 15.155 13.095) 21.797 2.925 ( -5.951 33.735 7.232) 35.011 3.213 ( -14.654 3.116 1.431) 15.050 4.083 ( 3.771 25.735 -5.097) 26.505 4.670 ( -10.193 -4.149 15.522) 19.027 4.898 ( -20.709 40.578 7.992) 46.253 5.291 ( 1.920 -2.575 6.407) 7.167 6.044 ( 3.659 4.414 -6.080) 8.357 6.390 ( -7.606 -2.261 13.331) 15.514 7.186 ( 5.800 -18.607 5.132) 20.155 7.513 ( 2.565 1.146 -17.275) 17.501 8.154 ( 17.041 -0.585 -10.869) 20.221 10.184 ( -5.112 -5.271 7.929) 10.807 10.654 ( 3.137 -6.506 -1.363) 7.350 11.238 ( 13.505 -9.440 3.519) 16.849 11.993 ( 0.652 -19.340 3.860) 19.732 12.205 ( 6.383 -13.212 0.319) 14.676 13.387 ( 5.101 -7.291 -4.950) 10.183 13.920 ( -19.362 -0.149 -0.472) 19.368 14.069 ( -13.677 -8.791 5.534) 17.175 15.354 ( 7.534 12.676 -0.510) 14.755 15.901 ( 7.990 3.850 8.358) 12.187 16.161 ( 4.411 11.225 -2.569) 12.331 16.776 ( 6.972 0.573 -12.342) 14.187 20.628 ( 1.528 0.814 -0.117) 1.735 20.802 ( 1.342 3.712 -0.108) 3.949 21.606 ( -2.943 -1.968 -0.347) 3.557 21.853 ( -4.375 -0.064 -1.096) 4.511 24.889 ( -3.757 -5.020 9.678) 11.532 25.214 ( 3.242 0.311 -4.971) 5.943 32.406 ( -0.044 2.152 -1.382) 2.558 32.522 ( -1.726 3.080 0.286) 3.543 42.419 ( -9.639 -0.412 -2.109) 9.875 43.072 ( -15.226 7.882 -1.397) 17.202 44.577 ( -2.164 11.883 9.609) 15.434 46.469 ( 6.324 29.910 -31.141) 43.639 ======================= Grid point 447 (210/355) ======================= q-point: (-0.17 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.019 ( -6.211 23.481 17.408) 29.883 2.320 ( -8.882 30.722 15.259) 35.434 2.978 ( -10.955 11.164 0.212) 15.643 3.551 ( -10.200 38.470 7.963) 40.588 4.009 ( -9.267 25.082 -6.613) 27.545 4.816 ( -9.864 -3.793 23.408) 25.683 5.221 ( -8.817 9.773 4.548) 13.926 6.193 ( 12.915 -6.934 -1.196) 14.707 6.376 ( -11.976 -5.613 4.946) 14.120 7.262 ( 1.987 7.394 -16.319) 18.026 7.653 ( 5.108 -17.243 -0.514) 17.991 8.341 ( 17.358 -4.523 -9.393) 20.248 10.244 ( -6.901 -3.864 9.675) 12.496 10.775 ( 6.505 -5.088 -11.002) 13.756 11.755 ( 21.402 -27.427 16.117) 38.342 12.362 ( 3.009 -18.936 4.915) 19.794 12.537 ( 6.158 -18.521 2.893) 19.731 13.591 ( 10.524 -9.126 -3.554) 14.376 13.734 ( -17.814 -0.665 -1.328) 17.876 14.138 ( -13.698 -12.406 6.934) 19.739 15.193 ( 8.173 14.334 -0.732) 16.517 15.905 ( -3.497 5.584 5.916) 8.854 15.984 ( 9.138 14.181 -2.394) 17.039 16.549 ( -2.522 22.836 -17.803) 29.066 20.635 ( 1.341 -0.146 -0.142) 1.356 20.747 ( -0.440 2.791 -0.521) 2.873 21.625 ( -0.470 -2.132 0.923) 2.370 21.818 ( -2.675 -0.409 -0.495) 2.751 25.004 ( -4.082 -8.105 8.126) 12.181 25.224 ( 3.663 -0.001 -4.486) 5.792 32.376 ( 0.215 0.965 -0.427) 1.077 32.461 ( -1.420 2.202 0.052) 2.621 42.302 ( -4.119 3.031 -4.502) 6.813 42.803 ( -19.273 3.489 3.254) 19.855 44.390 ( -0.857 13.341 8.206) 15.686 45.730 ( 3.410 46.120 -29.524) 54.866 ======================= Grid point 448 (211/355) ======================= q-point: (-0.08 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.597 ( -0.470 24.223 25.932) 35.488 1.928 ( 3.908 25.370 21.172) 33.275 2.670 ( -2.538 17.191 17.423) 24.608 2.971 ( -8.166 18.704 9.572) 22.542 3.672 ( -8.894 5.820 -12.160) 16.150 4.719 ( -14.498 8.594 -0.957) 16.881 5.046 ( -11.860 0.401 15.328) 19.385 6.227 ( 2.945 1.643 -12.130) 12.590 6.553 ( -7.180 -12.300 15.579) 21.107 7.117 ( 9.352 6.174 -15.318) 18.979 7.934 ( -2.188 -12.240 0.898) 12.466 8.532 ( 17.744 -2.741 -10.897) 21.003 10.262 ( -8.005 -1.911 9.667) 12.696 10.856 ( 9.136 -2.514 -14.682) 17.474 12.605 ( 23.929 -29.041 11.839) 39.448 12.716 ( 3.593 -16.071 6.627) 17.751 12.965 ( 2.233 -26.077 3.928) 26.465 13.568 ( -12.556 1.873 -1.399) 12.772 13.802 ( 11.807 -2.829 -2.798) 12.459 14.281 ( -24.067 -20.410 3.408) 31.740 15.096 ( 17.533 9.194 -0.887) 19.817 15.617 ( -22.206 12.824 -4.967) 26.120 15.860 ( -12.104 15.265 0.468) 19.487 15.920 ( 28.369 35.286 -5.550) 45.615 20.658 ( 1.520 -0.761 -0.063) 1.701 20.707 ( -1.536 0.524 -0.150) 1.630 21.665 ( 1.384 -1.129 1.299) 2.209 21.802 ( -1.682 -0.298 -0.794) 1.884 25.117 ( -7.058 -7.054 3.768) 10.666 25.245 ( 4.034 -0.180 -3.725) 5.494 32.370 ( -0.114 0.143 0.465) 0.500 32.427 ( -0.762 0.494 -0.384) 0.986 42.302 ( 17.753 -0.535 -0.597) 17.771 42.595 ( -20.250 0.942 5.729) 21.066 44.217 ( 1.180 9.832 4.862) 11.032 44.856 ( -0.495 42.084 -14.270) 44.440 ======================= Grid point 450 (212/355) ======================= q-point: ( 0.08 0.08 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 354 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.114 ( 8.427 0.000 14.541) 16.806 2.581 ( 27.813 0.000 14.386) 31.313 3.007 ( -5.224 -0.000 -5.945) 7.914 3.042 ( 24.033 0.000 -4.282) 24.411 3.692 ( 42.107 0.000 28.790) 51.008 3.914 ( -14.586 -0.000 -21.221) 25.751 4.924 ( -13.746 -0.000 20.506) 24.687 6.264 ( 11.604 0.000 -11.510) 16.344 6.439 ( -18.647 -0.000 11.071) 21.686 7.148 ( -1.544 -0.000 -4.264) 4.535 7.590 ( -25.543 -0.000 1.003) 25.563 8.825 ( 10.190 0.000 -14.091) 17.389 10.156 ( -7.629 -0.000 8.504) 11.425 10.993 ( 10.710 0.000 -13.179) 16.982 12.609 ( -23.079 -0.000 2.861) 23.255 12.969 ( -35.845 -0.000 12.561) 37.982 13.323 ( -7.655 -0.000 1.740) 7.850 13.433 ( 4.962 0.000 -1.345) 5.141 13.651 ( 17.426 0.000 1.061) 17.458 14.299 ( 14.122 0.000 8.723) 16.598 14.858 ( -13.132 -0.000 2.440) 13.356 15.211 ( -12.305 -0.000 -2.393) 12.536 15.855 ( 7.083 0.000 -2.418) 7.484 16.494 ( 32.986 0.000 -21.184) 39.203 20.638 ( -1.932 -0.000 -0.326) 1.959 20.733 ( 2.448 0.000 0.077) 2.450 21.732 ( -1.669 -0.000 -1.363) 2.154 21.768 ( 3.270 0.000 1.141) 3.464 24.907 ( -10.740 -0.000 6.003) 12.304 25.325 ( 2.831 0.000 -1.597) 3.250 32.395 ( 1.310 0.000 0.713) 1.492 32.415 ( 1.341 0.000 -0.733) 1.528 42.006 ( -14.480 -0.000 0.322) 14.483 43.692 ( 52.322 0.000 -20.021) 56.022 44.314 ( -0.057 -0.000 -3.878) 3.879 44.361 ( 11.190 0.000 3.324) 11.673 ======================= Grid point 451 (213/355) ======================= q-point: ( 0.17 0.08 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.356 ( 4.962 -12.312 12.400) 18.165 2.890 ( 19.649 -4.214 9.515) 22.234 2.994 ( 9.421 2.020 -0.159) 9.637 3.268 ( 17.354 -6.007 -17.038) 25.050 3.876 ( -0.923 -17.342 -8.720) 19.433 4.576 ( 37.197 -28.809 19.611) 50.972 4.907 ( -8.300 -4.725 24.525) 26.319 6.099 ( -10.960 12.915 -1.223) 16.983 6.474 ( 3.533 -7.893 -5.562) 10.282 6.973 ( -14.022 12.646 -3.560) 19.215 7.336 ( -20.017 0.257 6.552) 21.063 8.800 ( 7.624 5.281 -15.715) 18.248 10.122 ( -6.489 -0.024 8.485) 10.682 11.002 ( 9.830 4.467 -12.003) 16.145 12.198 ( -21.191 16.366 4.522) 27.154 12.664 ( -29.563 8.044 9.913) 32.202 13.145 ( -1.934 14.753 -5.038) 15.709 13.359 ( 2.810 11.259 1.613) 11.716 13.745 ( 9.769 3.141 2.595) 10.584 14.587 ( 14.649 -7.853 9.088) 18.944 14.729 ( -13.199 -3.680 -2.714) 13.969 15.344 ( -14.526 -24.634 0.407) 28.601 15.843 ( 9.529 5.733 0.122) 11.121 16.744 ( 19.370 -6.024 -20.428) 28.789 20.603 ( -1.636 1.780 0.140) 2.422 20.757 ( 2.360 -0.099 -0.177) 2.369 21.716 ( -0.830 -0.149 -1.420) 1.652 21.816 ( 3.369 -1.358 0.264) 3.642 24.829 ( -8.604 0.947 7.225) 11.275 25.332 ( 1.871 1.037 -1.694) 2.729 32.404 ( 1.154 0.450 -0.230) 1.260 32.446 ( 2.540 -1.568 -0.318) 3.002 41.919 ( -6.799 -2.437 1.344) 7.347 43.691 ( 30.923 24.349 -8.950) 40.364 44.487 ( 7.088 -11.058 1.361) 13.205 44.905 ( 16.913 -36.813 -16.483) 43.737 ======================= Grid point 452 (214/355) ======================= q-point: ( 0.25 0.08 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.665 ( 3.566 -10.654 13.483) 17.550 3.082 ( 8.621 -2.500 -0.908) 9.022 3.306 ( 25.568 -9.129 13.242) 30.206 3.375 ( -3.393 -16.585 -25.853) 30.902 4.381 ( 14.180 -27.794 5.775) 31.732 4.805 ( -14.329 -3.038 16.052) 21.731 5.633 ( 6.745 -10.998 2.222) 13.091 5.793 ( 7.998 -9.131 11.310) 16.591 6.480 ( -17.503 13.151 -8.931) 23.644 6.618 ( 5.616 2.900 5.067) 8.102 7.259 ( -8.787 -4.775 3.988) 10.766 8.670 ( 6.368 8.950 -17.406) 20.583 10.113 ( -4.980 -1.288 8.630) 10.047 10.921 ( 7.810 10.046 -9.874) 16.106 11.765 ( -17.414 14.283 0.164) 22.523 12.211 ( -19.101 17.597 6.879) 26.867 12.798 ( -2.407 19.033 -9.229) 21.289 13.175 ( 3.538 14.625 3.889) 15.541 13.864 ( 6.348 -6.239 3.622) 9.609 14.598 ( 0.580 4.968 -4.624) 6.812 14.940 ( 2.343 -13.087 6.401) 14.756 15.566 ( -16.834 -20.151 1.202) 26.285 15.916 ( 3.824 -2.862 4.576) 6.615 16.858 ( 11.040 0.076 -15.923) 19.376 20.562 ( -1.510 1.148 1.018) 2.153 20.786 ( 2.141 -0.946 -0.424) 2.379 21.700 ( 0.187 0.876 -1.579) 1.815 21.876 ( 2.980 -1.942 -1.079) 3.717 24.777 ( -6.491 0.458 7.950) 10.274 25.314 ( 1.256 1.659 -2.633) 3.356 32.409 ( 1.313 -0.120 -0.981) 1.643 32.506 ( 2.787 -2.436 -0.258) 3.710 41.965 ( -0.347 -5.104 4.724) 6.963 43.613 ( 25.868 15.035 -3.930) 30.177 44.772 ( 4.238 -13.608 1.939) 14.384 45.551 ( 12.261 -32.506 -20.215) 40.195 ======================= Grid point 453 (215/355) ======================= q-point: ( 0.33 0.08 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.887 ( 4.141 -5.375 7.344) 9.999 3.166 ( -1.459 -5.308 -5.841) 8.026 3.559 ( 12.741 -9.768 0.095) 16.055 3.876 ( 12.877 -26.613 1.836) 29.622 4.684 ( -23.568 0.722 20.910) 31.515 4.933 ( -0.135 -13.356 4.734) 14.171 5.336 ( -10.855 6.913 -11.342) 17.154 6.176 ( 0.035 5.100 7.308) 8.912 6.349 ( 0.649 -3.994 17.729) 18.185 6.759 ( 14.470 -13.880 -4.031) 20.452 7.358 ( 0.990 -10.414 -3.731) 11.106 8.490 ( 6.954 9.891 -18.424) 22.037 10.146 ( -3.582 -2.812 8.887) 9.986 10.732 ( 5.164 15.061 -7.223) 17.484 11.365 ( -14.202 11.938 -6.670) 19.716 11.849 ( -11.598 11.351 7.962) 18.076 12.408 ( -0.475 19.469 -9.956) 21.872 13.023 ( 5.580 10.549 4.973) 12.928 14.081 ( 7.801 -7.756 3.628) 11.583 14.520 ( 3.830 3.353 -4.372) 6.711 15.124 ( -4.015 -6.732 3.923) 8.766 15.750 ( -15.947 -21.063 0.707) 26.428 15.956 ( -3.051 1.963 5.703) 6.759 16.833 ( 7.951 6.132 -11.941) 15.602 20.550 ( -1.029 -0.486 1.552) 1.924 20.827 ( 1.595 -1.835 -0.550) 2.493 21.679 ( 0.842 1.273 -1.482) 2.127 21.921 ( 1.888 -1.120 -1.595) 2.714 24.755 ( -5.163 -0.185 8.297) 9.773 25.284 ( 1.217 1.544 -3.716) 4.204 32.428 ( 1.641 -1.013 -1.206) 2.275 32.574 ( 2.251 -2.623 -0.243) 3.465 42.101 ( 1.962 -5.902 7.714) 9.909 43.656 ( 24.965 9.247 -1.450) 26.662 44.991 ( -2.036 -9.923 -0.558) 10.145 46.067 ( 8.426 -27.294 -15.834) 32.660 ======================= Grid point 454 (216/355) ======================= q-point: ( 0.42 0.08 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.987 ( 0.365 -2.467 -0.499) 2.543 3.208 ( -4.784 -5.840 -3.532) 8.335 3.878 ( 12.176 -9.750 7.301) 17.223 4.331 ( -20.678 9.125 11.692) 25.447 4.451 ( 5.764 -16.780 1.279) 17.788 4.979 ( -7.855 -6.533 -4.126) 11.018 5.257 ( -8.189 -4.630 14.957) 17.669 6.126 ( -2.425 13.419 11.214) 17.655 6.521 ( 11.139 -9.989 15.039) 21.214 7.086 ( 3.077 -12.818 -12.188) 17.953 7.504 ( -0.978 -6.957 -7.248) 10.094 8.346 ( 10.544 6.382 -18.370) 22.122 10.211 ( -2.436 -3.307 8.793) 9.705 10.496 ( 3.638 13.755 -3.940) 14.763 11.054 ( -8.967 7.051 -8.239) 14.071 11.638 ( -8.738 6.586 6.154) 12.554 12.083 ( 4.205 16.050 -7.304) 18.128 12.989 ( 8.061 4.580 4.862) 10.469 14.238 ( 2.981 -1.647 1.680) 3.797 14.563 ( 9.154 -1.978 -2.840) 9.786 15.138 ( -11.586 -3.598 3.291) 12.570 15.812 ( -14.600 -2.880 -0.956) 14.912 16.007 ( -3.192 -11.568 6.129) 13.475 16.722 ( 8.246 9.764 -10.532) 16.561 20.568 ( -0.237 -1.368 1.677) 2.177 20.867 ( 1.048 -1.561 -0.686) 2.002 21.659 ( 0.378 1.256 -1.284) 1.836 21.939 ( 0.614 -0.399 -1.151) 1.364 24.752 ( -4.516 -0.562 8.507) 9.648 25.256 ( 1.535 1.046 -4.462) 4.833 32.462 ( 1.796 -1.328 -1.025) 2.457 32.631 ( 1.309 -2.001 -0.155) 2.397 42.248 ( 0.832 -5.075 8.693) 10.100 43.761 ( 23.993 7.909 -0.204) 25.264 45.051 ( -7.988 -4.592 -2.515) 9.551 46.491 ( 6.378 -21.826 -11.607) 25.530 ======================= Grid point 455 (217/355) ======================= q-point: (-0.50 0.08 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.003 ( -2.499 -1.791 -0.615) 3.136 3.217 ( -5.803 -3.203 -2.646) 7.137 3.875 ( -21.147 10.935 1.184) 23.837 4.188 ( 4.771 -7.885 15.260) 17.827 4.800 ( 15.597 -2.105 5.865) 16.796 5.159 ( 2.859 -20.332 -5.267) 21.196 5.351 ( -8.297 -4.338 21.940) 23.855 5.909 ( -6.550 10.499 11.853) 17.136 6.830 ( 7.397 -4.959 6.114) 10.802 7.135 ( -4.533 -3.944 -13.889) 15.133 7.454 ( -8.613 2.850 -4.448) 10.105 8.332 ( 14.056 1.225 -18.352) 23.149 10.263 ( 0.248 2.163 5.834) 6.227 10.345 ( 0.008 3.899 1.300) 4.110 10.884 ( -2.153 1.617 -7.773) 8.226 11.498 ( -7.186 3.287 3.615) 8.690 11.900 ( 8.578 10.519 -3.618) 14.047 13.056 ( 8.524 0.267 2.933) 9.018 14.227 ( -6.509 1.524 0.900) 6.745 14.586 ( -2.314 5.958 -1.356) 6.534 15.145 ( -2.767 -7.559 1.268) 8.149 15.740 ( -8.536 -3.944 2.528) 9.737 16.189 ( -3.068 -10.406 2.758) 11.194 16.612 ( 11.839 8.619 -10.018) 17.743 20.601 ( 0.721 -1.292 1.514) 2.117 20.892 ( 1.055 -0.497 -0.635) 1.328 21.630 ( -1.023 1.110 -1.102) 1.869 21.937 ( -0.910 0.036 -0.542) 1.060 24.759 ( -4.286 -0.729 8.689) 9.716 25.239 ( 1.931 0.611 -4.848) 5.254 32.492 ( 1.616 -0.649 -0.834) 1.931 32.662 ( 0.339 -0.697 0.002) 0.775 42.356 ( -1.647 -3.557 8.106) 9.004 43.830 ( 19.191 10.333 -1.873) 21.876 44.995 ( -9.557 -1.018 0.199) 9.613 46.806 ( 5.033 -15.044 -11.536) 19.615 ======================= Grid point 456 (218/355) ======================= q-point: (-0.42 0.08 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.973 ( -3.685 4.356 2.056) 6.065 3.195 ( -3.940 -1.492 0.794) 4.287 3.609 ( -16.942 -2.383 3.576) 17.479 4.410 ( 3.323 -5.155 15.912) 17.053 4.920 ( 17.419 8.582 -0.141) 19.419 5.287 ( 2.591 15.362 11.339) 19.268 5.609 ( 3.992 -24.081 -1.644) 24.465 5.847 ( -14.615 -9.033 19.432) 25.938 6.773 ( -10.715 7.078 -5.690) 14.045 7.039 ( -5.912 5.415 -17.291) 19.059 7.360 ( 1.491 0.963 12.224) 12.352 8.356 ( 13.269 3.181 -19.238) 23.586 10.179 ( -0.093 6.674 1.972) 6.960 10.377 ( -2.731 -4.222 5.053) 7.128 10.890 ( 4.980 -3.628 -5.756) 8.432 11.430 ( -5.519 -1.698 2.415) 6.259 11.863 ( 11.736 4.738 -1.411) 12.735 13.156 ( 7.173 -1.836 -0.873) 7.455 14.052 ( -17.392 4.726 1.250) 18.066 14.361 ( -14.565 8.089 0.857) 16.682 15.315 ( 7.022 -8.367 -1.208) 10.989 15.801 ( -2.962 -6.638 4.946) 8.792 16.305 ( -1.312 -5.325 -0.101) 5.486 16.606 ( 16.044 3.527 -8.437) 18.467 20.636 ( 1.611 -0.611 1.117) 2.054 20.902 ( 1.617 0.585 -0.295) 1.744 21.594 ( -2.324 0.554 -0.735) 2.500 21.911 ( -2.777 0.619 -0.373) 2.869 24.770 ( -4.261 -0.943 8.900) 9.913 25.229 ( 2.288 0.394 -5.016) 5.527 32.503 ( 1.298 0.719 -0.860) 1.715 32.660 ( -0.492 0.962 0.152) 1.091 42.407 ( -4.012 -1.871 6.889) 8.189 43.748 ( 8.373 13.935 -6.879) 17.652 44.930 ( -4.888 1.784 7.451) 9.088 46.979 ( 4.369 -7.048 -15.328) 17.428 ======================= Grid point 457 (219/355) ======================= q-point: (-0.33 0.08 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.787 ( -6.234 12.581 6.649) 15.535 3.193 ( -4.104 -0.999 3.973) 5.799 3.593 ( -6.983 -2.299 3.855) 8.301 4.580 ( 0.257 -3.277 18.257) 18.550 4.856 ( 6.818 16.521 5.954) 18.838 5.039 ( 9.418 14.782 -9.675) 20.020 5.885 ( -16.906 -8.615 21.082) 28.363 6.108 ( 1.931 -16.284 -2.249) 16.552 6.445 ( -9.592 13.466 -2.420) 16.709 6.785 ( -3.724 6.409 -4.357) 8.598 7.461 ( 4.388 -1.586 5.330) 7.083 8.305 ( 11.819 6.223 -20.673) 24.612 10.103 ( -1.432 2.278 3.110) 4.113 10.451 ( -2.930 -5.635 3.621) 7.311 11.017 ( 8.035 -5.531 -3.622) 10.406 11.484 ( -3.253 -9.001 2.541) 9.902 11.963 ( 15.306 -0.915 -0.194) 15.335 13.239 ( 5.098 -2.127 -5.258) 7.626 13.814 ( -20.892 -0.067 3.894) 21.252 14.072 ( -18.734 6.128 0.981) 19.735 15.511 ( 8.306 -4.833 -0.336) 9.616 15.895 ( -0.306 -3.289 5.310) 6.254 16.346 ( 0.359 -0.831 -2.266) 2.440 16.719 ( 15.982 -1.140 -7.634) 17.748 20.660 ( 2.039 0.460 0.578) 2.168 20.901 ( 1.972 1.669 -0.276) 2.598 21.563 ( -2.680 -0.221 -0.047) 2.689 21.861 ( -4.016 0.886 -0.328) 4.126 24.789 ( -4.345 -1.560 9.173) 10.269 25.225 ( 2.615 0.292 -5.046) 5.691 32.487 ( 1.175 2.128 -1.006) 2.631 32.623 ( -1.187 2.465 0.165) 2.741 42.405 ( -5.574 -0.255 5.533) 7.858 43.482 ( -2.531 15.552 -10.504) 18.937 44.897 ( 0.417 6.085 13.707) 15.003 46.978 ( 4.457 2.644 -21.751) 22.360 ======================= Grid point 458 (220/355) ======================= q-point: (-0.25 0.08 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.539 ( -6.196 13.893 12.267) 19.542 3.158 ( -5.938 2.046 3.852) 7.368 3.401 ( -3.329 23.034 4.036) 23.621 4.496 ( -5.853 17.608 -8.822) 20.546 4.699 ( 4.342 7.346 20.809) 22.491 5.054 ( 2.746 -4.277 1.402) 5.273 5.665 ( -3.864 30.284 14.163) 33.655 6.035 ( -10.830 3.192 4.090) 12.009 6.374 ( -1.302 -0.954 -2.698) 3.145 6.909 ( 0.467 -19.276 6.450) 20.332 7.490 ( 0.911 1.882 -8.351) 8.609 8.251 ( 13.033 2.018 -18.370) 22.614 10.108 ( -2.378 -2.378 5.752) 6.663 10.544 ( -1.600 -7.375 0.175) 7.549 11.207 ( 9.538 -8.644 0.764) 12.895 11.691 ( -1.478 -16.716 2.827) 17.018 12.187 ( 18.808 -4.783 0.995) 19.432 13.293 ( 1.645 -4.859 -7.114) 8.771 13.689 ( -20.438 -4.712 5.709) 21.737 13.846 ( -14.308 -0.843 1.497) 14.411 15.588 ( 6.863 5.041 0.185) 8.518 15.964 ( -0.204 -1.855 5.379) 5.694 16.315 ( 2.193 4.599 -2.694) 5.763 16.836 ( 9.765 -0.369 -9.744) 13.800 20.666 ( 1.976 1.387 0.279) 2.430 20.870 ( 0.205 3.293 -1.380) 3.577 21.559 ( -0.451 -1.218 1.283) 1.826 21.809 ( -3.688 0.260 -0.203) 3.703 24.823 ( -4.621 -2.939 9.399) 10.878 25.226 ( 2.966 0.115 -4.898) 5.727 32.451 ( 1.377 2.920 -0.971) 3.371 32.559 ( -1.684 3.248 -0.032) 3.659 42.362 ( -5.667 1.049 4.289) 7.184 43.120 ( -7.930 14.580 -10.230) 19.497 44.836 ( 2.123 11.351 15.996) 19.729 46.763 ( 5.094 15.307 -29.095) 33.268 ======================= Grid point 459 (221/355) ======================= q-point: (-0.17 0.08 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.328 ( -4.539 13.147 18.164) 22.878 2.844 ( -8.279 34.803 9.616) 37.044 3.056 ( -3.313 7.262 0.646) 8.008 4.064 ( 0.570 22.039 -19.041) 29.130 4.564 ( 2.566 33.098 14.416) 36.192 4.923 ( -2.156 15.195 24.596) 28.991 5.353 ( -4.351 13.343 9.844) 17.143 6.036 ( -6.025 -12.582 4.716) 14.726 6.309 ( -4.405 2.594 -2.368) 5.634 7.281 ( 0.112 -15.547 5.896) 16.628 7.366 ( -1.335 -0.722 -19.367) 19.426 8.354 ( 14.053 -5.808 -14.074) 20.719 10.160 ( -4.750 -3.459 8.154) 10.051 10.671 ( 2.814 -8.389 -6.216) 10.814 11.552 ( 9.631 -19.563 9.069) 23.616 12.024 ( -0.911 -22.828 2.308) 22.962 12.488 ( 19.134 -6.912 3.308) 20.612 13.368 ( -8.910 -9.415 -8.282) 15.383 13.632 ( -6.455 -7.019 6.850) 11.741 13.838 ( -8.036 -7.379 2.270) 11.143 15.514 ( 8.201 11.550 0.869) 14.192 15.927 ( -9.305 5.044 0.968) 10.629 16.226 ( 3.623 8.817 0.361) 9.539 16.787 ( 4.491 8.849 -12.974) 16.334 20.660 ( 1.440 1.335 0.397) 2.003 20.787 ( -2.063 3.818 -2.002) 4.779 21.608 ( 2.865 -1.801 2.171) 4.021 21.782 ( -1.984 -0.647 -0.518) 2.151 24.882 ( -5.543 -4.984 9.012) 11.695 25.237 ( 3.349 -0.237 -4.445) 5.571 32.415 ( 1.644 2.663 -0.492) 3.168 32.488 ( -1.703 2.934 -0.360) 3.411 42.313 ( -3.480 0.793 4.025) 5.379 42.783 ( -6.483 11.166 -7.307) 14.836 44.699 ( 1.960 15.746 14.608) 21.567 46.287 ( 6.106 31.167 -33.601) 46.235 ======================= Grid point 460 (222/355) ======================= q-point: (-0.08 0.08 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.154 ( 2.735 20.377 23.573) 31.280 2.304 ( -4.945 21.240 17.505) 27.965 2.909 ( 3.435 8.903 -2.644) 9.903 3.606 ( 2.316 25.029 -13.394) 28.482 3.992 ( 17.825 45.950 15.157) 51.565 4.801 ( -11.375 14.849 12.094) 22.274 5.036 ( -14.946 8.222 9.514) 19.532 6.155 ( -8.148 -5.716 -3.744) 10.634 6.365 ( 1.342 -10.482 8.697) 13.686 7.208 ( 4.105 4.444 -15.537) 16.673 7.603 ( -10.218 -19.152 2.248) 21.823 8.549 ( 14.021 -7.287 -13.392) 20.713 10.191 ( -6.801 -2.340 8.906) 11.447 10.806 ( 7.215 -6.350 -11.447) 14.947 12.104 ( -1.498 -31.520 12.776) 34.044 12.462 ( 2.986 -28.019 1.983) 28.247 12.823 ( 14.694 -9.922 6.463) 18.872 13.336 ( -14.282 -7.426 -4.858) 16.815 13.835 ( -14.301 -13.084 3.315) 19.665 13.927 ( 17.180 -3.568 0.911) 17.570 15.433 ( 13.739 9.911 1.372) 16.997 15.590 ( -21.571 14.492 -4.385) 26.354 16.030 ( -6.408 16.270 3.326) 17.800 16.573 ( 15.189 17.767 -13.340) 26.914 20.655 ( -0.827 0.038 0.638) 1.045 20.714 ( -0.306 1.833 -1.142) 2.182 21.675 ( 2.967 -1.206 1.766) 3.657 21.781 ( 0.072 -0.405 -1.405) 1.464 24.949 ( -7.899 -5.896 7.248) 12.235 25.261 ( 3.648 -0.631 -3.576) 5.147 32.393 ( 1.319 1.684 0.275) 2.156 32.433 ( -0.784 1.598 -0.659) 1.898 42.303 ( -10.539 -2.468 4.905) 11.883 42.629 ( 14.829 3.465 -4.702) 15.938 44.501 ( 2.592 16.549 10.408) 19.721 45.564 ( 7.766 44.298 -29.431) 53.748 ======================= Grid point 463 (223/355) ======================= q-point: ( 0.17 0.17 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 355 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.328 ( 7.885 0.000 1.709) 8.068 2.902 ( 2.119 0.000 -27.343) 27.425 3.010 ( 5.504 0.000 9.477) 10.959 3.595 ( 27.923 0.000 10.536) 29.844 3.819 ( 23.355 0.000 -2.462) 23.484 4.692 ( 2.847 0.000 12.736) 13.050 4.991 ( 26.876 0.000 29.425) 39.852 6.048 ( -24.629 -0.000 -2.412) 24.747 6.417 ( 15.463 0.000 -16.842) 22.864 6.995 ( -11.648 -0.000 2.772) 11.973 7.107 ( -24.486 -0.000 10.881) 26.795 8.833 ( 5.052 0.000 -16.890) 17.630 10.096 ( -6.093 -0.000 8.409) 10.385 11.084 ( 9.868 0.000 -12.235) 15.719 12.154 ( -21.802 -0.000 -2.850) 21.987 12.409 ( -31.690 -0.000 16.477) 35.718 13.250 ( -1.698 -0.000 -1.423) 2.215 13.453 ( -3.006 -0.000 -1.247) 3.255 14.010 ( 14.690 0.000 3.794) 15.172 14.441 ( -8.485 -0.000 3.070) 9.024 14.811 ( 7.664 0.000 7.078) 10.433 14.907 ( -15.081 -0.000 -3.644) 15.515 15.985 ( 7.119 0.000 -0.588) 7.143 16.770 ( 16.650 0.000 -22.870) 28.289 20.613 ( -0.152 -0.000 -0.383) 0.412 20.778 ( 2.230 0.000 -0.535) 2.293 21.694 ( -0.926 -0.000 -0.891) 1.285 21.842 ( 3.124 0.000 0.676) 3.196 24.788 ( -7.587 -0.000 7.497) 10.666 25.348 ( 0.701 0.000 -1.409) 1.574 32.425 ( 1.219 0.000 -0.022) 1.219 32.453 ( 3.026 0.000 -0.797) 3.129 41.876 ( 0.528 0.000 3.909) 3.944 44.321 ( 4.144 0.000 -3.351) 5.330 44.344 ( 32.493 0.000 -19.626) 37.960 44.662 ( 17.426 0.000 -2.965) 17.676 ======================= Grid point 464 (224/355) ======================= q-point: ( 0.25 0.17 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.545 ( 10.254 -12.621 1.374) 16.319 2.839 ( -6.626 -10.914 -28.530) 31.257 3.157 ( 8.770 -2.633 14.062) 16.781 3.821 ( 31.628 11.117 11.457) 35.429 4.240 ( 27.006 -15.971 2.314) 31.460 4.668 ( -18.222 -2.784 16.002) 24.410 5.550 ( 0.669 -5.166 2.857) 5.941 5.799 ( 8.841 -5.830 10.419) 14.856 6.459 ( 2.737 4.517 -18.203) 18.954 6.764 ( -3.815 7.141 8.609) 11.818 7.079 ( -12.217 -7.539 9.071) 16.981 8.753 ( 3.556 4.640 -18.330) 19.240 10.084 ( -5.184 -0.802 8.524) 10.008 11.083 ( 8.886 4.943 -11.326) 15.221 11.799 ( -19.441 11.991 -2.735) 23.005 12.186 ( -26.860 3.145 11.503) 29.388 13.039 ( -3.847 16.897 -5.027) 18.044 13.418 ( 1.477 2.827 0.337) 3.207 13.941 ( 5.421 11.352 4.808) 13.468 14.510 ( -4.399 -7.130 -4.099) 9.327 14.844 ( -2.936 -10.911 5.047) 12.375 15.072 ( -7.440 -15.454 1.959) 17.263 16.009 ( 5.794 3.814 3.117) 7.605 16.847 ( 10.331 -3.798 -19.991) 22.821 20.592 ( 0.413 2.265 0.215) 2.312 20.798 ( 2.252 -0.131 -0.991) 2.464 21.691 ( -0.400 -0.584 -0.964) 1.196 21.880 ( 2.799 -0.810 0.169) 2.919 24.753 ( -6.090 0.047 7.876) 9.956 25.333 ( 0.002 1.041 -2.132) 2.373 32.427 ( 1.601 0.692 -0.798) 1.918 32.498 ( 2.993 -1.660 -0.557) 3.467 41.963 ( 6.364 -2.159 8.572) 10.892 44.112 ( 19.107 17.957 -5.278) 26.747 44.662 ( 12.707 -7.932 -6.134) 16.187 45.093 ( 14.384 -26.846 -13.252) 33.215 ======================= Grid point 465 (225/355) ======================= q-point: ( 0.33 0.17 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.832 ( 0.090 -8.181 -11.383) 14.018 2.906 ( 1.609 -15.674 -3.806) 16.209 3.423 ( 10.408 -11.010 11.161) 18.818 4.039 ( 31.243 4.492 7.634) 32.475 4.533 ( -24.176 -1.736 22.836) 33.301 4.787 ( 9.849 -12.154 2.227) 15.802 5.255 ( -16.428 5.115 -8.830) 19.340 6.234 ( -3.293 2.446 7.562) 8.602 6.328 ( 8.867 -9.547 7.146) 14.861 6.781 ( 11.150 0.020 -4.169) 11.905 7.207 ( 3.311 -9.442 2.911) 10.421 8.598 ( 3.480 7.043 -19.474) 20.999 10.104 ( -4.107 -2.412 9.047) 10.224 10.984 ( 7.332 11.229 -9.227) 16.278 11.384 ( -16.038 12.633 -7.486) 21.746 11.896 ( -19.591 7.540 9.967) 23.238 12.685 ( -0.907 17.820 -6.758) 19.080 13.334 ( 8.262 12.829 2.695) 15.496 13.987 ( 1.986 -8.871 5.538) 10.645 14.508 ( -2.379 -0.562 -4.683) 5.283 15.066 ( -0.479 -9.353 4.090) 10.219 15.187 ( -17.718 -16.854 -3.308) 24.676 16.015 ( 0.229 2.996 8.026) 8.570 16.894 ( 7.505 -0.716 -16.238) 17.902 20.563 ( 0.521 1.721 1.105) 2.111 20.822 ( 2.343 -0.712 -1.237) 2.743 21.688 ( -0.091 0.190 -1.057) 1.078 21.920 ( 2.131 -0.858 -0.275) 2.314 24.737 ( -4.936 -0.282 8.161) 9.542 25.300 ( 0.114 1.361 -3.267) 3.541 32.436 ( 2.289 -0.026 -1.093) 2.537 32.556 ( 2.475 -2.127 -0.436) 3.292 42.124 ( 7.700 -2.233 11.985) 14.419 44.068 ( 22.555 10.823 -1.430) 25.058 44.849 ( 5.742 -6.105 -7.423) 11.195 45.610 ( 8.001 -28.349 -11.435) 31.598 ======================= Grid point 466 (226/355) ======================= q-point: ( 0.42 0.17 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.884 ( -3.057 -7.249 -9.198) 12.104 3.115 ( 3.597 -3.507 4.789) 6.941 3.801 ( 8.957 -15.163 8.303) 19.470 4.269 ( -19.261 3.419 7.572) 20.976 4.414 ( 17.293 -4.324 8.869) 19.910 4.881 ( -2.486 0.355 4.205) 4.898 5.127 ( -12.021 -4.473 9.437) 15.924 6.259 ( -4.380 0.294 2.712) 5.159 6.523 ( 5.887 -7.558 16.332) 18.934 6.918 ( 8.998 -4.997 -13.860) 17.264 7.393 ( 4.825 -5.202 -3.414) 7.874 8.437 ( 5.418 5.567 -20.256) 21.695 10.163 ( -3.211 -3.694 9.690) 10.856 10.776 ( 5.853 15.881 -6.395) 18.093 11.043 ( -9.811 7.564 -8.235) 14.875 11.661 ( -14.178 5.605 8.041) 17.236 12.393 ( 6.236 16.302 -5.380) 18.265 13.240 ( 11.029 10.858 3.807) 15.938 14.203 ( 0.411 -7.299 4.126) 8.394 14.503 ( -0.348 -6.353 -3.982) 7.506 15.055 ( -7.040 2.966 1.007) 7.705 15.360 ( -17.996 -22.402 -4.933) 29.155 15.987 ( -2.904 2.217 10.156) 10.793 16.867 ( 7.489 4.303 -14.312) 16.716 20.562 ( 0.626 -0.143 1.508) 1.639 20.856 ( 2.178 -1.166 -1.241) 2.765 21.672 ( -0.396 0.999 -0.754) 1.313 21.944 ( 1.265 -0.018 -0.089) 1.268 24.737 ( -4.303 -0.557 8.383) 9.440 25.266 ( 0.722 1.024 -4.164) 4.348 32.464 ( 2.792 -0.722 -0.826) 3.000 32.610 ( 1.640 -2.025 -0.297) 2.623 42.277 ( 5.605 -0.970 12.589) 13.814 44.155 ( 25.231 8.439 -0.007) 26.605 44.901 ( -3.049 -3.168 -7.573) 8.757 46.089 ( 4.432 -26.356 -8.270) 27.977 ======================= Grid point 467 (227/355) ======================= q-point: ( 0.50 0.17 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.922 ( -2.841 -3.513 -0.980) 4.623 3.169 ( 1.909 0.505 2.903) 3.511 3.886 ( -19.548 12.145 2.165) 23.115 4.157 ( 4.888 -10.147 15.298) 18.997 4.833 ( 13.087 -18.869 -2.089) 23.059 4.935 ( 5.845 -2.426 5.891) 8.646 5.216 ( -10.473 -10.270 22.604) 26.946 6.134 ( -2.191 10.626 8.562) 13.821 6.738 ( -4.128 -3.623 -5.758) 7.957 6.973 ( 0.311 -6.505 -6.086) 8.914 7.428 ( 0.285 0.922 -3.472) 3.604 8.365 ( 9.090 0.052 -21.270) 23.131 10.240 ( -3.016 -3.603 9.366) 10.478 10.557 ( 5.405 14.384 -2.695) 15.600 10.861 ( -2.336 2.341 -6.812) 7.572 11.488 ( -11.435 3.684 5.681) 13.289 12.222 ( 13.810 14.040 -2.977) 19.918 13.223 ( 10.829 6.552 2.760) 12.954 14.188 ( -9.430 2.744 1.136) 9.887 14.628 ( -0.462 0.170 -4.299) 4.327 14.968 ( -7.034 -7.286 3.440) 10.695 15.475 ( -13.459 -14.290 -4.514) 20.143 16.034 ( -3.033 -6.282 8.803) 11.232 16.790 ( 9.433 6.322 -14.021) 18.043 20.591 ( 1.010 -1.444 1.558) 2.352 20.889 ( 1.776 -1.007 -1.143) 2.340 21.640 ( -0.909 1.720 -0.228) 1.959 21.944 ( 0.036 0.966 0.333) 1.022 24.745 ( -4.067 -0.660 8.587) 9.525 25.243 ( 1.391 0.522 -4.668) 4.899 32.502 ( 2.780 -0.595 -0.417) 2.873 32.650 ( 0.751 -1.315 -0.106) 1.518 42.378 ( 2.493 0.388 11.622) 11.893 44.216 ( 21.345 12.936 -6.420) 25.771 44.879 ( -5.822 -3.645 1.246) 6.981 46.486 ( 2.339 -21.362 -8.711) 23.188 ======================= Grid point 468 (228/355) ======================= q-point: (-0.42 0.17 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.958 ( -1.141 -2.569 3.493) 4.484 3.199 ( 3.240 0.825 5.068) 6.071 3.539 ( -13.312 9.097 4.528) 16.747 4.418 ( 2.919 -6.880 16.193) 17.835 5.084 ( 8.527 -4.808 -0.533) 9.803 5.221 ( 0.358 -18.545 -5.045) 19.223 5.441 ( -7.046 -13.043 28.128) 31.795 5.924 ( 5.491 22.553 4.997) 23.744 6.600 ( -17.594 -5.152 -7.975) 19.992 7.004 ( 0.329 2.051 -13.921) 14.075 7.418 ( -1.140 -0.751 8.890) 8.994 8.388 ( 9.695 -1.685 -21.926) 24.033 10.302 ( -3.016 -2.573 7.590) 8.563 10.366 ( 2.311 11.976 -0.530) 12.208 10.863 ( 5.407 -3.025 -4.237) 7.506 11.368 ( -9.190 0.580 4.038) 10.054 12.166 ( 19.567 11.428 -1.280) 22.696 13.245 ( 8.570 3.485 -0.164) 9.253 13.972 ( -18.492 6.496 0.992) 19.624 14.388 ( -13.638 12.094 -1.231) 18.269 15.191 ( 5.052 -13.500 -0.142) 14.415 15.596 ( -6.586 -13.757 0.530) 15.262 16.173 ( -2.936 -8.875 4.637) 10.435 16.743 ( 10.967 3.442 -13.496) 17.728 20.639 ( 1.699 -1.586 1.463) 2.746 20.913 ( 1.309 -0.623 -1.030) 1.778 21.599 ( -0.748 2.078 0.551) 2.276 21.913 ( -1.708 1.921 0.382) 2.599 24.755 ( -4.057 -0.693 8.791) 9.707 25.232 ( 1.920 0.186 -4.906) 5.271 32.529 ( 2.437 0.379 -0.197) 2.475 32.665 ( -0.087 -0.015 0.030) 0.093 42.422 ( -0.329 1.578 10.366) 10.491 44.047 ( 7.196 17.430 -15.409) 24.352 44.953 ( 1.801 -2.549 13.326) 13.687 46.759 ( 1.655 -14.528 -12.669) 19.347 ======================= Grid point 469 (229/355) ======================= q-point: (-0.33 0.17 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.950 ( -0.834 7.118 5.574) 9.079 3.209 ( -0.502 3.555 7.430) 8.252 3.484 ( 0.900 -7.428 8.185) 11.089 4.584 ( -0.686 -3.576 14.402) 14.856 5.174 ( 7.882 9.190 -4.666) 12.975 5.296 ( -6.933 6.272 -4.336) 10.306 5.639 ( -17.235 -5.659 15.899) 24.122 5.790 ( 3.261 -16.496 7.407) 18.375 6.534 ( -2.070 3.532 2.326) 4.708 6.852 ( 1.788 6.960 -10.489) 12.714 7.480 ( -2.132 -2.764 6.933) 7.762 8.374 ( 7.951 1.770 -23.072) 24.468 10.205 ( 1.180 8.698 1.826) 8.965 10.347 ( -4.304 -3.665 4.345) 7.130 10.992 ( 8.034 -5.128 -2.131) 9.766 11.341 ( -5.862 -4.886 3.059) 8.221 12.223 ( 23.874 7.142 0.027) 24.920 13.260 ( 3.900 1.878 -4.532) 6.267 13.663 ( -21.157 5.400 3.689) 22.144 14.036 ( -15.776 10.567 -0.537) 18.995 15.454 ( 7.016 -10.317 0.050) 12.477 15.775 ( -3.305 -11.317 2.784) 12.114 16.291 ( -0.779 -5.783 1.067) 5.932 16.769 ( 8.540 -1.329 -12.026) 14.810 20.685 ( 2.226 -0.619 1.289) 2.646 20.923 ( 0.298 0.031 -1.290) 1.324 21.569 ( 0.774 1.781 1.587) 2.508 21.853 ( -3.136 2.270 0.103) 3.873 24.768 ( -4.170 -0.864 9.005) 9.961 25.229 ( 2.308 0.032 -4.992) 5.500 32.534 ( 2.175 1.707 -0.186) 2.772 32.647 ( -0.898 1.603 -0.045) 1.838 42.417 ( -2.480 2.594 9.211) 9.885 43.688 ( -1.755 18.360 -17.318) 25.300 45.072 ( 5.138 2.378 18.591) 19.434 46.883 ( 2.431 -6.307 -18.865) 20.039 ======================= Grid point 470 (230/355) ======================= q-point: (-0.25 0.17 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.782 ( -1.918 13.539 10.570) 17.283 3.199 ( 1.582 2.741 5.898) 6.693 3.644 ( 4.211 3.343 6.542) 8.468 4.583 ( -13.066 9.931 0.912) 16.437 4.875 ( -3.075 3.370 8.243) 9.422 5.196 ( 9.906 10.571 -0.790) 14.509 5.715 ( -15.746 -9.907 14.432) 23.545 6.134 ( -6.290 -20.301 -5.484) 21.949 6.369 ( 7.994 22.134 8.720) 25.097 6.774 ( 0.407 1.562 3.694) 4.031 7.504 ( -0.100 0.631 -1.808) 1.918 8.300 ( 8.187 2.240 -23.646) 25.123 10.125 ( 0.177 3.230 4.185) 5.289 10.394 ( -4.421 -6.260 1.200) 7.757 11.166 ( 8.335 -6.882 0.163) 10.810 11.446 ( -3.120 -11.234 1.806) 11.798 12.402 ( 25.690 2.001 1.349) 25.803 13.184 ( -8.907 -0.084 -7.680) 11.762 13.473 ( -15.740 -0.846 7.459) 17.439 13.776 ( -6.369 4.393 -1.032) 7.805 15.649 ( 4.956 -4.439 1.407) 6.800 15.906 ( -2.649 -6.003 2.440) 7.000 16.361 ( 2.356 -1.390 -0.311) 2.753 16.815 ( 2.013 -3.119 -10.935) 11.548 20.710 ( 2.014 0.887 1.226) 2.519 20.893 ( -2.061 1.780 -2.154) 3.472 21.581 ( 3.941 0.561 2.572) 4.739 21.788 ( -3.021 1.354 -0.361) 3.330 24.785 ( -4.441 -1.398 9.190) 10.302 25.231 ( 2.627 -0.115 -4.927) 5.585 32.516 ( 2.149 2.830 -0.210) 3.560 32.595 ( -1.495 2.948 -0.376) 3.327 42.376 ( -3.931 3.162 8.214) 9.639 43.278 ( -3.680 17.270 -15.661) 23.602 45.121 ( 4.103 8.336 20.125) 22.166 46.837 ( 4.243 3.836 -25.839) 26.465 ======================= Grid point 471 (231/355) ======================= q-point: (-0.17 0.17 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.598 ( -1.162 13.443 16.192) 21.077 3.171 ( 3.108 6.429 0.912) 7.199 3.376 ( -2.794 29.283 7.058) 30.251 4.221 ( -6.340 12.671 -13.332) 19.455 4.947 ( -0.471 5.162 18.534) 19.245 5.197 ( 7.423 1.257 11.266) 13.550 5.770 ( -10.139 -5.642 11.112) 16.066 5.925 ( 0.717 30.167 0.472) 30.179 6.281 ( -2.379 3.241 2.138) 4.553 6.878 ( -10.217 -16.847 3.633) 20.036 7.432 ( 5.071 6.734 -9.773) 12.906 8.307 ( 10.066 -4.909 -19.983) 22.907 10.126 ( -1.851 -0.504 6.785) 7.051 10.499 ( -0.985 -10.142 -2.665) 10.533 11.410 ( 7.966 -11.686 4.387) 14.807 11.660 ( -3.198 -17.892 -0.220) 18.177 12.633 ( 16.825 -1.192 3.326) 17.192 13.085 ( -13.109 -6.151 -8.988) 17.043 13.430 ( -8.056 -6.600 8.984) 13.754 13.778 ( 7.462 -3.175 -1.471) 8.242 15.704 ( 3.214 3.273 2.262) 5.115 15.909 ( -7.247 2.139 -0.126) 7.557 16.379 ( 3.942 3.956 1.408) 5.760 16.794 ( -3.001 -1.252 -10.660) 11.145 20.703 ( -0.092 2.003 1.229) 2.352 20.812 ( -2.215 3.250 -2.253) 4.533 21.640 ( 4.215 -0.457 2.423) 4.883 21.759 ( 0.479 -0.325 -1.209) 1.341 24.811 ( -5.098 -2.313 9.141) 10.719 25.241 ( 2.911 -0.444 -4.602) 5.463 32.484 ( 1.789 3.274 -0.031) 3.731 32.523 ( -1.056 3.383 -0.852) 3.645 42.313 ( -5.797 2.867 7.220) 9.693 42.935 ( 1.861 13.420 -11.990) 18.092 45.053 ( 1.942 14.025 18.827) 23.557 46.591 ( 6.491 16.466 -31.477) 36.112 ======================= Grid point 472 (232/355) ======================= q-point: (-0.08 0.17 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.472 ( 0.145 10.837 21.634) 24.196 2.830 ( -1.130 27.993 9.334) 29.530 3.123 ( 9.703 11.604 0.080) 15.126 3.873 ( 3.440 18.378 -20.309) 27.605 4.881 ( 1.552 13.215 20.011) 24.032 5.124 ( -9.175 18.291 10.187) 22.859 5.321 ( 10.903 44.800 9.321) 47.040 5.875 ( -12.073 -12.511 4.268) 17.902 6.276 ( 0.094 -6.733 6.180) 9.140 7.022 ( -15.639 -14.811 -13.355) 25.344 7.367 ( 3.258 1.101 -0.163) 3.443 8.460 ( 11.053 -9.650 -16.720) 22.245 10.145 ( -4.257 -0.943 8.234) 9.317 10.674 ( 3.984 -10.913 -7.247) 13.692 11.740 ( 0.054 -17.971 8.631) 19.937 11.996 ( -2.033 -26.146 -0.663) 26.234 12.797 ( -0.276 -7.674 3.619) 8.489 13.048 ( -9.472 -8.071 -5.554) 13.627 13.604 ( 3.593 -8.453 3.885) 9.973 13.996 ( 17.594 -8.827 -0.442) 19.689 15.589 ( -13.433 11.395 -1.253) 17.659 15.719 ( 1.821 9.549 2.034) 9.931 16.259 ( -3.504 13.579 3.180) 14.380 16.746 ( 4.171 0.523 -10.977) 11.754 20.651 ( -3.761 1.755 0.677) 4.205 20.752 ( 1.634 2.509 -0.798) 3.098 21.682 ( 0.327 -1.237 0.984) 1.614 21.793 ( 5.270 -0.051 -1.969) 5.626 24.840 ( -6.455 -2.995 8.532) 11.110 25.263 ( 3.056 -0.964 -3.869) 5.023 32.438 ( -0.560 2.588 -0.201) 2.656 32.471 ( 2.110 2.908 -0.661) 3.653 42.214 ( -10.459 2.996 4.515) 11.779 42.825 ( 16.415 3.643 -6.448) 18.008 44.875 ( 1.127 17.703 14.710) 23.044 46.130 ( 9.155 29.991 -32.603) 45.235 ======================= Grid point 476 (233/355) ======================= q-point: ( 0.25 0.25 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 354 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.575 ( 17.918 0.000 -1.761) 18.005 2.587 ( -1.969 -0.000 -23.217) 23.300 3.298 ( 7.404 0.000 19.472) 20.832 4.276 ( 28.868 0.000 7.558) 29.841 4.406 ( 29.625 0.000 1.031) 29.643 4.504 ( -23.554 -0.000 16.825) 28.946 5.382 ( -23.856 -0.000 -6.834) 24.815 5.983 ( 21.226 0.000 20.992) 29.853 6.491 ( 6.679 0.000 -21.388) 22.406 6.841 ( -3.303 -0.000 4.739) 5.776 6.936 ( 0.133 0.000 12.979) 12.980 8.729 ( 1.536 0.000 -19.435) 19.495 10.064 ( -4.895 -0.000 8.336) 9.667 11.158 ( 8.545 0.000 -11.848) 14.607 11.702 ( -18.383 -0.000 -7.053) 19.689 11.991 ( -25.624 -0.000 15.615) 30.007 13.220 ( 0.356 0.000 -1.792) 1.826 13.286 ( -10.933 -0.000 -2.159) 11.144 14.268 ( 7.632 0.000 -1.658) 7.810 14.288 ( -4.270 -0.000 -3.975) 5.834 14.574 ( -14.053 -0.000 0.641) 14.068 15.020 ( 2.347 0.000 10.440) 10.700 16.122 ( 5.358 0.000 2.720) 6.009 16.797 ( 7.002 0.000 -19.823) 21.024 20.626 ( 1.716 0.000 -0.297) 1.741 20.813 ( 2.259 0.000 -1.570) 2.751 21.680 ( -0.135 -0.000 0.100) 0.168 21.901 ( 2.401 0.000 -0.004) 2.401 24.733 ( -5.216 -0.000 7.990) 9.542 25.327 ( -0.826 -0.000 -2.437) 2.573 32.445 ( 1.382 0.000 -0.895) 1.647 32.513 ( 3.414 0.000 -0.670) 3.479 42.091 ( 11.111 0.000 14.569) 18.322 44.414 ( 7.241 0.000 -1.715) 7.441 44.717 ( 22.938 0.000 -16.832) 28.452 44.935 ( 13.758 0.000 -7.006) 15.439 ======================= Grid point 477 (234/355) ======================= q-point: ( 0.33 0.25 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.563 ( 2.099 -7.131 -14.609) 16.391 2.849 ( 18.192 -8.709 1.127) 20.200 3.482 ( 7.493 -3.166 17.453) 19.255 4.319 ( -21.504 1.242 16.032) 26.852 4.507 ( 19.858 5.188 3.627) 20.843 4.774 ( 19.384 -7.289 5.890) 21.530 5.102 ( -18.993 1.535 -3.789) 19.428 6.258 ( -0.985 -5.169 21.209) 21.852 6.336 ( -3.470 6.360 -8.300) 11.017 6.874 ( 13.965 -0.059 -9.419) 16.845 7.171 ( 15.789 -7.403 7.047) 18.808 8.615 ( 0.610 3.547 -20.335) 20.651 10.069 ( -4.267 -1.563 8.660) 9.780 11.144 ( 6.643 4.652 -10.653) 13.389 11.399 ( -13.618 10.698 -8.490) 19.287 11.807 ( -22.671 1.679 12.690) 26.035 12.918 ( -3.638 15.858 -3.501) 16.642 13.422 ( -0.975 -9.474 0.273) 9.528 14.046 ( 3.407 10.160 -0.950) 10.758 14.418 ( -4.792 -7.247 -7.066) 11.199 14.603 ( -11.536 -13.313 2.214) 17.755 15.094 ( -2.047 -1.900 6.095) 6.705 16.133 ( 2.028 5.007 6.351) 8.338 16.822 ( 5.200 -5.082 -17.258) 18.727 20.620 ( 1.941 2.616 0.262) 3.268 20.832 ( 2.587 -0.395 -1.951) 3.265 21.684 ( 0.008 -0.143 0.299) 0.332 21.927 ( 1.895 -0.648 -0.308) 2.027 24.724 ( -4.394 -0.202 8.158) 9.269 25.299 ( -0.747 0.692 -3.274) 3.428 32.455 ( 2.122 0.081 -1.023) 2.358 32.553 ( 2.868 -1.096 -0.538) 3.117 42.283 ( 11.316 0.697 18.729) 21.893 44.403 ( 13.239 7.225 -0.060) 15.082 44.854 ( 15.771 0.022 -16.213) 22.619 45.225 ( 8.408 -20.723 -6.795) 23.373 ======================= Grid point 478 (235/355) ======================= q-point: ( 0.42 0.25 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.696 ( 4.482 -8.977 -5.402) 11.395 3.155 ( 12.778 -4.872 5.431) 14.714 3.719 ( 7.863 -8.674 7.873) 14.108 4.159 ( -22.043 0.357 17.002) 27.840 4.571 ( 7.512 3.335 2.022) 8.464 4.976 ( -5.563 -3.659 5.710) 8.771 5.002 ( 7.658 3.514 9.743) 12.881 6.153 ( -10.697 -0.102 -4.406) 11.569 6.475 ( -1.354 -10.536 18.830) 21.620 6.986 ( 19.407 2.032 -16.031) 25.254 7.410 ( 11.009 -0.883 -0.123) 11.045 8.456 ( 1.009 4.289 -21.193) 21.647 10.115 ( -3.474 -3.432 9.757) 10.911 11.026 ( -3.841 6.855 -8.171) 11.336 11.069 ( 1.769 14.100 -8.398) 16.506 11.613 ( -17.762 2.955 9.349) 20.289 12.666 ( 3.712 12.310 -2.658) 13.130 13.507 ( 5.873 3.300 1.500) 6.901 14.069 ( 3.223 -7.796 2.565) 8.817 14.396 ( -6.493 -1.244 -4.150) 7.806 14.753 ( -15.632 -20.583 -5.151) 26.354 15.071 ( -4.390 1.865 0.648) 4.814 16.071 ( -3.201 5.791 10.439) 12.360 16.874 ( 5.651 -2.805 -15.657) 16.881 20.597 ( 1.684 2.200 1.067) 2.969 20.859 ( 2.710 -0.655 -2.020) 3.443 21.682 ( -0.082 0.637 0.537) 0.838 21.952 ( 1.157 -0.519 -0.291) 1.301 24.726 ( -3.884 -0.421 8.343) 9.212 25.265 ( -0.012 0.708 -4.081) 4.142 32.480 ( 2.894 -0.522 -0.693) 3.021 32.597 ( 1.966 -1.472 -0.398) 2.488 42.439 ( 8.355 2.937 18.791) 20.774 44.490 ( 18.258 2.681 3.774) 18.836 44.853 ( 6.020 3.887 -17.336) 18.759 45.658 ( 4.347 -25.514 -5.092) 26.378 ======================= Grid point 479 (236/355) ======================= q-point: ( 0.50 0.25 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.862 ( 5.297 -4.792 2.634) 7.614 3.283 ( 8.045 3.793 7.021) 11.331 3.842 ( -12.308 0.603 0.173) 12.324 4.142 ( 4.572 -5.072 14.507) 16.034 4.681 ( 3.126 -9.431 6.451) 11.846 4.922 ( -14.449 -2.820 17.680) 23.006 5.166 ( 11.296 -0.910 5.548) 12.618 6.091 ( -10.731 -8.832 -1.237) 13.953 6.715 ( -1.827 -5.268 10.472) 11.864 6.946 ( 9.589 10.534 -14.586) 20.388 7.455 ( 4.999 1.574 -4.760) 7.079 8.329 ( 3.485 0.499 -22.835) 23.105 10.192 ( -3.242 -3.855 10.379) 11.537 10.846 ( -1.314 8.005 -5.822) 9.985 10.864 ( 5.866 10.085 -4.371) 12.459 11.443 ( -13.583 2.844 5.656) 14.986 12.553 ( 11.982 10.108 -0.843) 15.699 13.480 ( 9.027 8.414 1.208) 12.399 14.150 ( -8.547 3.332 2.358) 9.472 14.468 ( 1.123 -15.996 -4.008) 16.529 14.828 ( -13.304 -4.270 -3.078) 14.308 15.050 ( -7.907 -12.585 -4.474) 15.522 16.003 ( -5.631 1.860 11.718) 13.133 16.874 ( 7.147 1.765 -15.681) 17.323 20.598 ( 1.529 0.158 1.707) 2.297 20.885 ( 1.952 -0.746 -1.980) 2.879 21.667 ( 0.224 1.578 1.160) 1.971 21.959 ( 0.056 0.468 -0.139) 0.492 24.735 ( -3.688 -0.523 8.540) 9.316 25.240 ( 0.856 0.338 -4.602) 4.693 32.520 ( 3.087 -0.736 -0.152) 3.177 32.635 ( 1.037 -1.391 -0.237) 1.751 42.523 ( 4.859 4.487 16.808) 18.063 44.593 ( 17.097 13.753 -15.887) 27.090 44.786 ( 0.296 -5.425 6.361) 8.366 46.085 ( 1.968 -24.173 -6.298) 25.058 ======================= Grid point 480 (237/355) ======================= q-point: ( 0.58 0.25 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.981 ( 6.437 -0.393 7.913) 10.208 3.325 ( 8.683 4.040 7.510) 12.170 3.615 ( -10.066 9.461 2.261) 13.999 4.392 ( 6.257 -8.199 13.687) 17.138 4.932 ( -12.803 -13.265 17.022) 25.092 5.003 ( 5.383 -8.775 -1.633) 10.423 5.270 ( -6.538 -7.093 10.941) 14.586 6.225 ( -15.245 -14.001 -6.659) 21.744 6.461 ( 9.263 24.266 3.939) 26.271 6.976 ( 7.169 -3.111 -9.231) 12.095 7.412 ( -5.032 2.294 1.377) 5.699 8.306 ( 5.675 -4.054 -24.152) 25.139 10.262 ( -3.460 -2.718 9.333) 10.318 10.628 ( 2.486 14.464 -1.226) 14.727 10.865 ( 7.251 -1.521 -2.971) 7.983 11.302 ( -10.606 1.612 2.986) 11.136 12.543 ( 18.204 9.392 0.502) 20.490 13.425 ( 6.483 7.614 -1.465) 10.107 13.928 ( -14.772 8.588 2.209) 17.229 14.467 ( -8.875 11.464 -5.188) 15.398 14.946 ( 0.925 -20.216 1.721) 20.310 15.237 ( -6.168 -18.673 -4.576) 20.191 16.027 ( -5.961 -5.658 9.417) 12.499 16.828 ( 7.918 3.568 -15.885) 18.105 20.636 ( 1.670 -1.504 2.169) 3.124 20.903 ( 0.692 -0.802 -1.971) 2.237 21.649 ( 1.439 2.364 1.967) 3.396 21.932 ( -1.414 1.890 -0.248) 2.373 24.747 ( -3.698 -0.511 8.741) 9.505 25.228 ( 1.553 -0.026 -4.877) 5.119 32.558 ( 2.756 -0.181 0.258) 2.774 32.659 ( 0.168 -0.719 -0.142) 0.752 42.547 ( 1.912 5.256 14.879) 15.896 44.297 ( 0.928 17.233 -22.260) 28.166 45.013 ( 8.953 -4.959 16.956) 19.806 46.431 ( 1.595 -19.472 -10.581) 22.218 ======================= Grid point 481 (238/355) ======================= q-point: (-0.33 0.25 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.083 ( 7.381 2.655 8.304) 11.423 3.347 ( 0.861 7.018 5.208) 8.782 3.492 ( 6.510 -0.677 10.105) 12.039 4.604 ( 1.924 -1.844 13.908) 14.161 5.032 ( -10.519 -13.167 -3.702) 17.254 5.181 ( -9.061 -9.929 3.510) 13.893 5.444 ( -1.558 -9.013 15.511) 18.007 5.808 ( -23.368 13.113 -4.868) 27.235 6.635 ( 19.009 -1.688 7.742) 20.595 6.979 ( 11.194 7.264 -11.338) 17.510 7.365 ( -10.498 -6.274 5.037) 13.227 8.309 ( 4.081 -3.119 -24.949) 25.472 10.292 ( -4.390 -1.010 6.624) 8.011 10.419 ( 2.031 12.831 1.203) 13.046 10.993 ( 9.190 -3.954 -0.785) 10.035 11.224 ( -7.191 -2.408 1.398) 7.712 12.601 ( 21.876 8.029 1.225) 23.335 13.311 ( -5.712 6.263 -6.167) 10.483 13.646 ( -9.246 10.351 5.505) 14.931 14.113 ( -9.423 14.498 -3.199) 17.585 15.305 ( 5.447 -16.378 0.651) 17.272 15.485 ( -4.424 -18.003 -0.622) 18.549 16.139 ( -5.061 -9.659 5.193) 12.078 16.777 ( 5.436 2.047 -14.845) 15.941 20.693 ( 1.645 -1.721 2.375) 3.363 20.906 ( -0.629 -0.560 -2.129) 2.290 21.641 ( 3.496 2.534 2.701) 5.094 21.868 ( -2.540 2.920 -0.675) 3.928 24.758 ( -3.820 -0.485 8.932) 9.726 25.226 ( 2.027 -0.222 -5.009) 5.408 32.580 ( 2.289 0.862 0.446) 2.486 32.657 ( -0.632 0.603 -0.283) 0.918 42.526 ( -0.401 5.801 13.368) 14.578 43.881 ( -3.704 18.095 -21.064) 28.016 45.234 ( 6.685 -1.254 19.885) 21.016 46.665 ( 3.410 -12.776 -16.635) 21.250 ======================= Grid point 482 (239/355) ======================= q-point: (-0.25 0.25 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.040 ( 2.054 11.578 8.607) 14.572 3.314 ( 5.266 2.827 4.584) 7.532 3.729 ( 12.032 -5.126 11.715) 17.559 4.587 ( -9.442 5.060 -0.768) 10.740 4.948 ( -10.443 8.047 3.939) 13.759 5.251 ( -11.915 -11.813 6.967) 18.167 5.550 ( 0.730 0.399 -0.125) 0.841 5.694 ( -12.244 -16.483 10.716) 23.161 6.670 ( -1.792 8.292 -0.348) 8.491 6.990 ( 15.931 8.204 7.241) 19.328 7.452 ( 2.203 -6.853 -1.738) 7.405 8.258 ( 3.357 -0.762 -25.939) 26.167 10.248 ( -0.923 6.803 3.607) 7.755 10.294 ( -3.042 0.374 2.707) 4.089 11.151 ( 7.748 -4.810 1.184) 9.196 11.263 ( -3.082 -7.503 -0.168) 8.114 12.714 ( 19.428 5.073 1.930) 20.172 13.043 ( -18.426 4.417 -7.909) 20.532 13.476 ( -1.570 8.474 7.388) 11.351 13.850 ( 1.448 8.309 -3.137) 8.999 15.584 ( 4.717 -9.795 2.138) 11.080 15.712 ( -4.699 -13.541 0.541) 14.343 16.282 ( -1.902 -9.304 2.013) 9.707 16.726 ( -0.471 -0.177 -12.320) 12.331 20.735 ( 0.122 -0.500 2.315) 2.371 20.884 ( -1.359 0.792 -2.320) 2.803 21.661 ( 4.604 1.701 2.866) 5.684 21.794 ( -1.120 2.461 -1.277) 2.990 24.769 ( -4.037 -0.578 9.079) 9.953 25.229 ( 2.342 -0.333 -5.024) 5.553 32.578 ( 1.570 1.996 0.487) 2.586 32.623 ( -0.785 2.140 -0.689) 2.381 42.470 ( -2.273 6.232 11.968) 13.684 43.455 ( -3.322 16.845 -18.281) 25.079 45.355 ( 2.292 3.678 20.793) 21.240 46.768 ( 6.359 -4.232 -22.737) 23.986 ======================= Grid point 483 (240/355) ======================= q-point: (-0.17 0.25 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.892 ( 1.337 12.975 13.008) 18.421 3.316 ( 4.946 5.651 -1.490) 7.656 3.799 ( 2.757 16.315 7.426) 18.137 4.297 ( -4.350 8.483 -6.095) 11.315 4.949 ( -6.096 -5.309 19.255) 20.883 5.337 ( -0.577 -5.013 6.808) 8.474 5.559 ( -5.728 -4.085 2.264) 7.391 5.856 ( -12.768 -10.013 -2.868) 16.478 6.497 ( -12.597 2.391 7.465) 14.837 6.931 ( 12.387 20.980 9.416) 26.120 7.561 ( 11.365 2.303 -5.723) 12.931 8.205 ( 4.924 -3.947 -24.959) 25.744 10.171 ( -0.685 3.611 5.613) 6.709 10.322 ( -2.436 -6.820 -0.367) 7.251 11.344 ( 6.776 -9.094 3.060) 11.746 11.378 ( -2.911 -9.849 -2.161) 10.495 12.694 ( -13.389 1.945 -2.583) 13.774 12.885 ( -2.157 -1.497 -3.219) 4.154 13.448 ( 12.456 2.462 7.683) 14.841 13.836 ( 10.815 0.426 -2.936) 11.215 15.736 ( 1.048 -2.494 3.517) 4.437 15.818 ( -6.728 -5.644 -0.691) 8.809 16.419 ( 2.202 -5.173 1.440) 5.804 16.653 ( -6.707 -1.538 -9.206) 11.493 20.718 ( -4.025 1.380 1.403) 4.480 20.845 ( 1.125 2.240 -1.178) 2.770 21.670 ( -0.859 0.828 0.882) 1.484 21.791 ( 6.609 0.496 -1.052) 6.711 24.780 ( -4.450 -0.839 9.086) 10.152 25.238 ( 2.548 -0.554 -4.854) 5.510 32.540 ( -1.135 2.984 -0.158) 3.196 32.579 ( 1.850 3.021 -0.539) 3.583 42.380 ( -4.527 6.668 9.889) 12.757 43.123 ( 2.963 12.536 -13.594) 18.728 45.343 ( -1.655 8.987 19.208) 21.271 46.714 ( 8.804 6.306 -27.225) 29.300 ======================= Grid point 484 (241/355) ======================= q-point: (-0.08 0.25 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.765 ( 1.401 11.994 17.319) 21.113 3.174 ( 2.032 13.374 -2.969) 13.850 3.498 ( 3.848 19.134 4.419) 20.011 4.144 ( 10.087 14.192 -8.308) 19.292 4.967 ( -14.212 0.824 18.359) 23.232 5.431 ( -1.788 15.556 8.382) 17.761 5.605 ( -10.115 -8.096 1.249) 13.017 5.758 ( -4.431 -9.513 -2.859) 10.876 6.419 ( -7.698 6.498 14.649) 17.778 6.709 ( 4.100 12.968 1.648) 13.700 7.515 ( 8.508 9.956 -7.322) 15.004 8.300 ( 8.450 -10.919 -20.088) 24.375 10.153 ( -2.081 1.178 7.419) 7.795 10.472 ( 1.179 -12.329 -3.531) 12.879 11.513 ( -4.989 -12.354 -1.465) 13.404 11.623 ( 3.326 -16.054 3.344) 16.733 12.555 ( -15.779 -7.542 -7.340) 18.967 12.879 ( -5.637 -3.474 2.941) 7.246 13.668 ( 20.027 -1.505 4.375) 20.555 14.012 ( 16.005 -7.493 -2.213) 17.810 15.630 ( -13.030 8.939 0.116) 15.802 15.833 ( 0.898 0.548 3.139) 3.310 16.406 ( -5.508 7.906 1.120) 9.701 16.650 ( 0.284 -8.015 -6.770) 10.496 20.643 ( -4.820 2.012 0.896) 5.299 20.818 ( 2.235 2.892 -0.032) 3.655 21.658 ( -0.964 -0.903 -0.468) 1.402 21.852 ( 6.946 0.394 -2.041) 7.250 24.790 ( -5.188 -1.079 8.818) 10.288 25.256 ( 2.576 -1.006 -4.378) 5.179 32.472 ( -1.190 2.951 -0.846) 3.293 32.549 ( 2.769 3.241 -0.194) 4.267 42.242 ( -6.769 7.341 6.345) 11.831 43.013 ( 14.046 4.251 -7.235) 16.361 45.205 ( -3.180 13.585 15.074) 20.540 46.476 ( 10.039 18.033 -28.633) 35.296 ======================= Grid point 489 (242/355) ======================= q-point: ( 0.33 0.33 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 355 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.523 ( 9.392 0.000 -5.695) 10.984 2.989 ( 22.821 0.000 1.196) 22.852 3.593 ( 4.076 0.000 16.871) 17.357 4.146 ( -26.442 -0.000 18.824) 32.458 4.732 ( 15.379 0.000 -7.815) 17.251 4.917 ( -17.580 -0.000 3.037) 17.840 4.984 ( 22.837 0.000 9.548) 24.752 6.267 ( -7.159 -0.000 22.488) 23.600 6.284 ( -13.928 -0.000 -4.959) 14.784 6.992 ( 21.812 0.000 -15.247) 26.612 7.360 ( 25.097 0.000 4.670) 25.528 8.545 ( -1.346 -0.000 -20.756) 20.799 10.050 ( -4.196 -0.000 8.328) 9.326 11.164 ( -1.489 -0.000 -11.448) 11.545 11.367 ( -2.403 -0.000 -9.162) 9.472 11.653 ( -22.144 -0.000 13.871) 26.130 13.047 ( -9.831 -0.000 -1.766) 9.988 13.236 ( 2.664 0.000 -1.192) 2.918 14.092 ( -11.863 -0.000 -12.843) 17.484 14.185 ( -2.002 -0.000 -6.570) 6.868 14.568 ( 2.704 0.000 9.528) 9.905 15.077 ( -4.907 -0.000 8.474) 9.792 16.233 ( 1.895 0.000 4.959) 5.309 16.732 ( 3.748 0.000 -15.525) 15.971 20.669 ( 2.518 0.000 -0.087) 2.520 20.842 ( 2.511 0.000 -2.427) 3.492 21.689 ( 0.389 0.000 1.210) 1.271 21.935 ( 1.395 0.000 -0.834) 1.626 24.719 ( -3.824 -0.000 8.236) 9.080 25.280 ( -0.861 -0.000 -3.701) 3.800 32.471 ( 2.198 0.000 -0.934) 2.388 32.570 ( 2.709 0.000 -0.522) 2.759 42.509 ( 10.730 0.000 24.498) 26.745 44.568 ( 8.387 0.000 0.730) 8.418 44.951 ( 18.152 0.000 -23.724) 29.872 45.101 ( 8.018 0.000 -1.050) 8.086 ======================= Grid point 490 (243/355) ======================= q-point: ( 0.42 0.33 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.670 ( 13.441 -4.061 1.583) 14.131 3.269 ( 20.721 -3.877 4.882) 21.639 3.710 ( 1.839 -2.849 6.564) 7.388 4.009 ( -21.283 -2.589 23.195) 31.586 4.698 ( -0.626 6.385 2.427) 6.860 4.869 ( -5.427 -2.673 3.549) 7.014 5.234 ( 17.209 0.458 7.337) 18.714 6.037 ( -18.842 5.371 -4.703) 20.149 6.363 ( -5.422 -8.062 20.079) 22.306 7.165 ( 27.112 0.376 -17.720) 32.392 7.573 ( 15.074 3.408 0.192) 15.456 8.407 ( -2.374 2.363 -21.160) 21.423 10.071 ( -3.708 -2.527 9.122) 10.166 11.014 ( -6.754 4.825 -10.166) 13.124 11.286 ( 7.053 8.482 -7.822) 13.523 11.500 ( -18.727 0.240 10.630) 21.534 12.852 ( -0.899 8.615 -0.632) 8.685 13.407 ( -0.251 -12.413 -0.193) 12.417 14.014 ( -5.545 -8.730 -10.569) 14.787 14.146 ( -6.704 -4.307 -6.888) 10.533 14.584 ( 0.722 4.957 7.148) 8.728 15.051 ( -5.894 0.630 3.679) 6.976 16.199 ( -1.834 6.744 7.556) 10.293 16.771 ( 4.801 -6.229 -14.228) 16.257 20.666 ( 2.211 2.781 0.423) 3.578 20.863 ( 2.495 -0.716 -2.651) 3.710 21.698 ( 0.501 0.367 1.611) 1.726 21.948 ( 0.755 -0.666 -1.068) 1.468 24.722 ( -3.433 -0.203 8.366) 9.045 25.252 ( -0.280 0.265 -4.241) 4.259 32.496 ( 2.617 -0.497 -0.578) 2.726 32.597 ( 1.922 -0.647 -0.491) 2.086 42.686 ( 7.369 3.844 25.486) 26.807 44.645 ( 8.577 0.135 4.470) 9.673 44.962 ( 13.383 5.173 -24.346) 28.259 45.325 ( 6.092 -16.657 -1.992) 17.847 ======================= Grid point 491 (244/355) ======================= q-point: ( 0.50 0.33 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.903 ( 13.987 -4.193 6.202) 15.865 3.507 ( 15.420 3.016 11.964) 19.749 3.711 ( -9.680 -1.345 -2.320) 10.044 4.114 ( -1.396 -11.206 19.207) 22.281 4.672 ( 1.668 0.942 10.285) 10.462 4.835 ( -10.368 0.282 14.512) 17.838 5.347 ( 9.108 6.090 -0.712) 10.980 5.786 ( -18.851 -5.187 -5.130) 20.214 6.577 ( -3.002 -11.155 13.390) 17.684 7.271 ( 20.624 11.660 -13.044) 27.045 7.545 ( 5.027 6.240 -5.615) 9.785 8.248 ( -1.591 1.247 -22.634) 22.724 10.139 ( -3.600 -4.132 10.397) 11.753 10.853 ( -1.330 3.369 -8.205) 8.969 11.137 ( 2.763 12.052 -0.774) 12.389 11.376 ( -9.810 1.772 3.179) 10.463 12.778 ( 7.514 4.914 1.410) 9.088 13.558 ( -1.495 -5.019 -1.261) 5.387 14.106 ( -9.501 -8.140 -5.107) 13.513 14.188 ( 2.027 -12.167 -5.008) 13.312 14.537 ( -3.918 -1.671 1.108) 4.402 14.968 ( -4.516 3.364 -1.524) 5.834 16.078 ( -5.932 7.115 11.270) 14.588 16.852 ( 6.604 -3.659 -14.885) 16.690 20.644 ( 1.699 2.254 1.434) 3.166 20.883 ( 1.633 -0.489 -2.819) 3.294 21.703 ( 1.083 0.873 2.153) 2.563 21.956 ( -0.167 -0.370 -1.100) 1.172 24.732 ( -3.278 -0.320 8.537) 9.150 25.230 ( 0.565 0.101 -4.662) 4.697 32.534 ( 2.685 -0.985 -0.046) 2.860 32.624 ( 1.016 -1.002 -0.442) 1.493 42.761 ( 4.041 6.900 22.905) 24.261 44.727 ( -1.141 3.694 -7.704) 8.620 44.888 ( 16.096 2.946 -6.617) 17.650 45.695 ( 4.290 -21.920 -4.739) 22.833 ======================= Grid point 492 (245/355) ======================= q-point: (-0.42 -0.67 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.117 ( 13.119 -0.778 8.508) 15.656 3.562 ( 0.448 6.182 2.181) 6.570 3.638 ( 2.753 3.609 10.182) 11.148 4.422 ( 8.565 -10.222 12.668) 18.394 4.682 ( -12.827 -2.712 18.850) 22.961 4.960 ( 5.010 -7.903 11.548) 14.863 5.190 ( -9.119 4.921 -2.412) 10.640 5.791 ( -17.719 -12.599 -7.249) 22.918 6.730 ( -2.120 -3.234 8.303) 9.159 7.125 ( 16.259 13.037 -6.059) 21.703 7.445 ( -1.092 7.738 -7.488) 10.823 8.162 ( 1.772 -3.789 -24.577) 24.930 10.218 ( -3.979 -3.726 10.474) 11.808 10.781 ( 0.357 3.888 -4.828) 6.209 10.989 ( 4.229 7.262 2.322) 8.719 11.261 ( -4.685 3.908 -0.605) 6.131 12.820 ( 12.780 4.276 3.109) 13.830 13.509 ( -7.145 3.349 -5.253) 9.479 14.021 ( -3.217 7.827 3.568) 9.184 14.458 ( 1.676 -9.093 -8.350) 12.459 14.598 ( -5.545 -13.683 1.042) 14.801 14.912 ( -2.206 -7.945 -4.823) 9.553 15.982 ( -7.376 2.230 12.507) 14.690 16.872 ( 7.344 1.286 -15.957) 17.613 20.648 ( 1.156 -0.001 2.508) 2.762 20.885 ( 0.197 -0.409 -2.908) 2.943 21.713 ( 2.489 1.397 2.781) 3.985 21.940 ( -1.187 0.951 -1.309) 2.007 24.745 ( -3.309 -0.327 8.729) 9.341 25.218 ( 1.317 -0.207 -4.926) 5.103 32.576 ( 2.207 -0.887 0.414) 2.414 32.645 ( 0.211 -0.963 -0.427) 1.075 42.760 ( 1.577 8.003 20.125) 21.715 44.441 ( -3.585 14.535 -21.749) 26.403 45.096 ( 9.424 -5.574 12.605) 16.696 46.072 ( 4.987 -20.981 -9.343) 23.503 ======================= Grid point 493 (246/355) ======================= q-point: (-0.33 -0.67 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.271 ( 12.501 2.442 7.995) 15.038 3.433 ( -6.588 3.635 -0.158) 7.527 3.701 ( 15.405 6.244 14.223) 21.877 4.699 ( -2.188 -4.255 7.034) 8.507 4.739 ( -1.726 -7.279 14.873) 16.648 4.907 ( -13.705 -2.764 -0.312) 13.985 5.376 ( 6.631 -13.119 15.058) 21.043 5.597 ( -31.033 0.952 -7.283) 31.891 6.830 ( 11.137 -1.147 4.158) 11.943 7.156 ( -15.541 -2.092 1.276) 15.733 7.241 ( 21.517 8.974 -8.727) 24.893 8.145 ( 1.226 -5.091 -25.540) 26.071 10.265 ( -4.836 -1.404 8.976) 10.292 10.632 ( -1.558 10.286 0.398) 10.411 11.037 ( 7.630 -2.776 0.522) 8.136 11.160 ( -1.339 3.193 -1.615) 3.821 12.896 ( 13.521 4.826 4.074) 14.924 13.271 ( -16.555 7.030 -7.295) 19.409 13.875 ( 5.810 12.704 5.413) 14.981 14.279 ( -2.609 14.061 -6.544) 15.727 14.961 ( -2.416 -25.107 1.667) 25.278 15.157 ( 3.152 -19.235 -4.767) 20.066 15.979 ( -7.493 -4.443 10.165) 13.387 16.814 ( 5.246 4.219 -15.602) 16.993 20.685 ( 0.171 -1.705 3.075) 3.520 20.878 ( -0.574 -0.638 -2.820) 2.948 21.731 ( 3.640 1.891 3.087) 5.134 21.890 ( -1.252 2.494 -1.740) 3.288 24.757 ( -3.451 -0.262 8.911) 9.560 25.217 ( 1.848 -0.428 -5.078) 5.421 32.607 ( 1.284 -0.230 0.680) 1.471 32.653 ( -0.271 -0.262 -0.585) 0.696 42.717 ( -0.337 8.348 18.047) 19.888 44.024 ( -5.933 16.741 -21.676) 28.023 45.320 ( 2.691 -5.009 16.709) 17.650 46.400 ( 8.364 -16.517 -14.785) 23.693 ======================= Grid point 494 (247/355) ======================= q-point: (-0.25 0.33 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.261 ( -0.190 7.984 3.576) 8.750 3.416 ( 6.862 1.028 3.285) 7.677 3.889 ( 17.518 -0.001 15.031) 23.083 4.538 ( -10.842 3.651 -14.874) 18.765 4.899 ( -18.723 -12.516 12.508) 25.761 4.991 ( -0.389 1.742 15.067) 15.172 5.298 ( -18.737 -7.300 0.821) 20.126 5.687 ( 7.565 -5.607 16.292) 18.818 6.718 ( -14.818 10.160 -7.541) 19.485 7.169 ( 3.184 -8.201 9.654) 13.061 7.446 ( 24.303 -2.164 -6.954) 25.370 8.111 ( 0.131 -4.072 -25.721) 26.042 10.243 ( -6.146 1.217 5.731) 8.491 10.451 ( -0.775 10.203 2.597) 10.557 11.117 ( -3.075 -3.735 -2.672) 5.526 11.196 ( 10.324 -2.330 1.635) 10.709 12.905 ( -21.149 8.887 -7.455) 24.121 12.945 ( 6.694 4.622 4.103) 9.111 13.767 ( 12.387 13.540 4.921) 18.999 14.039 ( 5.925 11.292 -4.678) 13.583 15.327 ( -5.038 -21.614 0.805) 22.208 15.484 ( 5.638 -14.098 -0.260) 15.186 16.071 ( -6.362 -10.494 5.610) 13.493 16.706 ( 0.834 4.103 -12.870) 13.534 20.717 ( -2.534 -1.318 2.535) 3.819 20.873 ( 0.355 -0.437 -2.062) 2.137 21.732 ( 0.049 2.431 1.588) 2.904 21.844 ( 3.992 2.418 -1.134) 4.803 24.766 ( -3.667 -0.191 9.040) 9.757 25.221 ( 2.179 -0.523 -5.141) 5.608 32.608 ( -0.781 0.886 0.320) 1.224 32.646 ( 0.768 0.806 -0.506) 1.223 42.641 ( -2.061 8.692 16.084) 18.398 43.599 ( -4.769 15.420 -19.070) 24.984 45.453 ( -3.687 -2.049 17.123) 17.635 46.644 ( 12.042 -9.368 -19.154) 24.488 ======================= Grid point 495 (248/355) ======================= q-point: (-0.17 0.33 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.138 ( -0.443 8.687 6.385) 10.791 3.443 ( 5.898 4.730 -1.251) 7.663 4.037 ( 1.292 7.531 3.021) 8.217 4.353 ( 2.426 1.398 -2.592) 3.815 4.894 ( -14.504 -3.567 12.572) 19.523 5.028 ( -14.110 -12.714 12.911) 22.966 5.439 ( 1.623 -9.939 1.786) 10.228 5.831 ( 4.296 5.395 13.227) 14.917 6.377 ( -22.005 2.964 0.517) 22.210 7.327 ( 9.496 4.298 5.884) 11.969 7.688 ( 20.958 -2.771 -6.651) 22.162 8.048 ( -0.279 -2.992 -25.451) 25.628 10.190 ( -4.992 -0.472 2.614) 5.655 10.318 ( -0.056 6.321 4.098) 7.534 11.165 ( -3.043 -7.111 -4.087) 8.748 11.350 ( 7.820 -3.821 2.928) 9.183 12.520 ( -21.875 5.410 -9.098) 24.301 12.904 ( -2.814 4.572 4.955) 7.306 13.770 ( 22.888 8.549 4.487) 24.841 13.982 ( 11.846 4.985 -3.096) 13.220 15.568 ( -8.033 -14.204 -1.092) 16.355 15.699 ( 2.256 -5.774 4.335) 7.565 16.246 ( -2.643 -13.448 1.008) 13.742 16.586 ( -3.228 3.073 -7.851) 9.028 20.692 ( -5.050 0.492 1.337) 5.247 20.881 ( 1.632 0.362 -0.496) 1.744 21.676 ( -2.115 2.039 -0.614) 3.001 21.876 ( 7.365 1.259 -0.727) 7.508 24.772 ( -3.987 -0.155 9.050) 9.891 25.230 ( 2.355 -0.618 -5.081) 5.634 32.566 ( -1.845 2.170 -0.588) 2.909 32.638 ( 1.677 1.681 -0.060) 2.375 42.527 ( -4.195 9.364 12.890) 16.476 43.279 ( 1.784 10.756 -13.758) 17.554 45.469 ( -7.832 1.973 14.748) 16.815 46.761 ( 13.499 -0.060 -21.514) 25.398 ======================= Grid point 496 (249/355) ======================= q-point: (-0.08 0.33 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.022 ( -0.198 9.202 9.339) 13.113 3.364 ( 4.372 8.500 -4.083) 10.394 3.793 ( -1.882 14.087 -0.934) 14.242 4.412 ( 8.175 5.133 2.617) 10.001 4.862 ( -19.185 -3.588 17.360) 26.122 5.228 ( -8.805 -17.886 -0.911) 19.957 5.587 ( -3.897 3.750 7.539) 9.278 5.680 ( -0.282 4.303 0.520) 4.344 6.276 ( -11.528 -4.205 16.458) 20.529 7.242 ( 10.431 19.001 2.167) 21.784 7.764 ( 9.988 11.372 -8.455) 17.337 8.083 ( 7.540 -12.695 -21.662) 26.216 10.187 ( -1.794 -0.173 4.322) 4.682 10.309 ( 0.095 -4.599 1.670) 4.894 11.239 ( -5.272 -9.552 -6.567) 12.734 11.515 ( 4.388 -6.671 5.000) 9.421 12.249 ( -17.410 -3.057 -10.706) 20.665 12.832 ( -4.060 1.537 5.871) 7.302 13.937 ( 22.302 4.258 4.050) 23.064 14.073 ( 15.915 -2.270 -2.893) 16.335 15.583 ( -13.188 -0.373 -0.651) 13.209 15.808 ( 0.112 -4.336 4.834) 6.495 16.447 ( -5.634 4.167 -0.629) 7.036 16.459 ( 0.023 -11.180 -4.316) 11.984 20.631 ( -4.357 1.406 1.262) 4.749 20.878 ( 1.312 1.738 0.136) 2.181 21.639 ( -0.445 0.129 -1.155) 1.244 21.918 ( 5.547 1.017 -2.128) 6.027 24.774 ( -4.451 -0.117 8.882) 9.936 25.243 ( 2.348 -0.864 -4.823) 5.433 32.504 ( -1.199 2.694 -1.041) 3.128 32.621 ( 1.941 2.383 -0.008) 3.073 42.364 ( -5.356 9.739 8.517) 14.002 43.177 ( 11.886 3.706 -6.761) 14.168 45.373 ( -8.925 6.211 10.577) 15.169 46.706 ( 12.407 10.442 -21.696) 27.087 ======================= Grid point 502 (250/355) ======================= q-point: ( 0.42 0.42 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 354 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.815 ( 17.535 0.000 6.067) 18.555 3.471 ( 19.200 0.000 3.349) 19.490 3.716 ( -0.979 -0.000 6.231) 6.307 3.900 ( -16.206 -0.000 26.674) 31.212 4.764 ( -7.602 -0.000 18.066) 19.600 4.816 ( 3.342 0.000 -9.806) 10.360 5.421 ( 12.947 0.000 5.400) 14.028 5.856 ( -22.773 -0.000 -7.045) 23.838 6.332 ( -4.925 -0.000 22.442) 22.976 7.372 ( 29.483 0.000 -17.839) 34.460 7.742 ( 9.119 0.000 -2.535) 9.464 8.295 ( -4.743 -0.000 -20.641) 21.179 10.053 ( -3.397 -0.000 9.040) 9.657 10.952 ( -4.105 -0.000 -10.892) 11.640 11.353 ( -19.735 -0.000 11.944) 23.068 11.412 ( 10.084 0.000 -8.273) 13.044 12.894 ( -4.257 -0.000 0.165) 4.260 13.291 ( 2.761 0.000 -1.149) 2.991 13.750 ( -9.460 -0.000 -11.025) 14.528 14.066 ( -3.466 -0.000 -8.117) 8.826 14.716 ( 4.657 0.000 7.026) 8.429 15.011 ( -7.323 -0.000 5.650) 9.249 16.284 ( -1.300 -0.000 4.912) 5.081 16.693 ( 5.445 0.000 -11.893) 13.080 20.716 ( 1.926 0.000 0.150) 1.932 20.865 ( 2.085 0.000 -2.863) 3.542 21.716 ( 0.681 0.000 2.124) 2.231 21.941 ( 0.327 0.000 -1.655) 1.687 24.727 ( -3.092 -0.000 8.450) 8.998 25.232 ( 0.012 0.000 -4.527) 4.527 32.514 ( 2.472 0.000 -0.322) 2.493 32.606 ( 1.261 0.000 -0.635) 1.412 42.907 ( 3.643 0.000 29.116) 29.343 44.745 ( 7.039 0.000 3.267) 7.760 44.997 ( 8.405 0.000 -21.867) 23.427 45.252 ( 8.918 0.000 -4.882) 10.167 ======================= Grid point 503 (251/355) ======================= q-point: (-0.50 -0.58 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.046 ( 17.711 -1.940 7.420) 19.300 3.537 ( -11.327 -2.609 -0.334) 11.629 3.820 ( 9.652 2.759 20.835) 23.127 3.993 ( 4.152 -8.196 15.124) 17.696 4.760 ( 0.899 1.133 8.468) 8.590 4.835 ( -3.183 -0.936 9.200) 9.780 5.510 ( 5.015 5.580 0.275) 7.507 5.534 ( -21.652 2.367 -8.332) 23.320 6.465 ( -2.150 -6.974 19.318) 20.650 7.557 ( 25.043 3.575 -15.809) 29.831 7.676 ( -2.636 8.211 -6.005) 10.508 8.133 ( -5.616 1.135 -20.818) 21.592 10.089 ( -3.203 -2.780 10.039) 10.898 10.858 ( 0.563 2.375 -9.866) 10.164 11.198 ( -16.800 2.380 9.706) 19.548 11.437 ( 10.176 4.892 -6.454) 13.005 12.873 ( 2.305 -0.227 2.435) 3.361 13.384 ( -2.535 -8.708 -3.235) 9.629 13.742 ( -6.783 -11.935 -7.421) 15.605 14.022 ( -2.437 -5.063 -8.453) 10.151 14.700 ( 3.937 9.975 6.647) 12.617 14.968 ( -3.610 0.780 1.251) 3.900 16.204 ( -4.078 8.076 7.054) 11.472 16.772 ( 7.714 -6.070 -12.294) 15.732 20.708 ( 1.205 2.531 0.764) 2.906 20.875 ( 1.188 -0.435 -3.112) 3.359 21.733 ( 1.110 0.076 2.521) 2.756 21.938 ( -0.327 -0.523 -1.893) 1.991 24.737 ( -2.928 -0.114 8.597) 9.082 25.214 ( 0.635 -0.048 -4.809) 4.851 32.543 ( 2.149 -0.726 0.061) 2.269 32.615 ( 0.411 -0.568 -0.774) 1.045 43.011 ( 0.282 5.381 28.009) 28.523 44.781 ( 2.212 5.101 -2.432) 6.068 44.972 ( 6.899 -0.925 -13.846) 15.497 45.431 ( 8.191 -13.609 -6.527) 17.173 ======================= Grid point 504 (252/355) ======================= q-point: (-0.42 -0.58 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.272 ( 14.043 -1.456 6.861) 15.697 3.440 ( -14.172 -2.873 -1.176) 14.508 3.936 ( 2.634 1.847 23.783) 23.999 4.306 ( 12.347 -7.411 11.398) 18.365 4.782 ( 0.093 2.188 3.052) 3.756 4.936 ( 1.941 -6.884 20.827) 22.021 5.176 ( -13.249 7.836 -9.140) 17.902 5.493 ( -7.924 0.138 -2.114) 8.202 6.639 ( -2.830 -6.968 13.769) 15.689 7.373 ( -8.051 11.609 -6.721) 15.645 7.616 ( 15.073 9.338 -12.926) 21.943 7.999 ( -2.128 -2.642 -22.358) 22.614 10.160 ( -3.777 -3.800 10.628) 11.902 10.807 ( 2.336 1.680 -6.843) 7.423 11.046 ( -10.906 2.326 6.098) 12.710 11.400 ( 10.169 8.415 -4.349) 13.897 12.970 ( 8.458 -1.504 5.191) 10.037 13.393 ( -11.060 -1.567 -6.807) 13.081 13.885 ( -5.899 -14.444 -0.751) 15.620 14.186 ( 2.560 -18.324 -9.127) 20.631 14.591 ( 4.739 9.191 4.877) 11.433 14.895 ( -0.059 5.240 -3.528) 6.317 16.052 ( -6.579 7.401 11.046) 14.835 16.874 ( 9.068 -2.295 -14.375) 17.151 20.681 ( 0.098 1.826 2.075) 2.766 20.868 ( -0.161 0.034 -3.372) 3.376 21.763 ( 2.303 -0.018 2.885) 3.692 21.929 ( -0.919 -0.076 -2.127) 2.318 24.750 ( -2.933 -0.120 8.787) 9.264 25.204 ( 1.291 -0.295 -5.030) 5.202 32.578 ( 1.327 -1.116 0.413) 1.782 32.626 ( -0.227 -1.013 -0.884) 1.363 43.007 ( -1.536 8.306 25.063) 26.448 44.545 ( -3.640 13.955 -18.212) 23.231 45.091 ( 2.334 -7.329 5.441) 9.421 45.769 ( 10.285 -19.115 -9.663) 23.760 ======================= Grid point 505 (253/355) ======================= q-point: (-0.33 -0.58 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.327 ( -13.424 -3.232 -0.053) 13.808 3.457 ( 12.649 0.715 3.865) 13.246 4.042 ( 6.223 2.919 20.913) 22.014 4.444 ( -10.025 -2.327 5.676) 11.753 4.792 ( -2.239 -0.010 -4.384) 4.923 4.985 ( 10.506 4.644 6.161) 13.035 5.274 ( 4.869 -14.721 20.363) 25.595 5.300 ( -20.330 4.195 -0.831) 20.775 6.795 ( -2.269 -9.358 11.607) 15.081 7.068 ( -14.645 8.857 -8.221) 18.987 7.546 ( 17.523 8.084 -11.272) 22.349 7.949 ( -1.055 -4.751 -23.181) 23.687 10.226 ( -4.465 -2.740 10.259) 11.519 10.722 ( -5.161 5.202 0.065) 7.328 11.008 ( 0.171 -2.411 -2.340) 3.365 11.337 ( 10.879 9.252 -1.267) 14.337 13.088 ( 7.354 2.545 5.724) 9.660 13.179 ( -14.513 5.550 -6.599) 16.881 14.049 ( 0.150 -5.583 3.157) 6.416 14.398 ( 2.932 0.244 -8.549) 9.042 14.633 ( 4.460 -9.150 3.003) 10.613 14.874 ( 3.435 -10.852 -5.769) 12.761 15.951 ( -6.845 2.921 12.509) 14.555 16.875 ( 7.250 3.988 -15.317) 17.409 20.673 ( -1.587 -0.299 2.905) 3.324 20.850 ( -0.466 -0.426 -3.047) 3.112 21.795 ( 1.753 0.877 2.434) 3.125 21.907 ( 0.756 0.770 -2.100) 2.360 24.762 ( -3.073 -0.042 8.973) 9.485 25.203 ( 1.807 -0.538 -5.182) 5.514 32.604 ( -0.260 -0.879 0.419) 1.008 32.637 ( -0.150 -1.088 -0.840) 1.383 42.947 ( -2.703 9.257 22.493) 24.473 44.136 ( -7.207 16.521 -20.597) 27.370 45.257 ( -4.552 -8.588 10.377) 14.218 46.159 ( 14.427 -18.391 -13.189) 26.838 ======================= Grid point 506 (254/355) ======================= q-point: (-0.25 -0.58 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.249 ( -10.492 -2.248 -1.115) 10.788 3.570 ( 10.962 2.622 3.670) 11.854 4.165 ( 9.362 2.803 17.855) 20.355 4.343 ( -14.496 -4.443 -12.370) 19.567 4.662 ( -9.114 2.657 -1.450) 9.604 4.995 ( -22.005 -0.174 5.246) 22.622 5.240 ( 18.527 1.319 21.865) 28.690 5.669 ( 5.171 -13.957 19.611) 24.620 6.657 ( -23.699 10.645 -6.153) 26.699 7.060 ( 6.458 -12.556 5.266) 15.069 7.606 ( 16.470 -0.339 -15.251) 22.449 7.922 ( -0.268 -5.034 -19.688) 20.324 10.236 ( -5.653 1.018 8.390) 10.168 10.572 ( -5.446 6.193 2.033) 8.494 11.035 ( 0.621 -1.710 -6.401) 6.655 11.334 ( 11.471 4.370 2.270) 12.483 12.809 ( -20.334 9.665 -7.890) 23.856 13.129 ( 4.732 7.290 6.870) 11.079 14.099 ( 10.562 6.020 3.577) 12.672 14.270 ( 6.694 10.724 -6.379) 14.160 14.919 ( -1.304 -20.050 1.554) 20.153 15.239 ( 7.605 -22.123 -3.479) 23.651 15.932 ( -6.265 -2.170 10.719) 12.604 16.757 ( 2.626 7.268 -13.671) 15.704 20.674 ( -3.661 -1.104 2.205) 4.414 20.853 ( 0.444 -1.364 -1.729) 2.247 21.766 ( -2.057 2.650 -0.151) 3.357 21.922 ( 5.589 0.872 -0.573) 5.686 24.772 ( -3.319 0.077 9.093) 9.680 25.209 ( 2.145 -0.661 -5.262) 5.720 32.601 ( -1.838 -0.045 -0.305) 1.864 32.652 ( 0.331 -0.751 -0.309) 0.877 42.851 ( -4.075 9.806 19.753) 22.427 43.704 ( -6.708 14.598 -18.604) 24.581 45.366 ( -9.941 -7.235 10.323) 16.054 46.524 ( 17.303 -13.412 -15.616) 26.891 ======================= Grid point 507 (255/355) ======================= q-point: (-0.17 -0.58 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.183 ( -6.669 -0.501 -0.496) 6.707 3.595 ( 5.194 5.541 0.170) 7.597 4.120 ( -2.020 6.633 -12.412) 14.218 4.372 ( 0.621 -5.083 11.097) 12.221 4.574 ( -18.532 -9.459 1.536) 20.863 4.912 ( -6.457 -1.648 16.560) 17.850 5.493 ( 12.897 0.180 20.508) 24.227 6.000 ( 7.066 -6.704 19.956) 22.206 6.201 ( -23.031 10.386 -7.943) 26.484 7.359 ( 6.598 -10.166 3.062) 12.500 7.697 ( 8.101 -7.311 -25.571) 27.802 7.942 ( 5.248 -2.086 -10.026) 11.507 10.172 ( -5.087 2.490 4.932) 7.510 10.436 ( -3.247 6.162 3.547) 7.817 11.035 ( -0.889 -2.724 -6.968) 7.534 11.415 ( 8.474 0.319 3.490) 9.171 12.392 ( -20.682 9.868 -9.131) 24.667 13.029 ( -0.687 9.381 6.199) 11.265 14.143 ( 18.454 6.930 2.787) 19.908 14.186 ( 10.113 6.950 -3.187) 12.678 15.221 ( -4.601 -17.370 0.003) 17.969 15.613 ( 5.846 -12.514 1.909) 13.943 16.012 ( -3.682 -9.847 5.235) 11.744 16.594 ( -1.492 5.604 -9.283) 10.945 20.652 ( -4.418 -0.233 1.368) 4.631 20.881 ( 0.675 -1.405 -0.502) 1.637 21.692 ( -1.983 2.694 -1.196) 3.553 21.961 ( 5.810 1.270 -1.042) 6.038 24.776 ( -3.667 0.204 9.089) 9.803 25.219 ( 2.323 -0.691 -5.247) 5.780 32.570 ( -2.102 0.968 -0.867) 2.471 32.662 ( 0.439 -0.066 -0.045) 0.446 42.710 ( -6.281 10.620 14.645) 19.150 43.392 ( -0.138 8.933 -12.181) 15.106 45.393 ( -12.687 -4.448 7.989) 15.638 46.784 ( 17.046 -5.398 -16.715) 24.476 ======================= Grid point 508 (256/355) ======================= q-point: (-0.08 -0.58 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.120 ( -3.876 2.138 0.922) 4.521 3.507 ( -0.020 6.333 -3.327) 7.154 3.944 ( 2.450 7.613 -7.144) 10.724 4.458 ( -12.018 -2.194 15.578) 19.797 4.577 ( -12.184 -9.410 -2.114) 15.539 5.069 ( 1.977 -7.741 18.904) 20.523 5.675 ( 5.567 -0.207 18.953) 19.755 5.742 ( -13.734 14.571 -10.102) 22.427 6.270 ( 6.095 -4.198 20.353) 21.657 7.460 ( 1.889 1.957 -6.902) 7.419 7.790 ( -2.734 -8.488 -19.488) 21.432 8.002 ( 15.761 -0.368 -9.093) 18.199 10.143 ( -1.633 -1.808 2.392) 3.414 10.344 ( -1.587 4.082 5.374) 6.932 11.044 ( -3.126 -4.668 -8.069) 9.832 11.507 ( 3.654 -1.739 4.245) 5.865 12.035 ( -16.199 3.663 -10.094) 19.435 12.910 ( 0.056 6.689 5.942) 8.947 14.184 ( 8.803 4.111 0.130) 9.716 14.270 ( 20.844 2.955 0.477) 21.058 15.368 ( -9.589 -8.433 -1.180) 12.824 15.773 ( -0.215 -3.038 6.668) 7.331 16.235 ( 3.001 -14.479 -1.895) 14.907 16.460 ( -4.209 4.316 -3.714) 7.081 20.616 ( -3.144 0.544 1.503) 3.527 20.898 ( 0.097 -0.193 -0.195) 0.291 21.641 ( -0.259 1.072 -1.301) 1.706 21.976 ( 3.350 1.661 -2.215) 4.346 24.775 ( -4.079 0.335 8.943) 9.835 25.230 ( 2.332 -0.741 -5.105) 5.661 32.524 ( -1.299 1.687 -1.144) 2.417 32.661 ( 0.645 0.769 0.013) 1.004 42.516 ( -6.766 10.294 8.952) 15.227 43.309 ( 9.483 2.225 -4.456) 10.711 45.338 ( -12.992 -0.914 4.782) 13.875 46.876 ( 14.062 4.197 -16.393) 22.002 ======================= Grid point 515 (257/355) ======================= q-point: (-0.50 -0.50 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 355 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.241 ( 17.308 0.000 5.908) 18.289 3.367 ( -18.231 -0.000 1.981) 18.338 3.850 ( -13.060 -0.000 25.474) 28.626 4.260 ( 33.488 0.000 12.143) 35.621 4.712 ( -8.102 -0.000 -7.107) 10.778 4.899 ( 0.168 0.000 23.437) 23.438 5.309 ( -17.352 -0.000 -14.025) 22.311 5.621 ( 4.582 0.000 1.038) 4.698 6.498 ( -0.160 -0.000 23.407) 23.408 7.625 ( -15.887 -0.000 -8.248) 17.900 7.759 ( 23.399 0.000 -17.273) 29.083 7.981 ( -8.242 -0.000 -18.226) 20.003 10.087 ( -2.121 -0.000 10.533) 10.745 10.847 ( 3.283 0.000 -11.222) 11.692 11.086 ( -17.044 -0.000 9.945) 19.733 11.566 ( 11.496 0.000 -5.563) 12.772 12.889 ( 2.417 0.000 2.768) 3.675 13.238 ( -4.594 -0.000 -7.190) 8.532 13.610 ( 1.782 0.000 -1.713) 2.472 13.896 ( -5.505 -0.000 -8.790) 10.372 14.896 ( 7.863 0.000 5.203) 9.428 14.921 ( -4.904 -0.000 2.690) 5.593 16.279 ( -3.028 -0.000 3.907) 4.943 16.741 ( 9.602 0.000 -10.597) 14.300 20.742 ( 0.441 0.000 0.314) 0.541 20.866 ( 0.577 0.000 -3.035) 3.090 21.753 ( 0.820 0.000 2.676) 2.799 21.919 ( -0.627 -0.000 -2.294) 2.379 24.748 ( -2.682 -0.000 8.745) 9.147 25.199 ( 0.994 0.000 -4.992) 5.090 32.556 ( 1.539 0.000 0.230) 1.556 32.605 ( -0.487 -0.000 -1.131) 1.232 43.175 ( -3.864 -0.000 29.814) 30.063 44.892 ( 3.509 0.000 4.897) 6.024 44.911 ( 1.586 0.000 -18.118) 18.187 45.342 ( 7.570 0.000 -12.323) 14.462 ======================= Grid point 516 (258/355) ======================= q-point: (-0.42 -0.50 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.202 ( -20.798 -2.671 3.390) 21.241 3.428 ( 13.528 -1.225 2.476) 13.807 3.876 ( -13.697 -5.231 23.503) 27.701 4.593 ( -20.376 -4.682 -7.030) 22.057 4.654 ( 35.722 2.072 11.769) 37.668 4.981 ( -0.764 0.903 19.046) 19.083 5.136 ( -2.172 0.324 -8.289) 8.575 5.593 ( 3.146 8.214 2.238) 9.076 6.620 ( -1.532 -1.728 20.758) 20.887 7.315 ( -24.295 5.538 -9.491) 26.664 7.815 ( -5.518 -2.825 -20.622) 21.534 7.851 ( 14.545 6.705 -13.282) 20.807 10.133 ( -1.967 -1.662 11.159) 11.452 10.824 ( 2.707 1.552 -8.724) 9.265 10.972 ( -11.473 -0.439 5.630) 12.787 11.615 ( 11.815 5.252 -3.500) 13.395 12.995 ( 6.460 -5.608 5.294) 10.060 13.207 ( -7.538 -4.194 -8.206) 11.906 13.679 ( 0.800 -5.276 1.000) 5.429 13.892 ( -1.771 -11.509 -8.448) 14.386 14.813 ( 1.283 7.959 3.144) 8.653 14.984 ( 5.536 3.260 0.609) 6.453 16.177 ( -4.498 8.391 6.101) 11.308 16.852 ( 11.453 -4.700 -12.359) 17.493 20.722 ( -0.686 2.271 1.029) 2.586 20.852 ( -0.531 0.195 -3.210) 3.260 21.784 ( 1.388 -0.993 2.748) 3.235 21.903 ( -0.998 -0.401 -2.510) 2.731 24.763 ( -2.562 0.036 8.970) 9.329 25.189 ( 1.467 -0.228 -5.171) 5.380 32.574 ( 0.479 -0.607 0.353) 0.850 32.598 ( -1.070 -0.854 -1.360) 1.930 43.211 ( -6.005 5.219 28.316) 29.412 44.681 ( -1.919 14.696 -16.718) 22.342 44.984 ( -2.374 -5.593 3.064) 6.805 45.522 ( 9.775 -17.070 -13.486) 23.850 ======================= Grid point 517 (259/355) ======================= q-point: (-0.33 -0.50 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.080 ( -20.389 -5.789 2.683) 21.364 3.574 ( 9.114 -1.996 0.708) 9.357 3.954 ( -14.082 -8.477 19.095) 25.195 4.363 ( -24.293 -0.692 -7.110) 25.322 4.930 ( 19.633 4.555 8.437) 21.849 5.053 ( 1.794 8.610 -10.666) 13.825 5.191 ( 7.047 -10.905 19.067) 23.068 5.497 ( 8.963 10.647 12.901) 18.977 6.703 ( -6.166 -3.324 17.883) 19.206 6.948 ( -23.985 3.133 -9.910) 26.140 7.739 ( -2.988 -4.083 -12.867) 13.826 7.776 ( 10.573 8.041 -20.874) 24.743 10.198 ( -2.112 -2.084 11.256) 11.640 10.730 ( -8.033 3.800 1.103) 8.954 10.964 ( 3.026 -2.658 -6.325) 7.499 11.604 ( 11.808 8.685 -0.748) 14.677 13.059 ( -12.926 4.090 -7.509) 15.498 13.228 ( 10.723 -4.584 7.657) 13.951 13.811 ( -3.757 -12.642 2.117) 13.357 14.182 ( 5.478 -21.814 -7.136) 23.596 14.727 ( 3.881 6.085 2.120) 7.522 14.917 ( 6.173 8.968 -3.830) 11.541 16.029 ( -5.317 6.747 10.118) 13.273 16.942 ( 10.531 1.152 -14.474) 17.937 20.675 ( -2.549 1.840 2.007) 3.729 20.827 ( -0.825 -0.084 -2.807) 2.927 21.819 ( 0.035 0.219 1.216) 1.236 21.904 ( 1.456 -1.637 -1.691) 2.768 24.777 ( -2.599 0.210 9.203) 9.566 25.188 ( 1.903 -0.507 -5.313) 5.666 32.580 ( -1.517 -0.832 -0.490) 1.798 32.606 ( -0.627 -1.577 -0.626) 1.809 43.158 ( -6.738 7.899 25.785) 27.797 44.260 ( -7.319 18.535 -19.524) 27.898 45.071 ( -8.369 -8.634 5.074) 13.051 45.917 ( 14.505 -21.720 -14.276) 29.765 ======================= Grid point 518 (260/355) ======================= q-point: (-0.25 -0.50 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.015 ( -17.659 -8.008 1.439) 19.443 3.687 ( 6.019 -1.544 0.730) 6.257 3.997 ( -18.171 -9.061 -4.318) 20.758 4.191 ( -16.068 -5.411 14.350) 22.212 4.752 ( -3.175 16.038 -13.781) 21.383 5.003 ( 5.404 5.436 8.960) 11.791 5.567 ( 12.072 -11.583 14.243) 21.972 5.594 ( 14.152 4.070 24.101) 28.243 6.583 ( -19.983 7.874 -0.834) 21.495 6.874 ( -5.900 -14.502 6.618) 16.997 7.635 ( 4.085 3.709 -26.184) 26.759 7.779 ( 4.760 -5.126 -9.505) 11.801 10.245 ( -3.021 0.203 10.735) 11.154 10.585 ( -8.365 3.672 1.745) 9.301 11.005 ( 4.425 -1.088 -9.473) 10.512 11.571 ( 10.978 8.612 2.262) 14.135 12.754 ( -16.455 9.930 -7.326) 20.568 13.345 ( 7.314 6.867 6.764) 12.100 14.065 ( -0.406 -16.632 4.006) 17.112 14.428 ( 6.013 1.522 -6.860) 9.248 14.781 ( 6.367 -4.368 3.681) 8.553 14.945 ( 8.985 -13.836 -5.178) 17.291 15.949 ( -4.041 3.112 11.179) 12.287 16.872 ( 5.776 8.724 -14.122) 17.575 20.636 ( -3.610 0.142 1.835) 4.052 20.823 ( -0.378 -1.426 -1.509) 2.110 21.782 ( -2.181 2.175 -0.984) 3.233 21.964 ( 4.392 -1.603 -0.791) 4.741 24.787 ( -2.844 0.444 9.336) 9.769 25.195 ( 2.226 -0.702 -5.388) 5.872 32.570 ( -2.360 -0.714 -1.007) 2.663 32.625 ( -0.862 -1.775 -0.267) 1.991 43.052 ( -7.812 9.444 22.084) 25.257 43.793 ( -8.742 15.612 -17.646) 25.131 45.141 ( -12.523 -9.266 4.591) 16.241 46.363 ( 17.619 -19.422 -15.518) 30.471 ======================= Grid point 519 (261/355) ======================= q-point: (-0.17 -0.50 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.006 ( -12.871 -8.387 0.507) 15.371 3.669 ( -3.499 4.098 -7.581) 9.301 4.011 ( -10.190 -15.160 -2.989) 18.509 4.285 ( -10.987 -8.144 21.623) 25.585 4.421 ( 0.471 14.023 -9.250) 16.805 4.982 ( -1.061 2.476 6.241) 6.797 5.765 ( 7.210 3.885 26.872) 28.092 5.929 ( 9.414 -9.584 12.406) 18.286 6.267 ( -7.337 10.365 -0.197) 12.700 7.149 ( -4.761 -19.485 5.516) 20.803 7.509 ( 0.136 -1.258 -28.145) 28.173 7.898 ( 8.447 -6.019 -9.986) 14.398 10.212 ( -4.338 4.056 8.045) 10.000 10.475 ( -5.193 2.467 2.117) 6.127 10.995 ( 2.698 0.875 -9.507) 9.921 11.564 ( 8.016 5.519 3.992) 10.520 12.355 ( -17.144 12.759 -7.621) 22.689 13.242 ( 1.752 11.649 3.997) 12.440 14.283 ( 1.788 -3.645 4.084) 5.759 14.379 ( 8.430 4.180 -4.595) 10.471 14.982 ( 6.096 -10.490 2.625) 12.414 15.387 ( 10.107 -22.402 -1.727) 24.637 15.946 ( -1.174 -0.393 9.478) 9.558 16.673 ( 0.549 10.341 -11.051) 15.144 20.613 ( -3.122 -0.442 1.403) 3.451 20.848 ( -0.327 -2.268 -0.558) 2.358 21.712 ( -1.932 2.668 -1.369) 3.567 22.015 ( 3.602 0.035 -1.790) 4.022 24.790 ( -3.303 0.637 9.292) 9.882 25.206 ( 2.413 -0.757 -5.375) 5.940 32.549 ( -2.403 -0.215 -1.279) 2.730 32.644 ( -0.902 -1.617 -0.121) 1.856 42.875 ( -10.229 10.915 13.635) 20.241 43.468 ( -2.956 7.772 -8.670) 12.012 45.170 ( -14.369 -8.145 2.946) 16.778 46.739 ( 17.435 -12.474 -16.269) 26.912 ======================= Grid point 520 (262/355) ======================= q-point: (-0.08 -0.50 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.030 ( -7.947 -6.157 0.319) 10.058 3.505 ( -7.428 2.733 -9.061) 12.031 4.091 ( 2.205 4.900 -6.793) 8.662 4.272 ( -10.304 -2.860 7.752) 13.208 4.405 ( -5.246 -7.702 16.681) 19.108 5.019 ( -2.630 -7.544 5.197) 9.531 5.803 ( -2.154 8.503 12.372) 15.166 5.933 ( 2.058 13.193 12.220) 18.100 6.371 ( 13.204 -8.326 14.007) 20.973 7.357 ( -3.482 -4.812 -9.813) 11.470 7.470 ( -8.417 -14.875 -14.921) 22.688 8.048 ( 13.099 -5.076 -12.056) 18.512 10.142 ( -2.655 2.040 4.486) 5.598 10.407 ( -2.484 2.953 4.298) 5.776 10.958 ( 0.942 0.490 -8.962) 9.025 11.569 ( 2.698 3.119 3.949) 5.710 11.961 ( -13.178 9.857 -7.772) 18.200 13.089 ( 2.455 9.826 3.023) 10.569 14.285 ( -0.285 1.555 0.408) 1.632 14.441 ( 6.598 -0.522 0.612) 6.647 15.193 ( 2.984 -6.435 0.058) 7.094 15.742 ( 3.561 -7.557 4.963) 9.717 16.069 ( 7.568 -9.388 1.970) 12.218 16.485 ( -2.010 5.839 -6.304) 8.825 20.602 ( -1.530 -0.187 1.548) 2.185 20.877 ( -0.529 -1.730 -0.362) 1.845 21.654 ( -0.801 1.676 -1.237) 2.232 22.013 ( 0.825 1.465 -2.651) 3.139 24.785 ( -3.841 0.734 9.099) 9.904 25.218 ( 2.448 -0.716 -5.264) 5.850 32.521 ( -1.532 0.276 -1.374) 2.077 32.659 ( -0.631 -1.037 0.001) 1.214 42.639 ( -9.710 9.614 6.800) 15.263 43.396 ( 5.384 0.466 -0.700) 5.450 45.153 ( -14.164 -5.756 1.327) 15.346 46.957 ( 14.139 -3.143 -15.867) 21.484 ======================= Grid point 528 (263/355) ======================= q-point: (-0.42 -0.42 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 354 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.970 ( -24.305 -0.000 5.521) 24.924 3.519 ( 5.532 0.000 -2.397) 6.029 3.814 ( -11.409 -0.000 22.490) 25.218 4.278 ( -23.555 -0.000 -8.880) 25.173 5.013 ( 12.137 0.000 19.379) 22.866 5.036 ( 0.662 0.000 -11.811) 11.830 5.215 ( 23.879 0.000 16.014) 28.752 5.715 ( 5.214 0.000 -0.103) 5.215 6.709 ( -1.543 -0.000 21.542) 21.597 7.007 ( -35.240 -0.000 -6.974) 35.923 7.623 ( -8.098 -0.000 -17.609) 19.382 7.982 ( 11.666 0.000 -15.350) 19.280 10.163 ( -0.632 -0.000 12.282) 12.298 10.840 ( 6.614 0.000 -13.801) 15.304 10.863 ( -13.462 -0.000 8.491) 15.916 11.766 ( 11.911 0.000 -1.775) 12.042 13.034 ( 7.904 0.000 4.877) 9.288 13.082 ( -2.564 -0.000 -7.464) 7.892 13.686 ( 3.389 0.000 3.087) 4.584 13.712 ( -4.124 -0.000 -8.113) 9.101 14.872 ( -1.566 -0.000 0.320) 1.598 15.115 ( 9.226 0.000 3.946) 10.034 16.240 ( -3.970 -0.000 3.037) 4.998 16.871 ( 13.546 0.000 -12.530) 18.453 20.739 ( -1.019 -0.000 0.410) 1.098 20.831 ( -1.272 -0.000 -3.029) 3.285 21.795 ( 0.754 0.000 2.775) 2.876 21.876 ( -1.375 -0.000 -2.645) 2.981 24.782 ( -2.190 -0.000 9.295) 9.549 25.179 ( 1.771 0.000 -5.324) 5.611 32.566 ( -1.985 -0.000 -1.818) 2.692 32.572 ( -0.300 -0.000 0.401) 0.501 43.309 ( -9.388 -0.000 28.905) 30.392 44.735 ( -3.323 -0.000 -16.035) 16.376 44.965 ( -0.932 -0.000 5.170) 5.254 45.310 ( 3.853 0.000 -20.860) 21.212 ======================= Grid point 529 (264/355) ======================= q-point: (-0.33 -0.42 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.783 ( -24.729 -4.242 5.442) 25.673 3.516 ( -9.613 -4.847 -5.485) 12.083 3.829 ( -9.043 -1.938 17.708) 19.978 4.054 ( -18.782 -2.377 -4.814) 19.534 5.007 ( 4.155 1.453 -7.062) 8.321 5.155 ( -2.505 -2.175 14.919) 15.284 5.500 ( 27.201 7.115 9.906) 29.810 5.736 ( 6.106 2.528 3.865) 7.656 6.575 ( -30.129 -1.819 -8.256) 31.292 6.789 ( -8.043 4.848 23.271) 25.094 7.532 ( -3.668 -5.384 -13.767) 15.230 7.939 ( 7.593 6.713 -17.591) 20.302 10.222 ( -0.140 -0.435 12.995) 13.003 10.720 ( -8.359 4.375 3.043) 9.913 10.906 ( 4.839 -4.677 -10.265) 12.274 11.838 ( 11.746 5.070 0.318) 12.797 12.996 ( -5.483 4.411 -6.834) 9.809 13.228 ( 10.119 -9.862 6.435) 15.526 13.691 ( -1.361 -1.791 0.893) 2.420 13.860 ( 5.177 -17.099 -3.149) 18.141 14.831 ( 0.087 3.441 -0.362) 3.461 15.146 ( 8.213 8.441 0.876) 11.810 16.139 ( -4.601 7.051 5.385) 9.994 16.981 ( 13.195 -2.350 -14.951) 20.079 20.700 ( -2.166 2.843 0.921) 3.690 20.801 ( -1.659 -0.080 -2.644) 3.122 21.821 ( -0.517 -0.040 0.703) 0.873 21.867 ( 0.237 -2.625 -1.226) 2.907 24.802 ( -1.908 0.341 9.669) 9.861 25.176 ( 2.109 -0.316 -5.453) 5.855 32.541 ( -2.410 -0.700 -1.870) 3.130 32.574 ( -1.323 -0.925 0.206) 1.627 43.298 ( -10.751 4.368 27.350) 29.710 44.432 ( -6.146 19.688 -19.531) 28.406 44.900 ( -8.889 -1.586 2.551) 9.383 45.554 ( 7.679 -26.421 -18.614) 33.220 ======================= Grid point 530 (265/355) ======================= q-point: (-0.25 -0.42 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.676 ( -22.707 -8.940 4.220) 24.766 3.472 ( -22.525 -13.238 -5.126) 26.625 3.788 ( -5.455 2.321 -5.615) 8.165 3.995 ( -13.979 -6.710 19.338) 24.787 4.943 ( 6.065 8.911 -9.636) 14.458 5.133 ( -5.888 5.999 8.648) 12.060 5.650 ( 8.069 -2.460 7.257) 11.128 5.845 ( 6.885 -2.929 10.809) 13.146 6.367 ( -17.077 -5.781 -5.786) 18.935 6.733 ( -6.618 4.052 22.115) 23.437 7.567 ( 3.139 -3.327 -12.484) 13.296 7.806 ( 7.175 5.482 -17.564) 19.749 10.283 ( -1.025 0.213 12.875) 12.918 10.578 ( -7.118 4.544 2.644) 8.849 10.979 ( 6.092 -2.873 -11.856) 13.636 11.838 ( 10.513 8.688 2.477) 13.861 12.755 ( -10.103 10.536 -6.377) 15.929 13.521 ( 8.079 -0.255 4.693) 9.347 13.776 ( 0.103 -15.868 5.026) 16.646 14.287 ( 9.077 -21.446 -2.585) 23.431 14.776 ( 2.114 1.699 -0.886) 2.853 15.048 ( 8.095 9.526 -1.898) 12.644 16.025 ( -3.846 4.544 8.683) 10.528 17.005 ( 8.936 5.429 -15.571) 18.756 20.631 ( -2.800 2.309 1.379) 3.882 20.785 ( -1.399 -1.126 -1.458) 2.313 21.786 ( -2.035 1.498 -1.429) 2.903 21.946 ( 2.350 -4.052 -0.753) 4.744 24.818 ( -1.972 0.928 9.884) 10.122 25.182 ( 2.407 -0.600 -5.511) 6.043 32.523 ( -2.710 -1.067 -1.842) 3.446 32.580 ( -1.939 -1.739 0.043) 2.605 43.204 ( -11.751 7.689 23.320) 27.222 43.902 ( -10.865 19.387 -18.305) 28.792 44.882 ( -12.837 -7.342 1.166) 14.835 46.044 ( 12.797 -28.409 -19.035) 36.512 ======================= Grid point 531 (266/355) ======================= q-point: (-0.17 -0.42 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.677 ( -17.489 -12.992 3.637) 22.088 3.490 ( -22.192 -17.134 -6.494) 28.779 3.666 ( -5.902 -0.390 -2.586) 6.455 4.119 ( -10.031 -10.342 21.219) 25.648 4.776 ( 15.411 17.138 -10.641) 25.386 4.949 ( -15.336 5.498 5.107) 17.074 5.854 ( -4.298 -15.166 9.969) 18.651 6.025 ( 7.591 -1.464 13.680) 15.713 6.328 ( 0.099 -0.175 -3.792) 3.797 6.765 ( -11.276 -8.559 16.658) 21.861 7.494 ( 6.305 8.100 -16.062) 19.062 7.837 ( 9.694 -6.138 -13.625) 17.813 10.279 ( -5.041 3.906 10.464) 12.254 10.478 ( -2.150 2.525 2.519) 4.164 11.003 ( 5.253 0.359 -11.321) 12.485 11.788 ( 7.393 9.552 4.067) 12.746 12.405 ( -11.799 14.368 -5.852) 19.491 13.441 ( -0.886 9.220 -0.184) 9.264 14.152 ( 2.818 -14.614 6.535) 16.254 14.447 ( -0.707 2.585 -4.686) 5.398 14.973 ( 10.251 -7.419 5.174) 13.671 15.140 ( 13.991 -16.380 -2.180) 21.652 15.996 ( -0.430 1.050 8.308) 8.385 16.840 ( 3.420 12.665 -12.818) 18.341 20.593 ( -1.641 0.319 1.359) 2.155 20.798 ( -1.096 -2.357 -0.520) 2.651 21.727 ( -1.982 2.171 -1.442) 3.275 22.012 ( 1.243 -2.072 -2.429) 3.426 24.821 ( -2.590 1.440 9.785) 10.224 25.193 ( 2.607 -0.742 -5.470) 6.105 32.505 ( -2.652 -1.041 -1.833) 3.388 32.595 ( -1.937 -2.356 0.024) 3.050 42.993 ( -14.332 11.363 10.480) 21.080 43.512 ( -7.785 7.665 -5.425) 12.198 44.888 ( -13.989 -8.871 0.288) 16.567 46.532 ( 14.913 -22.728 -20.047) 33.776 ======================= Grid point 532 (267/355) ======================= q-point: (-0.08 -0.42 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.773 ( -11.845 -12.958 3.670) 17.936 3.415 ( -8.538 0.355 -9.967) 13.129 3.793 ( -13.735 -20.039 6.708) 25.204 4.303 ( -5.412 -7.925 20.120) 22.292 4.558 ( 10.900 19.404 -4.181) 22.645 4.817 ( -7.978 -6.313 -2.106) 10.389 6.021 ( -4.266 4.333 24.585) 25.326 6.248 ( 0.363 -15.653 -2.391) 15.838 6.277 ( 11.645 9.562 4.785) 15.809 6.935 ( -18.242 -21.681 4.339) 28.665 7.351 ( 6.283 7.722 -12.038) 15.622 8.010 ( 13.386 -7.731 -14.570) 21.242 10.180 ( -5.547 4.208 5.692) 8.994 10.454 ( 0.491 2.350 4.634) 5.219 10.978 ( 4.738 2.598 -9.350) 10.799 11.706 ( 2.016 8.467 3.716) 9.464 12.022 ( -8.928 14.004 -5.150) 17.388 13.275 ( 0.981 8.932 -1.814) 9.167 14.251 ( -7.402 0.528 2.399) 7.799 14.400 ( -5.968 -3.538 -0.094) 6.939 15.198 ( 11.938 -4.837 1.713) 12.994 15.621 ( 11.639 -16.331 3.379) 20.337 16.078 ( 8.135 -4.184 4.835) 10.347 16.592 ( 1.123 12.051 -8.638) 14.870 20.595 ( 0.064 -0.498 1.321) 1.414 20.832 ( -0.564 -2.649 -0.147) 2.713 21.667 ( -1.583 1.948 -1.177) 2.772 22.011 ( -1.731 0.284 -3.259) 3.701 24.809 ( -3.488 1.539 9.457) 10.197 25.207 ( 2.660 -0.718 -5.347) 6.015 32.491 ( -1.775 -1.017 -1.766) 2.702 32.618 ( -1.554 -2.391 0.128) 2.854 42.703 ( -12.674 8.715 2.855) 15.644 43.415 ( -1.837 -1.099 2.485) 3.280 44.900 ( -12.786 -8.311 0.720) 15.267 46.883 ( 13.018 -12.895 -19.781) 26.964 ======================= Grid point 541 (268/355) ======================= q-point: (-0.33 -0.33 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 355 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.516 ( -26.104 -0.000 6.113) 26.811 3.228 ( -27.711 -0.000 -9.427) 29.271 3.837 ( -6.744 -0.000 22.368) 23.362 3.883 ( -9.020 -0.000 -6.914) 11.365 5.087 ( 14.099 0.000 -7.599) 16.016 5.144 ( -8.509 -0.000 12.990) 15.529 5.631 ( -26.836 -0.000 5.027) 27.302 5.760 ( -2.285 -0.000 -3.226) 3.953 6.379 ( 7.033 0.000 0.803) 7.078 6.929 ( -1.855 -0.000 27.050) 27.113 7.403 ( 1.547 0.000 -11.143) 11.250 7.956 ( 2.622 0.000 -20.117) 20.287 10.286 ( -0.272 -0.000 14.839) 14.841 10.733 ( -6.052 -0.000 9.330) 11.121 10.841 ( 7.363 0.000 -16.586) 18.147 12.003 ( 11.625 0.000 2.010) 11.798 13.024 ( 2.194 0.000 -4.000) 4.562 13.226 ( 5.418 0.000 2.098) 5.810 13.651 ( 5.254 0.000 -2.610) 5.867 13.775 ( 1.775 0.000 4.903) 5.214 14.851 ( -0.574 -0.000 -1.062) 1.207 15.313 ( 7.075 0.000 2.761) 7.595 16.177 ( -5.009 -0.000 2.690) 5.685 17.014 ( 13.389 0.000 -18.030) 22.458 20.716 ( -1.548 -0.000 0.642) 1.676 20.766 ( -2.333 -0.000 -2.789) 3.636 21.818 ( -1.909 -0.000 -2.667) 3.280 21.831 ( 0.404 0.000 2.405) 2.439 24.837 ( -0.994 -0.000 10.285) 10.333 25.171 ( 2.380 0.000 -5.566) 6.054 32.499 ( -2.629 -0.000 -2.192) 3.423 32.550 ( -2.247 -0.000 0.299) 2.267 43.338 ( -13.337 -0.000 27.058) 30.166 44.488 ( -6.285 -0.000 -17.170) 18.284 44.949 ( -4.960 -0.000 4.305) 6.567 45.078 ( -4.669 -0.000 -30.128) 30.488 ======================= Grid point 542 (269/355) ======================= q-point: (-0.25 -0.33 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.331 ( -25.126 -5.694 5.110) 26.265 2.958 ( -32.410 -9.855 -7.009) 34.592 3.751 ( -7.963 1.646 -5.109) 9.604 3.893 ( -7.844 -2.023 20.582) 22.118 5.058 ( -9.621 1.724 6.540) 11.760 5.140 ( -12.830 -1.696 -6.235) 14.365 5.402 ( -18.420 -6.677 2.094) 19.704 5.704 ( -8.733 -4.838 -1.622) 10.114 6.468 ( 12.676 9.116 8.282) 17.674 6.972 ( 7.416 9.024 21.299) 24.291 7.494 ( 8.896 -7.761 -7.290) 13.875 7.847 ( 2.186 3.560 -20.945) 21.358 10.337 ( -2.984 0.395 14.521) 14.830 10.657 ( 0.682 7.578 5.098) 9.159 10.920 ( 7.228 -5.351 -11.551) 14.639 12.082 ( 10.723 5.727 3.665) 12.697 12.871 ( -1.886 13.742 -3.891) 14.406 13.465 ( 7.814 -16.278 2.088) 18.176 13.681 ( 0.047 1.557 3.472) 3.805 14.023 ( 9.890 -19.621 2.780) 22.147 14.822 ( 0.379 1.769 -1.317) 2.237 15.292 ( 5.696 10.209 -0.376) 11.697 16.089 ( -5.419 4.319 5.164) 8.642 17.058 ( 9.267 -0.522 -20.297) 22.319 20.665 ( -1.776 3.443 0.577) 3.917 20.744 ( -1.930 -1.017 -1.437) 2.613 21.778 ( -2.069 0.839 -1.963) 2.973 21.884 ( 0.512 -4.145 0.525) 4.209 24.871 ( -0.360 1.152 10.701) 10.769 25.173 ( 2.667 -0.351 -5.595) 6.208 32.470 ( -2.580 -0.724 -2.082) 3.393 32.533 ( -2.822 -1.023 0.223) 3.010 43.283 ( -14.761 4.262 24.353) 28.795 44.064 ( -11.855 24.475 -23.995) 36.267 44.676 ( -13.236 -0.344 -2.230) 13.427 45.472 ( 2.239 -37.715 -20.948) 43.200 ======================= Grid point 543 (270/355) ======================= q-point: (-0.17 -0.33 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.283 ( -19.824 -13.788 5.203) 24.701 2.889 ( -27.474 -20.513 -1.232) 34.310 3.613 ( -9.070 2.204 -3.399) 9.934 3.949 ( -9.812 -6.414 15.553) 19.476 4.886 ( -14.668 7.113 10.726) 19.514 5.117 ( -18.569 -19.097 -5.366) 27.172 5.321 ( -4.291 2.597 -3.333) 6.022 5.834 ( -5.286 -17.809 -1.390) 18.629 6.426 ( 0.978 8.381 15.006) 17.216 6.987 ( 14.229 12.919 14.078) 23.823 7.689 ( 14.345 6.441 -6.790) 17.128 7.722 ( 3.356 -7.468 -19.130) 20.808 10.327 ( -6.689 2.761 11.593) 13.667 10.580 ( 4.394 6.827 5.111) 9.593 11.006 ( 8.073 -1.378 -10.281) 13.144 12.056 ( 7.766 10.663 4.734) 14.015 12.557 ( -5.046 16.927 -3.468) 18.000 13.529 ( -3.324 5.500 -1.635) 6.632 13.959 ( 7.319 -17.809 6.390) 20.287 14.387 ( -1.563 -7.580 -1.164) 7.826 14.924 ( 14.052 -11.899 3.659) 18.773 15.173 ( 6.860 5.448 -2.023) 8.991 16.027 ( -3.372 0.582 7.080) 7.864 16.986 ( 3.882 6.660 -17.701) 19.307 20.607 ( -0.625 1.928 0.934) 2.232 20.747 ( -1.328 -1.908 -0.326) 2.347 21.730 ( -2.161 1.396 -1.636) 3.049 21.954 ( -0.572 -3.677 -1.950) 4.201 24.882 ( -0.979 2.666 10.552) 10.927 25.184 ( 2.900 -0.595 -5.498) 6.244 32.450 ( -2.507 -1.052 -1.996) 3.373 32.534 ( -2.586 -2.205 0.261) 3.408 43.074 ( -17.586 12.399 8.652) 23.191 43.513 ( -14.993 9.770 -8.312) 19.732 44.615 ( -12.791 -7.280 -0.886) 14.744 46.058 ( 8.362 -36.442 -24.602) 44.758 ======================= Grid point 544 (271/355) ======================= q-point: (-0.08 -0.33 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.427 ( -12.203 -16.574 7.647) 21.957 3.078 ( -14.901 -25.550 0.571) 29.583 3.489 ( -11.736 -1.775 1.514) 11.966 4.103 ( -5.521 -15.924 7.079) 18.280 4.694 ( -12.603 5.920 13.812) 19.613 5.054 ( 14.806 18.318 -5.925) 24.287 5.500 ( -27.986 -40.209 0.659) 48.994 6.082 ( -2.440 -15.664 -4.201) 16.400 6.373 ( -4.865 3.780 16.707) 17.807 6.931 ( 10.826 15.494 10.417) 21.582 7.558 ( 7.650 9.334 -11.057) 16.367 7.931 ( 13.970 -8.261 -13.096) 20.855 10.228 ( -6.571 5.303 7.600) 11.361 10.556 ( 3.938 4.693 5.415) 8.177 11.038 ( 8.375 2.002 -8.001) 11.755 11.929 ( 2.803 13.204 4.216) 14.141 12.199 ( -4.260 17.070 -2.713) 17.802 13.385 ( -0.732 6.605 -3.966) 7.739 14.195 ( -5.431 -4.917 5.229) 9.001 14.280 ( -11.891 4.482 -2.640) 12.978 15.204 ( 8.267 -8.048 0.944) 11.576 15.518 ( 20.696 -17.217 5.742) 27.527 16.077 ( 2.715 -4.815 4.028) 6.839 16.787 ( 3.222 11.471 -11.942) 16.869 20.599 ( 0.934 -0.148 0.725) 1.192 20.781 ( -0.100 -2.941 0.259) 2.954 21.674 ( -2.369 1.765 -1.291) 3.224 21.961 ( -3.467 -1.039 -3.132) 4.786 24.861 ( -2.670 3.212 10.017) 10.853 25.199 ( 2.970 -0.633 -5.332) 6.136 32.441 ( -1.772 -1.582 -1.952) 3.074 32.556 ( -2.011 -2.889 0.352) 3.537 42.708 ( -15.556 8.712 -2.166) 17.961 43.336 ( -11.497 -2.050 3.529) 12.200 44.644 ( -9.833 -9.327 2.034) 13.705 46.573 ( 10.203 -26.604 -26.083) 38.628 ======================= Grid point 554 (272/355) ======================= q-point: (-0.25 -0.25 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 354 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.052 ( -25.309 -0.000 4.880) 25.775 2.485 ( -36.533 -0.000 -5.357) 36.924 3.633 ( -12.291 -0.000 -3.131) 12.683 3.917 ( -6.721 -0.000 15.651) 17.033 4.516 ( -55.853 -0.000 2.102) 55.892 5.134 ( -16.018 -0.000 15.379) 22.206 5.390 ( 9.530 0.000 -3.092) 10.019 5.567 ( -0.349 -0.000 -7.717) 7.725 6.698 ( 1.769 0.000 13.901) 14.013 7.286 ( 16.896 0.000 17.839) 24.571 7.430 ( 6.739 0.000 -17.425) 18.683 7.817 ( 7.318 0.000 -17.468) 18.939 10.359 ( -5.931 -0.000 13.855) 15.071 10.833 ( 7.827 0.000 -17.740) 19.390 10.900 ( 11.800 0.000 18.049) 21.563 12.264 ( 10.977 0.000 5.435) 12.249 13.096 ( 6.424 0.000 0.754) 6.468 13.277 ( 2.268 0.000 -2.479) 3.360 13.847 ( 10.059 0.000 3.455) 10.636 13.851 ( 0.896 0.000 6.769) 6.828 14.826 ( -0.308 -0.000 -1.365) 1.399 15.436 ( 3.420 0.000 0.830) 3.519 16.088 ( -6.486 -0.000 2.868) 7.092 17.001 ( 3.707 0.000 -26.846) 27.101 20.697 ( -1.978 -0.000 -2.262) 3.005 20.699 ( -0.789 -0.000 1.204) 1.439 21.753 ( -2.226 -0.000 -2.277) 3.184 21.852 ( -0.218 -0.000 1.632) 1.647 24.942 ( 1.789 0.000 11.276) 11.417 25.173 ( 2.970 0.000 -5.591) 6.331 32.433 ( -1.875 -0.000 -1.601) 2.465 32.493 ( -3.417 -0.000 0.193) 3.422 43.272 ( -16.920 -0.000 23.911) 29.292 44.104 ( -12.946 -0.000 -37.262) 39.447 44.582 ( -16.704 -0.000 -21.572) 27.283 44.852 ( -7.690 -0.000 2.670) 8.140 ======================= Grid point 555 (273/355) ======================= q-point: (-0.17 -0.25 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.886 ( -23.312 -9.558 4.698) 25.630 2.280 ( -30.257 -17.605 1.863) 35.056 3.487 ( -16.014 -0.331 -1.273) 16.068 3.841 ( -21.227 -4.663 4.953) 22.290 4.218 ( -41.197 -18.387 11.938) 46.667 4.966 ( -10.928 8.250 13.893) 19.507 5.406 ( -16.186 -7.973 -1.393) 18.096 5.685 ( 25.484 0.998 -6.021) 26.205 6.636 ( -5.591 9.874 15.706) 19.376 7.424 ( 19.159 8.695 4.937) 21.611 7.471 ( -1.860 -7.917 -20.673) 22.216 7.885 ( 18.135 0.827 -6.727) 19.360 10.347 ( -6.845 1.252 12.475) 14.284 10.783 ( 8.152 5.867 -8.848) 13.385 11.114 ( 17.317 3.838 11.530) 21.155 12.329 ( 9.210 8.108 6.673) 13.967 12.851 ( 1.530 21.610 -0.219) 21.665 13.535 ( 1.259 -6.188 -2.338) 6.734 13.826 ( 8.364 -6.502 7.954) 13.248 14.185 ( 0.212 -14.829 3.033) 15.137 14.882 ( 7.230 -7.679 1.241) 10.620 15.361 ( 3.176 9.798 -2.806) 10.675 16.014 ( -6.892 0.851 5.361) 8.773 16.914 ( -3.600 -4.276 -26.864) 27.439 20.644 ( -0.487 2.463 -0.431) 2.547 20.711 ( -0.722 -1.074 0.548) 1.405 21.716 ( -2.285 0.633 -1.749) 2.946 21.881 ( -1.074 -2.781 -0.102) 2.983 24.990 ( 2.162 3.369 10.853) 11.567 25.182 ( 3.267 -0.343 -5.405) 6.325 32.412 ( -1.576 0.004 -1.205) 1.984 32.475 ( -2.909 -1.660 0.304) 3.363 43.128 ( -19.938 10.013 11.872) 25.273 43.456 ( -24.942 15.291 -26.161) 39.247 44.388 ( -11.646 -4.249 -1.922) 12.545 45.275 ( -3.144 -44.494 -18.344) 48.230 ======================= Grid point 556 (274/355) ======================= q-point: (-0.08 -0.25 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.042 ( -10.455 -21.882 10.501) 26.427 2.451 ( -18.056 -28.693 7.870) 34.803 3.329 ( -18.353 -2.639 -0.536) 18.550 3.807 ( -12.437 -12.639 0.383) 17.736 4.394 ( -33.587 -40.762 8.975) 53.574 4.805 ( -8.512 8.028 15.845) 19.697 5.353 ( -5.982 0.720 0.654) 6.060 5.895 ( 17.016 -3.037 -6.060) 18.317 6.488 ( -8.503 7.049 15.729) 19.219 7.368 ( 8.395 14.266 3.623) 16.945 7.517 ( 4.429 -5.574 -21.796) 22.929 8.031 ( 19.776 2.242 -4.894) 20.496 10.287 ( -6.746 4.158 10.388) 13.065 10.724 ( 6.653 6.533 -4.053) 10.167 11.215 ( 17.146 8.816 6.553) 20.363 12.232 ( 4.940 15.006 6.116) 16.941 12.485 ( -0.780 21.157 -0.219) 21.172 13.483 ( 1.953 6.366 -2.360) 7.065 14.046 ( -6.518 -4.837 0.620) 8.141 14.251 ( -7.014 0.965 2.810) 7.617 15.124 ( 1.589 -7.256 0.279) 7.433 15.495 ( 24.346 -15.456 3.191) 29.014 16.014 ( -3.844 -4.505 5.223) 7.897 16.821 ( -3.157 -1.945 -19.839) 20.183 20.615 ( 0.802 0.856 -0.079) 1.176 20.738 ( 0.319 -2.388 0.630) 2.490 21.668 ( -2.643 1.412 -1.207) 3.230 21.892 ( -3.352 -1.332 -1.667) 3.974 24.964 ( -0.863 5.892 10.059) 11.689 25.198 ( 3.373 -0.415 -5.132) 6.156 32.395 ( -1.345 -0.789 -1.324) 2.046 32.490 ( -1.940 -2.634 0.441) 3.301 42.659 ( -19.964 9.333 -10.343) 24.344 43.161 ( -19.857 -1.927 5.297) 20.641 44.414 ( -7.197 -9.395 2.987) 12.206 45.932 ( 3.994 -43.336 -28.474) 52.007 ======================= Grid point 567 (275/355) ======================= q-point: (-0.17 -0.17 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 355 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.594 ( -25.623 -0.000 6.341) 26.395 1.772 ( -31.958 -0.000 5.770) 32.475 3.260 ( -54.034 -0.000 11.155) 55.174 3.324 ( -17.515 -0.000 0.217) 17.516 4.031 ( -11.423 -0.000 8.628) 14.315 5.048 ( -7.014 -0.000 17.464) 18.820 5.111 ( -17.180 -0.000 -0.346) 17.183 5.931 ( 24.229 0.000 -6.301) 25.035 6.739 ( -10.468 -0.000 19.410) 22.053 7.203 ( 0.114 0.000 -34.012) 34.012 7.754 ( 15.349 0.000 8.365) 17.481 8.043 ( 21.429 0.000 -8.056) 22.893 10.348 ( -6.743 -0.000 12.326) 14.050 10.833 ( 8.420 0.000 -17.477) 19.400 11.529 ( 31.129 0.000 23.526) 39.019 12.539 ( 9.872 0.000 8.954) 13.328 13.277 ( 7.898 0.000 4.224) 8.956 13.330 ( 5.514 0.000 -1.923) 5.840 13.976 ( -1.207 -0.000 0.690) 1.390 14.003 ( 9.302 0.000 12.661) 15.710 14.860 ( 4.852 0.000 1.149) 4.986 15.451 ( -1.518 -0.000 -3.609) 3.915 15.970 ( -7.939 -0.000 2.856) 8.437 16.577 ( -20.399 -0.000 -32.210) 38.126 20.654 ( -0.492 -0.000 -1.492) 1.571 20.708 ( 0.200 0.000 1.476) 1.489 21.693 ( -1.980 -0.000 -1.166) 2.298 21.851 ( -0.981 -0.000 0.617) 1.159 25.111 ( 4.911 0.000 9.126) 10.364 25.188 ( 3.618 0.000 -5.206) 6.339 32.409 ( 0.297 0.000 -0.089) 0.310 32.426 ( -3.219 -0.000 0.261) 3.230 43.094 ( -20.832 -0.000 19.000) 28.195 43.114 ( -38.769 -0.000 -49.319) 62.733 44.234 ( -9.146 -0.000 -1.399) 9.253 44.702 ( -8.598 -0.000 0.583) 8.618 ======================= Grid point 568 (276/355) ======================= q-point: (-0.08 -0.17 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.573 ( -14.129 -23.553 14.952) 31.272 1.862 ( -16.594 -28.188 12.279) 34.938 2.961 ( -36.327 -12.464 9.608) 39.590 3.257 ( -23.943 -15.917 6.066) 29.383 3.921 ( -10.455 -1.341 0.185) 10.543 4.918 ( -10.502 4.842 13.198) 17.548 5.141 ( -10.215 -8.431 6.197) 14.623 6.105 ( 18.732 1.503 -5.299) 19.525 6.598 ( -9.949 10.417 12.557) 19.109 7.186 ( 1.075 -10.483 -25.714) 27.789 7.804 ( 11.776 11.925 4.087) 17.250 8.231 ( 20.443 0.265 -7.239) 21.689 10.318 ( -7.117 1.938 11.198) 13.409 10.821 ( 8.223 2.310 -15.160) 17.401 11.798 ( 33.610 19.065 19.310) 43.197 12.563 ( 6.403 12.704 9.298) 16.995 12.904 ( 1.846 28.394 2.592) 28.571 13.562 ( 4.512 -2.421 -1.311) 5.286 13.940 ( -8.602 0.858 -3.174) 9.208 14.251 ( 9.357 -1.054 12.200) 15.411 15.008 ( -0.774 -5.948 -0.337) 6.007 15.479 ( 16.017 -13.417 -2.980) 21.105 15.907 ( -9.158 -2.658 5.018) 10.775 16.400 ( -22.182 -20.304 -25.188) 39.227 20.638 ( 0.630 1.000 -0.757) 1.404 20.718 ( 0.065 -0.670 0.946) 1.161 21.664 ( -1.581 1.070 -0.309) 1.934 21.845 ( -2.046 -0.461 -0.325) 2.122 25.123 ( 1.354 7.005 6.997) 9.993 25.206 ( 3.774 -0.150 -4.588) 5.943 32.382 ( -1.076 0.902 -0.082) 1.406 32.439 ( -0.837 -1.843 0.341) 2.053 42.485 ( -25.369 4.773 -21.013) 33.285 42.960 ( -22.814 -0.439 11.935) 25.751 44.221 ( -5.090 -7.098 2.116) 8.987 45.043 ( -4.299 -43.905 -14.701) 46.501 ======================= Grid point 580 (277/355) ======================= q-point: (-0.08 -0.08 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 354 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.278 ( -12.170 -0.000 25.780) 28.509 1.480 ( -6.726 -0.000 22.373) 23.362 2.584 ( -28.179 -0.000 26.851) 38.924 2.970 ( -15.665 -0.000 -0.495) 15.673 3.801 ( -12.468 -0.000 -5.576) 13.658 4.799 ( -14.104 -0.000 -2.831) 14.385 5.081 ( -8.428 -0.000 16.427) 18.463 6.206 ( 8.956 0.000 -10.684) 13.941 6.695 ( -11.971 -0.000 21.040) 24.207 7.015 ( 12.250 0.000 -26.806) 29.472 8.018 ( 5.073 0.000 3.299) 6.051 8.399 ( 21.111 0.000 -9.668) 23.219 10.311 ( -7.647 -0.000 10.602) 13.072 10.854 ( 9.338 0.000 -16.347) 18.827 12.419 ( 36.716 0.000 9.532) 37.933 12.807 ( 6.256 0.000 12.419) 13.906 13.396 ( 0.826 0.000 1.343) 1.576 13.443 ( 4.187 0.000 -0.018) 4.187 13.849 ( -4.878 -0.000 -4.873) 6.895 14.654 ( 43.090 0.000 15.915) 45.935 15.009 ( 4.915 0.000 4.969) 6.989 15.126 ( -31.648 -0.000 -20.329) 37.615 15.785 ( -25.600 -0.000 -5.845) 26.259 15.836 ( -6.634 -0.000 1.137) 6.731 20.651 ( 1.190 0.000 -0.649) 1.355 20.716 ( -0.729 -0.000 0.614) 0.953 21.666 ( -0.145 -0.000 0.545) 0.564 21.825 ( -1.649 -0.000 -0.404) 1.698 25.222 ( -1.363 -0.000 2.187) 2.577 25.223 ( 4.156 0.000 -4.266) 5.955 32.379 ( -1.714 -0.000 0.497) 1.785 32.426 ( 0.574 0.000 -0.117) 0.586 42.231 ( -7.359 -0.000 -10.538) 12.853 42.787 ( -24.113 -0.000 12.257) 27.050 44.126 ( -2.200 -0.000 1.754) 2.814 44.534 ( -7.413 -0.000 -1.569) 7.578 ======================= Grid point 581 (278/355) ======================= q-point: ( 0.00 0.00 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 355 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.101 ( 3.715 0.000 16.873) 17.277 2.253 ( 13.463 0.000 6.214) 14.828 2.782 ( 4.273 0.000 6.288) 7.603 3.046 ( -9.753 -0.000 -12.357) 15.742 3.446 ( 15.556 0.000 26.947) 31.114 4.007 ( -21.129 -0.000 -25.566) 33.167 5.429 ( -13.184 -0.000 22.418) 26.007 5.865 ( 11.143 0.000 -20.034) 22.924 6.904 ( -14.799 -0.000 7.933) 16.791 6.985 ( 14.095 0.000 -2.870) 14.385 8.067 ( -16.120 -0.000 10.859) 19.436 8.372 ( 17.818 0.000 -17.359) 24.876 10.430 ( -9.591 -0.000 10.024) 13.873 10.645 ( 10.210 0.000 -11.704) 15.531 13.130 ( -21.653 -0.000 6.618) 22.642 13.135 ( 23.215 0.000 3.716) 23.510 13.300 ( 4.039 0.000 -2.499) 4.750 13.337 ( -2.148 -0.000 -3.799) 4.364 13.955 ( 24.767 0.000 0.756) 24.779 13.978 ( -36.848 -0.000 -1.605) 36.883 15.195 ( -8.884 -0.000 7.773) 11.804 15.341 ( 5.094 0.000 -6.222) 8.041 15.734 ( 17.440 0.000 -1.274) 17.487 15.738 ( -2.837 -0.000 -1.345) 3.140 20.684 ( 2.527 0.000 -0.010) 2.527 20.684 ( -2.546 -0.000 -0.044) 2.546 21.726 ( 2.300 0.000 1.450) 2.719 21.755 ( -2.216 -0.000 -1.388) 2.615 25.151 ( -8.161 -0.000 2.968) 8.684 25.213 ( 5.938 0.000 -3.123) 6.709 32.386 ( 0.397 0.000 0.793) 0.887 32.402 ( -0.542 -0.000 -0.757) 0.931 42.484 ( -30.784 -0.000 5.539) 31.278 42.598 ( 39.160 0.000 -5.698) 39.573 44.245 ( 4.975 0.000 3.784) 6.251 44.321 ( -4.925 -0.000 -3.721) 6.173 ======================= Grid point 582 (279/355) ======================= q-point: ( 0.08 0.00 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.344 ( 4.086 -16.328 9.070) 19.120 2.543 ( 13.993 -17.592 -8.968) 24.202 2.839 ( 5.538 5.846 9.159) 12.196 2.936 ( 3.891 -2.104 -8.074) 9.206 3.908 ( -17.540 -23.447 -21.808) 36.510 4.116 ( 30.159 -31.456 25.613) 50.548 5.415 ( -12.585 -1.601 23.825) 26.992 5.890 ( 10.948 0.440 -19.104) 22.023 6.725 ( -17.470 4.318 4.239) 18.489 7.015 ( 5.829 7.957 -2.610) 10.203 7.876 ( -20.225 6.237 14.026) 25.390 8.397 ( 13.788 6.182 -18.306) 23.737 10.373 ( -8.576 0.997 9.969) 13.189 10.675 ( 9.944 2.487 -11.218) 15.195 12.670 ( -20.607 21.729 3.960) 30.207 13.010 ( 6.571 30.658 -3.338) 31.532 13.160 ( -10.243 8.486 -3.013) 13.639 13.386 ( 12.824 9.201 5.078) 16.580 13.714 ( -21.965 -5.006 0.920) 22.547 14.240 ( 25.503 1.098 3.366) 25.748 15.087 ( -21.318 -6.765 0.293) 22.367 15.487 ( 13.420 -11.176 -0.058) 17.464 15.749 ( -10.974 -11.911 3.768) 16.628 16.157 ( 19.435 -17.401 -11.755) 28.613 20.652 ( -2.739 0.637 0.209) 2.820 20.707 ( 2.569 0.080 -0.113) 2.573 21.725 ( -1.724 0.458 -1.322) 2.220 21.759 ( 2.872 -0.140 0.977) 3.037 25.069 ( -8.125 1.635 4.894) 9.625 25.242 ( 4.959 1.586 -2.791) 5.907 32.392 ( -0.251 0.010 -0.244) 0.350 32.407 ( 1.439 -0.865 0.254) 1.698 42.221 ( -22.330 -0.227 2.609) 22.483 42.876 ( 36.460 9.157 -7.448) 38.323 44.437 ( -0.269 -17.067 2.118) 17.200 44.552 ( 7.619 -25.779 -5.596) 27.458 ======================= Grid point 583 (280/355) ======================= q-point: ( 0.17 0.00 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.702 ( -0.649 -15.574 -0.780) 15.607 2.849 ( 12.138 -3.698 1.840) 12.822 3.030 ( 8.359 -23.025 -24.447) 34.607 3.105 ( 13.937 -9.323 20.405) 26.411 4.236 ( -6.721 -38.783 -11.386) 40.975 5.050 ( 18.492 -27.973 12.499) 35.786 5.497 ( -2.112 -9.416 19.895) 22.112 5.866 ( 3.799 3.570 -5.947) 7.909 6.471 ( -14.470 3.395 -13.452) 20.047 6.841 ( -2.215 13.730 9.280) 16.719 7.644 ( -17.155 5.984 15.190) 23.682 8.285 ( 10.952 10.809 -19.954) 25.198 10.329 ( -6.444 0.506 9.959) 11.873 10.647 ( 8.275 6.099 -10.253) 14.519 12.128 ( -17.655 22.056 0.176) 28.252 12.462 ( -1.493 30.610 -1.515) 30.683 12.809 ( -10.209 16.252 -8.583) 21.024 13.270 ( -2.546 12.058 8.595) 15.025 13.719 ( 5.507 -3.069 0.844) 6.361 14.349 ( 19.069 12.098 -2.391) 22.709 15.128 ( -14.802 -17.766 1.650) 23.183 15.772 ( 9.602 -5.459 4.788) 12.038 15.965 ( -13.349 -23.201 4.195) 27.094 16.480 ( 11.096 -9.288 -11.534) 18.504 20.618 ( -2.902 0.019 0.696) 2.985 20.739 ( 2.446 -1.155 -0.120) 2.707 21.688 ( -1.124 1.414 -1.667) 2.458 21.801 ( 3.707 -0.621 0.059) 3.759 24.994 ( -6.867 1.277 6.662) 9.652 25.232 ( 3.682 2.825 -3.833) 6.019 32.390 ( -0.329 -0.531 -0.739) 0.968 32.454 ( 2.440 -2.178 0.293) 3.284 42.114 ( -10.846 -5.185 3.714) 12.582 43.004 ( 28.505 9.003 -5.275) 30.355 44.777 ( -3.214 -22.674 -0.215) 22.902 45.128 ( 12.841 -31.353 -7.085) 34.614 ======================= Grid point 584 (281/355) ======================= q-point: ( 0.25 0.00 -0.56) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.832 ( 1.285 -7.152 -7.231) 10.251 3.105 ( 7.629 -6.453 5.485) 11.398 3.293 ( 8.017 -15.025 -4.946) 17.734 3.694 ( 10.709 -30.558 4.259) 32.659 4.850 ( 3.567 -33.705 -3.377) 34.061 5.287 ( -10.639 -2.400 14.772) 18.362 5.529 ( -16.050 10.716 -3.467) 19.608 6.024 ( 9.658 -6.375 -7.946) 14.038 6.388 ( 5.581 -7.918 -3.531) 10.311 6.747 ( -1.728 -3.762 20.877) 21.283 7.485 ( -10.403 2.887 8.738) 13.889 8.095 ( 9.827 12.371 -20.838) 26.150 10.321 ( -3.825 -0.079 9.106) 9.877 10.540 ( 5.371 9.383 -7.965) 13.429 11.586 ( -14.666 19.352 -7.449) 25.398 12.042 ( -1.092 19.343 3.224) 19.640 12.385 ( -9.286 16.488 -9.438) 21.146 13.088 ( -4.288 8.793 7.881) 12.563 13.883 ( 14.075 -3.197 2.014) 14.573 14.284 ( 14.806 11.755 -4.541) 19.443 15.303 ( -10.264 -14.888 2.300) 18.229 15.950 ( 2.632 -5.322 6.850) 9.064 16.138 ( -13.476 -11.678 -0.630) 17.843 16.601 ( 4.546 -0.899 -6.237) 7.770 20.603 ( -2.686 -1.083 1.086) 3.093 20.794 ( 1.660 -2.744 0.061) 3.208 21.647 ( 0.193 1.801 -1.742) 2.513 21.849 ( 3.742 -0.760 -0.868) 3.916 24.952 ( -5.584 0.367 7.634) 9.465 25.195 ( 2.944 2.812 -5.305) 6.687 32.401 ( -0.139 -1.630 -0.858) 1.848 32.525 ( 2.547 -2.995 0.105) 3.933 42.189 ( -3.423 -8.281 6.553) 11.101 43.128 ( 24.534 5.180 -3.070) 25.263 45.063 ( -6.735 -17.823 -4.942) 19.684 45.735 ( 11.997 -27.933 -2.438) 30.498 ======================= Grid point 585 (282/355) ======================= q-point: ( 0.33 0.00 -0.56) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.933 ( 1.455 -6.915 -6.685) 9.728 3.247 ( -0.599 -5.330 0.412) 5.379 3.627 ( 12.778 -11.620 1.020) 17.302 4.307 ( 7.619 -27.728 5.804) 29.335 4.971 ( -23.112 12.763 0.322) 26.404 5.079 ( -11.519 2.961 -11.235) 16.361 5.529 ( 0.368 -16.425 22.100) 27.538 6.172 ( 7.024 3.804 8.202) 11.449 6.417 ( 4.617 -4.379 -9.524) 11.454 7.089 ( -3.070 -13.710 14.308) 20.053 7.450 ( -0.506 -5.809 -3.989) 7.065 7.912 ( 10.582 9.485 -18.413) 23.259 10.302 ( 1.059 5.234 0.807) 5.401 10.426 ( 0.144 3.093 2.288) 3.850 11.165 ( -10.407 11.887 -7.991) 17.705 11.778 ( -1.174 12.954 0.552) 13.019 12.028 ( -6.341 11.737 -5.509) 14.433 12.988 ( -1.472 3.685 7.448) 8.439 14.090 ( 13.006 -2.591 1.069) 13.305 14.269 ( 16.812 4.768 -3.218) 17.769 15.396 ( -11.269 -7.030 1.487) 13.365 16.004 ( -0.945 3.930 4.725) 6.218 16.186 ( -10.989 -12.217 -0.650) 16.445 16.544 ( -0.494 6.573 -4.402) 7.926 20.608 ( -2.034 -1.451 1.280) 2.807 20.851 ( 0.258 -2.568 -0.160) 2.586 21.622 ( 1.486 1.274 -1.307) 2.354 21.891 ( 2.914 -0.849 -1.076) 3.220 24.937 ( -4.712 -0.304 8.067) 9.347 25.155 ( 2.816 2.026 -6.290) 7.183 32.432 ( 0.149 -2.238 -0.643) 2.333 32.597 ( 1.907 -2.781 -0.043) 3.372 42.341 ( -1.358 -8.000 7.161) 10.822 43.291 ( 21.869 2.378 -0.411) 22.002 45.185 ( -9.564 -10.203 -7.420) 15.831 46.250 ( 9.403 -20.761 0.377) 22.795 ======================= Grid point 586 (283/355) ======================= q-point: ( 0.42 0.00 -0.56) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.021 ( -0.096 -4.956 -2.904) 5.745 3.281 ( -4.367 -2.946 -3.696) 6.435 3.879 ( 13.175 -0.310 -0.434) 13.186 4.504 ( -19.713 6.326 0.555) 20.711 4.764 ( 1.302 -7.731 14.368) 16.368 5.052 ( -3.905 -18.112 -11.713) 21.920 5.733 ( -5.854 9.068 20.330) 23.017 6.097 ( 2.959 -0.341 10.060) 10.491 6.658 ( 11.113 -8.460 -2.500) 14.189 7.110 ( -5.066 3.427 -6.510) 8.932 7.578 ( -5.279 -8.026 0.858) 9.645 7.855 ( 12.254 2.072 -15.537) 19.896 10.222 ( 2.887 4.521 -1.345) 5.531 10.438 ( -1.518 -1.153 6.147) 6.435 10.893 ( -6.582 6.512 -6.778) 11.475 11.584 ( -2.129 6.980 -2.712) 7.785 11.830 ( -2.149 5.647 -0.490) 6.062 12.994 ( 1.260 -0.340 5.557) 5.708 14.213 ( 8.220 -1.106 -0.813) 8.334 14.426 ( 14.757 -1.801 -0.677) 14.882 15.319 ( -10.969 1.765 0.184) 11.112 15.946 ( -5.144 0.138 4.831) 7.058 16.278 ( -3.219 -5.833 -0.129) 6.663 16.376 ( -0.752 7.970 -4.879) 9.375 20.619 ( -1.070 -0.975 1.167) 1.859 20.879 ( -0.419 -1.158 -0.468) 1.318 21.616 ( 1.230 0.669 -0.852) 1.639 21.925 ( 1.502 -0.961 -0.811) 1.959 24.938 ( -4.220 -0.639 8.238) 9.278 25.127 ( 2.967 1.264 -6.718) 7.452 32.466 ( 0.209 -1.684 -0.462) 1.759 32.649 ( 0.924 -1.619 -0.068) 1.865 42.471 ( -1.967 -5.790 5.185) 8.017 43.460 ( 16.654 1.589 1.660) 16.812 45.168 ( -9.893 -3.789 -5.879) 12.116 46.604 ( 6.741 -11.930 -1.197) 13.755 ======================= Grid point 587 (284/355) ======================= q-point: (-0.50 0.00 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.052 ( -1.872 0.373 0.694) 2.031 3.247 ( -3.010 -0.446 -3.476) 4.620 3.893 ( -2.747 -0.388 -1.628) 3.216 4.401 ( 0.252 -1.103 3.333) 3.520 4.810 ( -0.815 2.515 7.775) 8.212 5.373 ( -3.570 9.206 4.553) 10.873 5.486 ( 4.489 -11.361 -1.139) 12.269 6.314 ( -4.605 -11.081 20.277) 23.561 6.718 ( 3.204 8.425 -12.974) 15.797 6.986 ( 0.765 2.052 -4.242) 4.774 7.573 ( -10.167 0.791 9.514) 13.947 7.883 ( 12.313 2.171 -16.406) 20.627 10.195 ( 0.235 1.420 0.927) 1.712 10.471 ( -1.053 -1.468 4.069) 4.452 10.769 ( 0.077 0.421 -5.194) 5.211 11.496 ( -2.106 -0.458 -1.846) 2.838 11.772 ( -0.199 0.352 1.014) 1.092 13.051 ( 2.105 -2.046 0.836) 3.052 14.271 ( -1.485 0.029 0.350) 1.526 14.517 ( 0.903 1.279 0.073) 1.567 15.226 ( -0.375 -0.389 -0.476) 0.720 15.946 ( -3.581 -1.724 5.938) 7.145 16.241 ( 6.904 4.479 -5.395) 9.841 16.340 ( -0.674 -1.088 -0.347) 1.326 20.628 ( 0.048 -0.153 0.719) 0.737 20.882 ( -0.041 0.220 -0.234) 0.324 21.613 ( -0.138 -0.016 -0.518) 0.536 21.940 ( -0.500 -0.541 -0.737) 1.042 24.948 ( -3.930 -0.883 8.286) 9.213 25.109 ( 3.177 0.832 -6.824) 7.573 32.482 ( -0.013 -0.224 -0.507) 0.554 32.667 ( -0.061 0.074 0.046) 0.106 42.538 ( -2.967 -2.990 2.273) 4.786 43.554 ( 6.450 2.590 1.009) 7.024 45.090 ( -6.265 0.976 -0.340) 6.349 46.766 ( 4.368 -2.611 -5.818) 7.730 ======================= Grid point 588 (285/355) ======================= q-point: (-0.42 0.00 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.955 ( -4.397 7.910 3.418) 9.674 3.239 ( 1.056 -0.315 0.105) 1.107 3.866 ( -14.878 -3.060 0.666) 15.204 4.508 ( 16.496 -2.962 1.046) 16.792 4.810 ( 2.572 3.807 10.824) 11.759 4.958 ( -4.084 23.709 -1.591) 24.111 5.945 ( 6.847 -24.960 -2.212) 25.977 6.350 ( -6.964 9.618 -8.877) 14.826 6.500 ( -6.783 10.127 5.587) 13.408 6.958 ( -4.949 -2.950 6.065) 8.365 7.503 ( -1.848 5.127 12.320) 13.472 7.855 ( 10.359 5.554 -16.402) 20.179 10.181 ( -3.296 -1.400 2.588) 4.418 10.508 ( 0.110 -2.097 0.581) 2.179 10.829 ( 6.865 -4.444 -1.571) 8.327 11.544 ( -1.550 -8.003 0.439) 8.164 11.820 ( 1.377 -4.861 1.135) 5.178 13.100 ( 1.908 -2.483 -4.735) 5.677 14.184 ( -11.555 0.786 1.814) 11.723 14.411 ( -12.316 3.839 0.965) 12.936 15.322 ( 9.599 -3.116 -0.232) 10.095 15.957 ( 1.729 1.970 4.226) 4.973 16.312 ( 0.006 -0.320 -3.897) 3.910 16.331 ( 13.258 -0.480 -0.360) 13.271 20.631 ( 1.025 0.686 0.055) 1.235 20.872 ( 0.723 1.461 0.262) 1.652 21.609 ( -1.646 -0.757 -0.200) 1.823 21.924 ( -2.522 0.160 -0.744) 2.635 24.967 ( -3.648 -1.393 8.201) 9.083 25.099 ( 3.385 0.618 -6.714) 7.544 32.467 ( -0.260 1.378 -0.633) 1.539 32.647 ( -0.936 1.738 0.197) 1.984 42.533 ( -3.630 -0.049 -0.803) 3.718 43.497 ( -6.668 3.811 -1.447) 7.816 45.021 ( -0.446 5.214 7.258) 8.948 46.721 ( 2.218 7.327 -11.874) 14.128 ======================= Grid point 589 (286/355) ======================= q-point: (-0.33 0.00 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.770 ( -5.282 10.645 8.339) 14.517 3.238 ( 1.653 3.801 0.826) 4.226 3.622 ( -16.115 12.963 1.872) 20.767 4.431 ( -1.882 29.385 -4.509) 29.788 4.864 ( 11.469 -13.041 6.054) 18.392 4.927 ( 6.459 -5.990 8.594) 12.307 5.958 ( -10.149 19.735 -12.739) 25.588 6.081 ( -7.662 25.975 4.582) 27.466 6.368 ( 1.939 -17.482 -2.387) 17.750 7.119 ( -3.007 -11.469 17.741) 21.338 7.423 ( -0.048 8.965 -2.766) 9.382 7.811 ( 9.293 0.680 -11.389) 14.715 10.227 ( -3.670 -6.399 5.286) 9.075 10.534 ( 0.709 -1.327 -4.476) 4.722 11.028 ( 10.790 -8.378 4.402) 14.352 11.740 ( -0.005 -15.278 2.617) 15.500 11.974 ( 4.126 -9.657 1.277) 10.578 13.143 ( 2.660 -4.187 -7.705) 9.164 14.084 ( -14.179 -1.997 1.706) 14.420 14.211 ( -16.754 0.365 2.448) 16.936 15.416 ( 9.794 5.195 -0.629) 11.105 15.991 ( 5.481 0.522 5.796) 7.994 16.225 ( 3.498 8.191 -3.881) 9.715 16.526 ( 9.923 -4.902 -2.909) 11.444 20.626 ( 1.622 1.257 -0.498) 2.111 20.847 ( 0.874 2.736 0.254) 2.883 21.605 ( -2.424 -1.318 0.263) 2.772 21.884 ( -3.602 0.394 -0.382) 3.643 25.000 ( -3.184 -2.433 7.675) 8.658 25.095 ( 3.542 0.319 -6.214) 7.160 32.430 ( -0.220 2.250 -0.523) 2.320 32.595 ( -1.679 2.845 0.217) 3.311 42.460 ( -3.657 3.127 -4.099) 6.321 43.305 ( -16.949 3.109 -1.594) 17.306 44.955 ( 2.684 10.261 12.831) 16.648 46.451 ( 0.082 18.391 -17.585) 25.446 ======================= Grid point 590 (287/355) ======================= q-point: (-0.25 0.00 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.590 ( -4.104 11.236 13.984) 18.402 3.073 ( -0.461 22.900 7.215) 24.014 3.235 ( -16.793 9.270 0.229) 19.184 3.907 ( -3.663 23.865 -11.882) 26.910 4.779 ( -12.748 29.409 3.014) 32.194 5.201 ( 1.809 -5.613 12.901) 14.185 5.592 ( -7.513 15.839 21.185) 27.498 5.808 ( 17.745 -4.697 -14.039) 23.109 6.469 ( -9.996 1.932 -4.531) 11.144 7.152 ( 0.995 7.074 -19.002) 20.300 7.447 ( 0.358 -13.657 16.456) 21.388 7.928 ( 10.310 -6.503 -8.510) 14.867 10.349 ( -4.648 -8.185 7.909) 12.294 10.532 ( 2.474 -0.584 -8.387) 8.763 11.400 ( 15.627 -17.566 10.258) 25.652 12.057 ( 0.790 -19.977 1.866) 20.079 12.245 ( 7.499 -14.659 4.152) 16.981 13.251 ( 5.220 -8.742 -7.993) 12.945 13.912 ( -16.110 2.296 -0.797) 16.292 14.181 ( -14.088 -10.397 5.558) 18.370 15.339 ( 8.238 13.190 -1.195) 15.597 16.062 ( 7.009 3.797 6.547) 10.315 16.081 ( 2.247 9.886 -5.278) 11.430 16.585 ( 3.021 5.143 -5.278) 7.965 20.621 ( 1.960 1.025 -0.618) 2.296 20.797 ( -0.439 3.294 -0.237) 3.332 21.615 ( -1.205 -1.882 1.164) 2.519 21.842 ( -3.576 0.143 -0.095) 3.580 25.055 ( -1.864 -3.493 5.097) 6.454 25.105 ( 2.896 -0.670 -4.074) 5.043 32.392 ( 0.132 1.804 -0.041) 1.810 32.526 ( -2.120 3.024 0.050) 3.694 42.325 ( -1.810 6.171 -6.500) 9.144 43.078 ( -22.389 -0.352 1.684) 22.455 44.826 ( 2.150 15.996 14.425) 21.647 45.949 ( -2.143 29.516 -20.121) 35.786 ======================= Grid point 591 (288/355) ======================= q-point: (-0.17 0.00 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.417 ( -2.152 17.672 21.285) 27.749 2.621 ( -6.810 26.809 15.338) 31.628 2.949 ( -11.155 8.933 -3.594) 14.736 3.494 ( -6.962 11.520 -14.940) 20.109 4.014 ( -7.620 41.381 8.960) 43.020 5.184 ( -16.424 22.598 2.557) 28.053 5.374 ( -2.749 -4.758 17.437) 18.282 6.133 ( -7.739 12.987 -15.313) 21.518 6.266 ( 19.199 -18.391 -0.143) 26.587 7.047 ( -0.256 -0.017 -8.751) 8.755 7.776 ( 3.555 -14.768 9.519) 17.926 8.102 ( 9.963 -6.364 -10.142) 15.577 10.443 ( -7.740 -5.101 9.957) 13.604 10.543 ( 6.334 -1.210 -11.231) 12.951 12.027 ( 21.363 -28.027 10.028) 36.639 12.426 ( 0.576 -23.053 2.024) 23.149 12.643 ( 8.406 -18.936 7.310) 21.970 13.450 ( 4.538 -12.153 -8.813) 15.683 13.732 ( -8.651 3.204 -0.196) 9.227 14.268 ( -16.085 -13.953 5.574) 22.011 15.168 ( 10.555 16.268 -1.862) 19.481 15.882 ( -9.533 7.823 -5.606) 13.547 16.014 ( 12.976 16.506 1.184) 21.029 16.345 ( -5.708 18.759 -0.887) 19.628 20.630 ( 2.185 0.059 -0.416) 2.224 20.739 ( -1.818 1.739 -0.180) 2.522 21.653 ( 0.815 -1.717 1.704) 2.553 21.808 ( -2.936 -0.158 -0.507) 2.984 25.112 ( 3.637 -1.567 -3.268) 5.134 25.147 ( -2.547 -4.066 3.008) 5.663 32.377 ( 0.381 0.452 0.455) 0.746 32.460 ( -1.968 2.186 -0.222) 2.950 42.202 ( 6.182 5.978 -4.972) 9.933 42.895 ( -25.752 -4.260 5.354) 26.646 44.596 ( 0.763 19.872 12.016) 23.235 45.277 ( -4.012 35.074 -16.521) 38.977 ======================= Grid point 592 (289/355) ======================= q-point: (-0.08 0.00 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.136 ( -2.385 18.864 26.036) 32.240 2.297 ( 5.980 20.551 14.038) 25.597 2.761 ( -7.412 -0.473 -0.445) 7.440 3.215 ( -7.570 7.543 -6.001) 12.257 3.503 ( 1.998 21.369 10.542) 23.912 4.543 ( -23.921 21.891 -15.908) 36.118 5.447 ( -11.067 -1.198 22.247) 24.876 5.892 ( 5.868 3.955 -20.984) 22.145 6.713 ( 14.939 -12.120 2.750) 19.432 7.007 ( -4.555 0.578 0.372) 4.607 8.046 ( -5.169 -10.597 10.079) 15.512 8.240 ( 15.515 -2.957 -15.748) 22.304 10.462 ( -9.304 -2.126 10.230) 13.991 10.590 ( 8.979 -1.236 -11.880) 14.942 12.704 ( 25.142 -17.841 0.638) 30.835 12.897 ( -5.599 -31.491 8.432) 33.077 13.054 ( 6.988 -15.744 5.432) 18.061 13.501 ( -16.156 -3.152 -5.126) 17.241 13.749 ( 20.803 1.354 -2.365) 20.981 14.295 ( -28.831 -9.707 -1.580) 30.463 15.088 ( 21.262 6.908 0.020) 22.356 15.518 ( -17.704 14.029 -3.459) 22.851 15.832 ( 19.055 21.195 -4.225) 28.812 15.958 ( -13.262 15.368 7.963) 21.806 20.656 ( 2.358 -0.427 -0.164) 2.402 20.706 ( -2.326 -0.064 0.017) 2.326 21.694 ( 1.760 -0.680 1.559) 2.448 21.782 ( -2.346 -0.215 -1.162) 2.627 25.161 ( 5.478 -0.938 -3.994) 6.844 25.185 ( -5.779 -3.160 2.615) 7.087 32.381 ( 0.131 -0.068 0.636) 0.653 32.417 ( -1.199 0.713 -0.574) 1.508 42.272 ( 23.384 0.235 -2.242) 23.492 42.727 ( -29.923 -4.270 7.202) 31.072 44.335 ( 1.800 15.843 6.836) 17.348 44.636 ( -5.012 26.149 -8.540) 27.961 ======================= Grid point 594 (290/355) ======================= q-point: ( 0.08 0.08 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 354 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.205 ( 0.093 0.000 -6.480) 6.481 2.442 ( 12.904 0.000 -23.394) 26.717 2.902 ( 8.531 0.000 -1.261) 8.624 3.191 ( 19.821 0.000 11.863) 23.100 3.533 ( 0.625 0.000 -14.014) 14.028 4.264 ( 33.968 0.000 25.357) 42.388 5.387 ( -11.831 -0.000 25.389) 28.011 5.928 ( 13.210 0.000 -20.967) 24.782 6.557 ( -24.623 -0.000 1.762) 24.686 7.121 ( 1.464 0.000 -0.636) 1.596 7.762 ( -24.694 -0.000 15.340) 29.071 8.485 ( 9.781 0.000 -18.482) 20.911 10.341 ( -8.347 -0.000 10.041) 13.058 10.748 ( 10.469 0.000 -11.418) 15.491 12.618 ( -26.879 -0.000 -1.704) 26.933 13.091 ( -18.893 -0.000 0.093) 18.893 13.403 ( -18.165 -0.000 4.831) 18.796 13.418 ( 4.402 0.000 -0.277) 4.411 13.662 ( 21.681 0.000 1.120) 21.710 14.495 ( 20.058 0.000 11.037) 22.894 14.896 ( -19.599 -0.000 0.814) 19.615 15.166 ( -12.502 -0.000 -2.381) 12.727 15.803 ( 8.775 0.000 -2.625) 9.160 16.132 ( 23.471 0.000 -14.755) 27.724 20.636 ( -2.035 -0.000 0.078) 2.036 20.732 ( 2.164 0.000 -0.176) 2.171 21.705 ( -1.392 -0.000 -1.265) 1.881 21.791 ( 2.819 0.000 1.151) 3.045 25.022 ( -8.173 -0.000 5.542) 9.875 25.291 ( 3.618 0.000 -1.686) 3.992 32.401 ( 1.298 0.000 -0.624) 1.441 32.409 ( 0.871 0.000 0.647) 1.085 42.032 ( -14.765 -0.000 2.214) 14.930 43.339 ( 41.557 0.000 -15.812) 44.463 44.238 ( 0.144 0.000 -3.586) 3.589 44.430 ( 9.788 0.000 3.366) 10.351 ======================= Grid point 595 (291/355) ======================= q-point: ( 0.17 0.08 -0.56) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.363 ( 2.472 -19.801 -8.835) 21.823 2.568 ( 2.814 -17.927 -30.034) 35.090 3.010 ( 16.182 1.696 4.533) 16.890 3.394 ( 21.954 6.272 12.913) 26.231 3.739 ( 17.511 -19.469 -4.349) 26.545 4.890 ( 20.920 -19.848 11.738) 31.134 5.465 ( 0.004 -5.473 26.723) 27.278 5.931 ( 6.885 3.024 -12.894) 14.927 6.281 ( -22.122 1.254 -8.165) 23.614 7.031 ( -4.905 8.772 4.846) 11.157 7.579 ( -22.016 1.230 16.212) 27.369 8.427 ( 6.947 5.903 -20.200) 22.162 10.309 ( -7.139 -0.143 10.244) 12.487 10.770 ( 9.710 3.393 -11.282) 15.267 12.207 ( -24.847 13.981 -3.061) 28.675 12.779 ( -21.062 13.971 0.992) 25.294 13.054 ( -2.173 22.875 -4.123) 23.345 13.412 ( -3.103 4.705 4.036) 6.932 13.800 ( 13.851 3.307 2.969) 14.547 14.632 ( -7.171 6.589 -5.498) 11.183 14.790 ( 7.964 -11.213 9.056) 16.467 15.368 ( -17.279 -27.176 1.869) 32.259 15.866 ( 11.957 0.024 2.636) 12.244 16.378 ( 15.331 -9.880 -15.725) 24.082 20.610 ( -1.575 1.006 0.514) 1.939 20.750 ( 1.840 -0.095 -0.539) 1.920 21.688 ( -0.592 0.313 -1.261) 1.428 21.826 ( 2.932 -0.345 0.651) 3.024 24.968 ( -7.072 0.421 6.681) 9.738 25.292 ( 2.011 2.172 -2.416) 3.821 32.396 ( 0.903 1.047 -0.506) 1.473 32.444 ( 1.964 -1.789 0.020) 2.657 41.988 ( -2.673 -3.266 5.651) 7.053 43.482 ( 32.104 14.692 -11.812) 37.230 44.424 ( 3.815 -17.124 -6.940) 18.867 44.760 ( 11.923 -23.422 0.810) 26.294 ======================= Grid point 596 (292/355) ======================= q-point: ( 0.25 0.08 -0.56) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.655 ( 3.308 -11.970 -13.163) 18.097 2.816 ( -3.542 -27.165 -16.851) 32.163 3.247 ( 18.479 -5.646 6.230) 20.302 3.598 ( 20.507 -1.167 12.761) 24.181 4.417 ( 23.832 -32.040 -0.085) 39.932 5.183 ( -10.626 -6.719 18.045) 21.992 5.519 ( -14.382 10.114 -8.118) 19.366 5.972 ( 3.740 -0.849 -10.957) 11.609 6.256 ( 13.421 -17.461 6.284) 22.902 6.852 ( -7.109 7.866 13.460) 17.134 7.442 ( -14.671 1.009 11.659) 18.767 8.261 ( 6.094 9.354 -22.061) 24.725 10.305 ( -5.376 -1.269 10.416) 11.790 10.717 ( 8.136 7.898 -10.375) 15.369 11.673 ( -21.576 17.387 -8.608) 29.016 12.318 ( -12.687 18.144 3.036) 22.347 12.632 ( -1.650 21.865 -7.084) 23.043 13.273 ( 0.199 11.484 5.829) 12.880 13.942 ( 9.387 -4.856 4.002) 11.301 14.489 ( -0.128 4.168 -6.174) 7.451 15.054 ( 2.779 -9.231 4.522) 10.648 15.577 ( -21.252 -22.230 -0.312) 30.756 16.040 ( 6.017 -2.887 7.329) 9.912 16.569 ( 8.598 -5.698 -11.694) 15.593 20.584 ( -1.275 0.561 1.117) 1.785 20.774 ( 1.466 -1.263 -0.796) 2.093 21.670 ( 0.532 1.051 -1.218) 1.694 21.867 ( 2.976 -0.714 0.000) 3.061 24.933 ( -5.774 0.041 7.533) 9.492 25.246 ( 1.365 3.065 -4.281) 5.439 32.391 ( 1.102 0.130 -0.774) 1.353 32.503 ( 2.385 -2.547 -0.157) 3.493 42.115 ( 4.636 -5.000 10.248) 12.310 43.511 ( 27.510 11.048 -6.518) 30.354 44.707 ( 0.922 -16.595 -8.442) 18.642 45.344 ( 10.520 -30.258 0.281) 32.036 ======================= Grid point 597 (293/355) ======================= q-point: ( 0.33 0.08 -0.56) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.787 ( 1.568 -9.503 -11.275) 14.828 3.098 ( -0.706 -11.608 -1.864) 11.778 3.600 ( 17.056 -12.636 1.860) 21.308 3.997 ( 16.497 -17.913 7.022) 25.344 4.927 ( -6.362 -1.272 5.216) 8.325 5.028 ( -23.401 12.654 -3.601) 26.846 5.363 ( 2.215 -15.965 20.456) 26.043 6.065 ( 13.458 -14.530 -18.185) 26.887 6.539 ( 1.616 7.141 2.401) 7.705 6.910 ( -1.606 -12.349 18.898) 22.632 7.368 ( -5.147 -0.910 2.378) 5.743 8.063 ( 7.135 8.946 -22.701) 25.422 10.336 ( -3.146 -1.717 9.505) 10.158 10.577 ( 5.649 11.366 -7.636) 14.812 11.193 ( -14.851 11.760 -9.752) 21.307 11.971 ( -8.414 13.326 3.477) 16.139 12.251 ( 1.607 19.165 -5.441) 19.987 13.137 ( 3.376 9.327 6.423) 11.817 14.154 ( 9.283 -5.477 3.459) 11.320 14.424 ( 4.382 2.128 -5.123) 7.069 15.187 ( -5.176 -6.463 2.231) 8.575 15.722 ( -21.370 -20.523 -3.116) 29.792 16.099 ( 1.589 2.407 7.158) 7.718 16.613 ( 3.757 2.523 -8.570) 9.692 20.580 ( -0.876 -0.657 1.348) 1.737 20.812 ( 0.910 -2.201 -0.900) 2.546 21.655 ( 1.250 1.261 -0.749) 1.927 21.906 ( 2.606 -0.469 -0.034) 2.649 24.920 ( -4.816 -0.446 8.005) 9.353 25.189 ( 1.667 2.507 -5.768) 6.507 32.410 ( 1.667 -1.101 -0.491) 2.057 32.570 ( 2.054 -2.740 -0.242) 3.433 42.298 ( 5.307 -3.990 11.617) 13.381 43.607 ( 26.049 7.149 -3.984) 27.305 44.893 ( -3.554 -11.816 -8.438) 14.948 45.928 ( 6.657 -27.327 2.326) 28.223 ======================= Grid point 598 (294/355) ======================= q-point: ( 0.42 0.08 -0.56) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.911 ( 1.411 -7.488 -4.528) 8.864 3.189 ( -1.740 -2.495 0.996) 3.200 3.975 ( 15.198 -8.841 1.315) 17.632 4.441 ( -22.064 10.067 2.080) 24.341 4.542 ( 9.479 -21.173 1.464) 23.244 4.905 ( -1.471 3.155 2.084) 4.057 5.713 ( -6.289 -13.132 25.512) 29.374 6.277 ( -3.685 13.752 2.842) 14.518 6.514 ( 13.691 -16.849 -13.383) 25.504 7.060 ( -7.643 -2.225 7.678) 11.060 7.409 ( -0.898 -6.560 -1.587) 6.809 7.929 ( 9.288 3.876 -21.435) 23.681 10.356 ( 3.467 4.481 1.070) 5.765 10.442 ( -0.626 3.664 2.815) 4.663 10.894 ( -8.317 6.135 -7.055) 12.514 11.720 ( -4.967 10.249 2.039) 11.570 11.993 ( 5.001 13.623 -2.051) 14.656 13.092 ( 5.478 5.120 5.406) 9.244 14.267 ( 3.302 0.483 1.099) 3.513 14.499 ( 8.454 -3.675 -3.465) 9.848 15.195 ( -10.734 -3.234 2.123) 11.410 15.766 ( -18.404 -11.263 -3.149) 21.806 16.149 ( 0.255 -4.176 7.025) 8.177 16.507 ( 3.596 8.002 -9.875) 13.209 20.597 ( -0.253 -1.288 1.144) 1.741 20.851 ( 0.691 -1.858 -0.874) 2.167 21.641 ( 0.668 1.359 -0.340) 1.552 21.933 ( 1.698 -0.024 0.506) 1.772 24.922 ( -4.274 -0.727 8.245) 9.315 25.147 ( 2.252 1.538 -6.491) 7.040 32.450 ( 1.933 -1.347 -0.071) 2.357 32.628 ( 1.309 -2.152 -0.196) 2.527 42.443 ( 3.139 -2.088 10.273) 10.943 43.718 ( 21.354 6.754 -4.876) 22.921 44.975 ( -4.607 -7.354 -4.064) 9.583 46.383 ( 2.777 -19.888 1.229) 20.118 ======================= Grid point 599 (295/355) ======================= q-point: ( 0.50 0.08 -0.56) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.009 ( -0.196 -4.231 1.185) 4.398 3.209 ( 0.011 -1.114 2.137) 2.410 3.896 ( -14.909 10.669 2.051) 18.447 4.396 ( 8.784 -7.583 3.300) 12.064 4.891 ( 4.723 0.379 -0.583) 4.774 5.068 ( 9.432 -23.909 1.666) 25.756 5.777 ( -3.092 17.167 11.528) 20.908 6.130 ( -9.685 -9.081 14.054) 19.333 6.716 ( -1.717 -4.405 -10.642) 11.645 6.964 ( -6.830 3.067 -6.694) 10.043 7.520 ( -1.488 -4.780 10.059) 11.236 7.925 ( 11.601 -1.445 -20.920) 23.965 10.281 ( 3.914 6.930 -1.947) 8.194 10.446 ( -2.940 -1.402 5.751) 6.610 10.760 ( -0.521 0.990 -3.659) 3.826 11.554 ( -2.825 6.104 2.402) 7.142 11.867 ( 7.600 8.522 -0.473) 11.429 13.101 ( 5.436 2.861 1.605) 6.349 14.249 ( -5.962 1.540 1.282) 6.289 14.543 ( -2.009 2.928 -2.844) 4.550 15.168 ( -3.522 -4.379 1.014) 5.711 15.787 ( -11.202 -10.519 1.985) 15.495 16.261 ( -0.987 -4.489 4.423) 6.379 16.389 ( 8.483 5.062 -11.697) 15.310 20.624 ( 0.694 -1.042 0.672) 1.421 20.879 ( 0.951 -0.938 -0.534) 1.439 21.619 ( -0.500 1.276 0.022) 1.371 21.940 ( -0.038 0.686 0.785) 1.044 24.932 ( -4.023 -0.844 8.375) 9.329 25.122 ( 2.756 0.833 -6.756) 7.344 32.484 ( 1.766 -0.378 0.084) 1.808 32.662 ( 0.435 -0.856 -0.041) 0.961 42.523 ( 0.902 -0.095 8.200) 8.250 43.720 ( 10.384 8.848 -9.186) 16.447 45.042 ( 0.076 -3.842 4.453) 5.882 46.650 ( -0.195 -11.032 -3.218) 11.494 ======================= Grid point 600 (296/355) ======================= q-point: (-0.42 0.08 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.034 ( -1.575 2.697 3.768) 4.894 3.260 ( 2.722 -0.623 5.342) 6.028 3.684 ( -12.237 -1.286 4.526) 13.110 4.594 ( 9.464 -3.763 0.729) 10.211 4.943 ( 9.475 2.920 2.223) 10.161 5.375 ( -4.645 19.452 -2.441) 20.147 5.576 ( 10.864 -18.677 0.359) 21.610 6.250 ( -16.670 -5.767 10.574) 20.566 6.608 ( -1.365 6.021 -5.290) 8.130 6.853 ( -9.347 -3.248 0.820) 9.930 7.596 ( -0.983 0.405 10.784) 10.836 7.948 ( 10.092 2.364 -19.715) 22.274 10.197 ( 0.217 4.442 -0.101) 4.448 10.461 ( -2.826 -1.783 2.368) 4.096 10.817 ( 6.784 -4.231 -0.631) 8.020 11.488 ( -2.678 -0.244 3.390) 4.327 11.857 ( 11.112 3.605 0.423) 11.689 13.109 ( 4.733 1.735 -3.635) 6.215 14.091 ( -16.271 3.637 2.572) 16.870 14.356 ( -14.657 6.482 -1.397) 16.087 15.308 ( 7.170 -8.266 0.625) 10.960 15.892 ( -5.134 -8.657 3.496) 10.655 16.289 ( 1.966 -0.273 -2.349) 3.076 16.441 ( 10.714 -2.160 -6.157) 12.545 20.649 ( 1.767 -0.179 0.166) 1.784 20.896 ( 1.204 0.079 -0.201) 1.223 21.593 ( -1.319 0.792 0.557) 1.636 21.914 ( -2.142 1.391 0.657) 2.638 24.947 ( -3.916 -1.037 8.435) 9.358 25.110 ( 3.131 0.470 -6.817) 7.517 32.494 ( 1.477 1.199 0.012) 1.902 32.662 ( -0.502 0.847 0.074) 0.988 42.541 ( -0.582 2.018 6.032) 6.387 43.547 ( -1.803 10.516 -12.158) 16.176 45.142 ( 5.687 0.602 12.328) 13.590 46.717 ( -2.071 -1.784 -9.586) 9.969 ======================= Grid point 601 (297/355) ======================= q-point: (-0.33 0.08 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.932 ( -2.516 9.037 7.823) 12.215 3.281 ( -1.580 1.768 3.758) 4.443 3.667 ( -2.989 1.767 3.759) 5.117 4.713 ( -2.579 3.261 -7.649) 8.706 4.919 ( 5.484 8.831 2.096) 10.604 5.063 ( 9.829 8.511 12.549) 18.070 6.006 ( -3.225 -20.817 -4.608) 21.564 6.053 ( -2.747 6.589 -13.545) 15.311 6.425 ( -3.935 16.745 7.798) 18.886 6.956 ( -6.089 -11.523 18.690) 22.785 7.565 ( -2.955 6.975 4.341) 8.731 7.866 ( 8.080 4.392 -21.116) 23.032 10.163 ( -0.630 -0.560 2.843) 2.965 10.472 ( -2.762 -2.653 -1.930) 4.289 11.000 ( 8.816 -7.592 2.394) 11.878 11.548 ( -2.940 -8.513 3.371) 9.616 11.979 ( 16.056 -1.488 1.978) 16.245 13.109 ( 3.971 0.035 -7.236) 8.254 13.904 ( -18.269 -1.355 4.772) 18.930 14.069 ( -19.675 5.197 -1.455) 20.401 15.521 ( 9.224 -4.510 1.284) 10.347 15.974 ( -1.939 -4.270 1.307) 4.868 16.309 ( 2.090 0.350 -0.576) 2.196 16.572 ( 11.164 -3.079 -6.260) 13.164 20.665 ( 2.591 0.961 -0.131) 2.767 20.892 ( 0.486 1.534 -0.531) 1.694 21.577 ( -0.917 0.003 1.322) 1.609 21.863 ( -3.650 1.347 0.515) 3.924 24.968 ( -3.887 -1.585 8.374) 9.367 25.106 ( 3.461 0.218 -6.730) 7.571 32.476 ( 1.411 2.557 -0.027) 2.921 32.624 ( -1.469 2.421 0.003) 2.832 42.502 ( -0.807 4.269 3.583) 5.631 43.253 ( -10.010 10.186 -11.017) 18.037 45.221 ( 7.480 6.707 17.129) 19.858 46.580 ( -2.872 8.144 -16.508) 18.631 ======================= Grid point 602 (298/355) ======================= q-point: (-0.25 0.08 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.789 ( -2.125 10.074 12.448) 16.154 3.200 ( -4.838 4.967 -0.591) 6.959 3.487 ( -1.212 19.652 4.443) 20.184 4.224 ( -10.709 25.679 -14.490) 31.370 5.110 ( 6.108 7.026 17.514) 19.834 5.174 ( 7.104 -8.612 9.823) 14.870 5.834 ( 5.244 2.278 -12.949) 14.155 6.002 ( -5.756 25.045 7.243) 26.700 6.315 ( -1.826 -7.141 -0.474) 7.386 7.150 ( -8.322 -2.952 3.512) 9.503 7.361 ( -2.356 3.506 5.337) 6.806 7.868 ( 9.254 -4.799 -17.722) 20.560 10.230 ( -1.492 -5.470 6.029) 8.276 10.479 ( -1.127 -2.879 -5.787) 6.561 11.286 ( 9.602 -14.151 6.215) 18.196 11.737 ( -3.551 -16.371 0.997) 16.781 12.240 ( 20.260 -5.791 4.700) 21.589 13.138 ( 1.466 -4.651 -7.974) 9.347 13.784 ( -15.453 0.970 2.019) 15.615 13.868 ( -17.580 -7.670 2.121) 19.297 15.602 ( 8.623 6.149 1.050) 10.643 16.007 ( -3.734 -1.614 -2.173) 4.612 16.312 ( 5.239 3.791 3.375) 7.295 16.660 ( 5.603 0.436 -7.313) 9.223 20.668 ( 2.987 1.783 -0.073) 3.480 20.841 ( -1.695 3.245 -1.277) 3.877 21.595 ( 1.370 -1.089 2.118) 2.747 21.809 ( -4.083 0.506 0.220) 4.120 25.000 ( -4.059 -2.593 7.999) 9.337 25.111 ( 3.863 -0.201 -6.430) 7.504 32.443 ( 1.626 3.024 0.147) 3.436 32.556 ( -2.214 3.238 -0.248) 3.931 42.424 ( 1.469 6.167 1.033) 6.423 42.937 ( -14.401 7.367 -6.664) 17.495 45.202 ( 5.870 14.031 19.353) 24.615 46.236 ( -2.526 18.939 -22.243) 29.322 ======================= Grid point 603 (299/355) ======================= q-point: (-0.17 0.08 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.684 ( -0.484 8.450 16.285) 18.354 3.025 ( -3.969 8.925 -4.248) 10.651 3.067 ( -6.153 28.942 12.999) 32.318 3.644 ( -5.721 22.473 -21.484) 31.612 4.850 ( 12.612 38.704 13.737) 42.963 5.383 ( 0.915 -2.540 16.925) 17.139 5.481 ( -12.299 28.360 2.440) 31.008 6.002 ( -3.629 -9.234 -10.706) 14.597 6.291 ( 4.862 0.320 7.950) 9.325 6.961 ( -2.916 0.329 -20.537) 20.745 7.573 ( -5.407 -14.525 20.251) 25.501 8.010 ( 11.209 -8.989 -18.912) 23.751 10.331 ( -4.748 -5.266 8.711) 11.232 10.508 ( 3.450 -3.650 -9.026) 10.329 11.742 ( 9.037 -24.920 8.819) 27.936 12.029 ( -3.256 -22.983 -2.034) 23.302 12.601 ( 20.259 -9.069 7.893) 23.558 13.194 ( -8.711 -9.325 -8.884) 15.549 13.712 ( 1.342 -3.256 0.741) 3.599 13.891 ( -16.626 -11.575 3.467) 20.553 15.536 ( 11.015 12.666 1.242) 16.831 15.872 ( -10.988 7.469 -5.124) 14.240 16.310 ( 5.119 7.092 6.641) 10.982 16.570 ( 1.364 10.087 -8.361) 13.172 20.668 ( 2.811 1.612 0.273) 3.252 20.754 ( -2.988 3.044 -1.216) 4.436 21.653 ( 3.208 -1.446 2.204) 4.152 21.770 ( -3.385 -0.378 -0.665) 3.470 25.044 ( -4.900 -3.596 7.075) 9.327 25.133 ( 4.486 -0.890 -5.825) 7.405 32.415 ( 1.847 2.415 0.466) 3.076 32.478 ( -2.324 2.879 -0.542) 3.740 42.368 ( 7.801 5.005 0.372) 9.276 42.672 ( -16.303 3.405 -2.415) 16.829 45.039 ( 2.790 21.066 18.843) 28.401 45.707 ( -0.685 28.873 -24.173) 37.663 ======================= Grid point 604 (300/355) ======================= q-point: (-0.08 0.08 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.601 ( -3.457 21.718 13.806) 25.966 2.665 ( 5.347 11.502 24.891) 27.937 2.809 ( 1.883 11.288 -7.245) 13.544 3.183 ( -3.205 14.054 -24.837) 28.717 4.385 ( 24.214 44.111 19.854) 54.095 4.725 ( -22.753 35.045 -12.962) 43.748 5.449 ( -9.287 1.492 24.411) 26.160 5.899 ( 3.319 1.003 -19.115) 19.427 6.610 ( 4.012 -13.623 13.815) 19.813 6.904 ( -2.932 -5.697 -15.135) 16.436 7.810 ( -12.737 -12.737 17.224) 24.922 8.203 ( 14.655 -9.168 -20.015) 26.446 10.379 ( -7.510 -2.800 9.782) 12.646 10.583 ( 7.607 -3.694 -10.680) 13.622 12.314 ( -3.283 -30.624 8.331) 31.906 12.438 ( 4.001 -29.070 -3.963) 29.610 12.993 ( 13.569 -11.250 9.931) 20.231 13.191 ( -12.843 -10.379 -9.145) 18.876 13.895 ( -18.833 -8.756 2.455) 20.914 13.928 ( 19.156 -5.437 -0.835) 19.930 15.459 ( 15.974 11.735 1.511) 19.878 15.506 ( -19.133 14.364 -3.424) 24.169 16.152 ( -8.652 16.458 8.149) 20.301 16.339 ( 12.155 17.051 -10.424) 23.391 20.672 ( -0.723 0.411 0.967) 1.275 20.692 ( 0.346 1.032 -1.072) 1.528 21.712 ( 2.260 -0.826 1.872) 3.048 21.749 ( -1.285 -0.540 -1.775) 2.257 25.077 ( -6.666 -3.381 5.660) 9.376 25.179 ( 5.164 -1.629 -4.583) 7.094 32.404 ( 1.415 1.424 0.702) 2.126 32.419 ( -1.236 1.464 -0.762) 2.062 42.410 ( -13.287 -1.486 5.642) 14.512 42.524 ( 14.772 0.407 -5.645) 15.819 44.746 ( 0.609 23.824 14.244) 27.764 45.082 ( 2.888 33.224 -19.722) 38.744 ======================= Grid point 607 (301/355) ======================= q-point: ( 0.17 0.17 -0.56) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 355 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.191 ( 11.554 0.000 -11.457) 16.271 2.303 ( 2.743 0.000 -28.926) 29.055 3.223 ( 15.313 0.000 8.606) 17.566 3.663 ( 31.609 0.000 -6.117) 32.195 3.909 ( 25.019 0.000 11.030) 27.342 4.926 ( 6.809 0.000 9.954) 12.060 5.595 ( 9.274 0.000 26.353) 27.937 5.978 ( 12.589 0.000 -25.004) 27.994 6.016 ( -24.271 -0.000 4.967) 24.774 7.068 ( -6.528 -0.000 2.295) 6.919 7.428 ( -23.442 -0.000 19.047) 30.204 8.433 ( 4.137 0.000 -21.980) 22.366 10.283 ( -6.859 -0.000 10.395) 12.454 10.842 ( 9.549 0.000 -12.035) 15.363 12.060 ( -24.926 -0.000 -6.575) 25.779 12.644 ( -25.254 -0.000 6.597) 26.101 13.242 ( -4.371 -0.000 0.965) 4.476 13.419 ( -4.078 -0.000 -2.300) 4.682 14.035 ( 14.360 0.000 -0.911) 14.388 14.420 ( -15.300 -0.000 -5.004) 16.097 14.870 ( -14.635 -0.000 -0.333) 14.639 15.020 ( 11.503 0.000 13.094) 17.429 15.996 ( 10.433 0.000 2.336) 10.691 16.363 ( 14.956 0.000 -17.338) 22.897 20.613 ( -0.321 -0.000 0.411) 0.521 20.762 ( 1.442 0.000 -1.044) 1.780 21.681 ( -0.173 -0.000 -0.396) 0.432 21.853 ( 2.508 0.000 0.435) 2.545 24.935 ( -6.413 -0.000 7.168) 9.618 25.310 ( 0.044 0.000 -2.425) 2.425 32.422 ( 0.292 0.000 -0.293) 0.413 32.440 ( 2.978 0.000 -0.502) 3.020 42.030 ( 8.433 0.000 11.943) 14.620 43.908 ( 32.644 0.000 -21.778) 39.241 44.264 ( 5.134 0.000 -2.301) 5.626 44.674 ( 11.762 0.000 1.615) 11.872 ======================= Grid point 608 (302/355) ======================= q-point: ( 0.25 0.17 -0.56) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.317 ( 3.150 -12.851 -20.938) 24.768 2.471 ( 15.143 -16.296 -6.814) 23.266 3.406 ( 14.637 -0.354 8.079) 16.723 3.961 ( 26.978 5.291 1.531) 27.534 4.291 ( 31.154 -14.811 4.033) 34.731 5.030 ( -12.169 -6.945 17.773) 22.632 5.482 ( -22.102 8.736 -4.276) 24.147 5.970 ( 8.670 1.995 -21.292) 23.076 6.216 ( 21.325 -12.949 19.754) 31.822 6.935 ( -10.004 6.339 6.978) 13.746 7.333 ( -15.655 -2.716 14.775) 21.697 8.320 ( 3.283 4.774 -23.939) 24.630 10.275 ( -5.891 -1.129 10.728) 12.291 10.850 ( 8.983 3.613 -12.001) 15.419 11.667 ( -22.266 12.582 -9.614) 27.322 12.376 ( -21.842 7.293 6.198) 23.847 12.948 ( -3.781 20.872 -4.059) 21.597 13.432 ( 0.636 -0.548 1.333) 1.576 14.002 ( 2.464 5.600 0.981) 6.196 14.398 ( -3.146 -6.680 -6.596) 9.900 14.898 ( -13.127 -16.981 0.794) 21.478 15.168 ( -0.037 -1.394 6.384) 6.534 16.119 ( 7.927 -0.641 8.027) 11.299 16.487 ( 9.950 -7.075 -14.924) 19.281 20.603 ( 0.292 1.448 0.853) 1.705 20.772 ( 1.474 -0.268 -1.555) 2.159 21.681 ( 0.445 0.212 -0.076) 0.499 21.883 ( 2.336 -0.629 0.073) 2.421 24.910 ( -5.421 -0.117 7.694) 9.413 25.274 ( -0.628 1.876 -3.927) 4.397 32.411 ( 1.231 0.941 -0.726) 1.711 32.489 ( 2.777 -1.848 -0.388) 3.358 42.229 ( 13.981 -0.363 18.395) 23.108 43.943 ( 25.932 12.633 -12.789) 31.553 44.470 ( 7.652 -12.098 -8.856) 16.832 44.996 ( 10.545 -21.928 0.664) 24.341 ======================= Grid point 609 (303/355) ======================= q-point: ( 0.33 0.17 -0.56) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.520 ( 3.451 -15.245 -11.982) 19.695 2.897 ( 13.816 -16.748 -1.197) 21.744 3.600 ( 11.056 -4.215 3.878) 12.451 4.138 ( 24.133 1.717 2.392) 24.312 4.863 ( 13.361 -12.118 6.023) 19.017 4.944 ( -29.824 6.808 10.479) 32.337 5.250 ( -2.997 -6.550 13.724) 15.499 5.955 ( 14.717 -3.125 -22.697) 27.231 6.615 ( 5.027 -2.331 4.782) 7.319 6.828 ( -6.343 -3.260 14.766) 16.398 7.327 ( -3.364 -1.481 7.030) 7.933 8.141 ( 4.057 6.799 -25.172) 26.388 10.307 ( -4.307 -2.645 11.078) 12.177 10.784 ( 8.367 8.674 -10.541) 16.011 11.192 ( -16.218 12.799 -10.908) 23.363 12.062 ( -16.405 9.578 5.731) 19.842 12.577 ( 1.469 18.906 -3.977) 19.376 13.394 ( 6.473 9.667 3.489) 12.146 14.076 ( 0.381 -10.951 2.638) 11.271 14.418 ( -0.418 -0.394 -3.764) 3.807 15.082 ( -17.120 -22.220 -3.127) 28.224 15.145 ( -6.033 0.458 0.098) 6.051 16.196 ( 2.362 2.611 8.269) 8.987 16.607 ( 5.230 -3.634 -10.123) 11.960 20.587 ( 0.440 1.170 1.239) 1.760 20.792 ( 1.754 -1.154 -1.703) 2.703 21.680 ( 0.791 0.727 0.251) 1.103 21.920 ( 2.079 -0.889 0.164) 2.267 24.902 ( -4.580 -0.447 8.066) 9.286 25.213 ( 0.099 2.179 -5.495) 5.912 32.419 ( 2.339 -0.170 -0.442) 2.386 32.548 ( 2.398 -2.239 -0.368) 3.301 42.439 ( 12.305 2.082 19.096) 22.813 43.978 ( 26.062 8.643 -9.165) 28.947 44.665 ( 2.595 -9.843 -7.830) 12.842 45.525 ( 6.139 -28.303 2.030) 29.032 ======================= Grid point 610 (304/355) ======================= q-point: ( 0.42 0.17 -0.56) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.756 ( 5.097 -11.380 -3.524) 12.958 3.189 ( 7.377 -3.097 4.218) 9.044 3.851 ( 8.392 -14.733 -3.367) 17.287 4.385 ( 0.350 -1.046 4.139) 4.283 4.536 ( -3.414 7.594 3.236) 8.933 5.001 ( 4.153 3.420 7.718) 9.408 5.505 ( -9.037 -14.535 23.517) 29.086 6.206 ( 4.928 -15.055 -7.841) 17.675 6.528 ( 5.981 8.436 -10.726) 14.899 6.960 ( -7.366 -6.336 14.063) 17.093 7.348 ( 1.921 -0.576 -1.128) 2.301 7.970 ( 5.481 4.832 -25.063) 26.106 10.370 ( -2.631 -2.740 10.193) 10.878 10.640 ( 7.731 12.266 -6.877) 16.047 10.873 ( -8.337 5.619 -7.891) 12.781 11.794 ( -12.930 7.827 4.592) 15.797 12.323 ( 8.835 15.958 -1.660) 18.316 13.318 ( 8.673 9.911 4.070) 13.785 14.282 ( -0.365 -4.768 3.581) 5.974 14.413 ( 0.014 -6.593 -4.974) 8.258 15.067 ( -9.337 -0.591 0.340) 9.362 15.246 ( -19.203 -21.564 -6.145) 29.522 16.186 ( -0.162 2.790 8.072) 8.542 16.600 ( 3.636 3.724 -10.357) 11.591 20.590 ( 0.734 -0.209 1.252) 1.466 20.827 ( 1.716 -1.708 -1.502) 2.850 21.671 ( 0.573 1.432 0.676) 1.684 21.950 ( 1.260 -0.366 0.663) 1.470 24.906 ( -4.067 -0.695 8.296) 9.265 25.161 ( 1.216 1.501 -6.369) 6.656 32.457 ( 2.994 -0.933 0.153) 3.140 32.605 ( 1.691 -2.170 -0.284) 2.765 42.573 ( 8.346 3.753 16.436) 18.812 44.035 ( 21.784 9.152 -13.081) 27.007 44.811 ( 1.374 -8.733 0.142) 8.842 46.026 ( 0.866 -25.062 2.098) 25.164 ======================= Grid point 611 (305/355) ======================= q-point: ( 0.50 0.17 -0.56) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.947 ( 4.192 -5.783 2.690) 7.632 3.260 ( 5.436 2.110 6.843) 8.990 3.934 ( -16.874 9.124 3.093) 19.430 4.308 ( 7.906 -11.880 -0.589) 14.283 4.792 ( 12.004 -11.214 -1.085) 16.463 5.047 ( 6.536 0.236 5.158) 8.329 5.771 ( -11.913 -15.690 26.976) 33.403 6.207 ( 1.917 12.192 -2.493) 12.591 6.484 ( -5.973 -6.051 -11.003) 13.905 6.927 ( -7.982 3.749 -2.819) 9.259 7.468 ( 3.146 -7.380 7.178) 10.765 7.886 ( 7.987 -1.558 -25.270) 26.548 10.425 ( -2.235 -1.431 8.129) 8.552 10.486 ( 6.689 11.915 -4.528) 14.395 10.753 ( -0.360 0.379 -2.890) 2.937 11.584 ( -11.300 4.952 3.453) 12.811 12.195 ( 15.563 13.862 0.314) 20.844 13.268 ( 7.749 7.938 1.660) 11.217 14.221 ( -9.558 3.626 2.293) 10.477 14.523 ( -1.837 -1.818 -5.946) 6.484 15.023 ( -7.145 -6.657 1.678) 9.909 15.396 ( -13.766 -19.897 -2.975) 24.377 16.211 ( -1.566 -2.430 8.206) 8.700 16.501 ( 6.362 5.905 -13.568) 16.107 20.619 ( 1.525 -1.132 1.094) 2.192 20.864 ( 1.231 -1.608 -1.192) 2.350 21.650 ( 0.394 2.146 1.128) 2.456 21.957 ( -0.405 0.714 0.912) 1.227 24.918 ( -3.843 -0.777 8.450) 9.316 25.129 ( 2.116 0.746 -6.735) 7.099 32.503 ( 2.973 -0.561 0.513) 3.069 32.648 ( 0.824 -1.480 -0.130) 1.699 42.638 ( 4.924 4.539 13.933) 15.459 43.943 ( 10.126 12.236 -18.804) 24.614 45.013 ( 6.984 -7.514 9.678) 14.103 46.377 ( -3.219 -17.841 -1.502) 18.192 ======================= Grid point 612 (306/355) ======================= q-point: ( 0.58 0.17 -0.56) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.064 ( 3.174 -1.370 5.874) 6.816 3.334 ( 6.236 0.794 8.330) 10.436 3.648 ( -10.677 6.645 7.014) 14.400 4.583 ( 7.486 -7.665 -0.066) 10.715 5.029 ( 6.425 -7.253 -7.536) 12.275 5.161 ( -0.312 -8.697 1.759) 8.879 5.922 ( -5.294 14.236 -1.888) 15.305 6.003 ( -2.445 -2.714 18.667) 19.021 6.510 ( -7.849 -10.773 -2.293) 13.525 6.779 ( -1.421 3.199 -2.660) 4.397 7.585 ( -4.051 -3.189 6.555) 8.339 7.928 ( 7.622 -3.978 -21.685) 23.327 10.334 ( 3.974 9.862 -2.615) 10.949 10.440 ( -2.700 0.625 5.371) 6.044 10.817 ( 6.875 -3.893 0.294) 7.907 11.441 ( -10.138 0.739 2.764) 10.534 12.169 ( 20.707 11.404 1.656) 23.698 13.215 ( 5.733 6.158 -2.784) 8.862 14.012 ( -17.622 6.009 2.997) 18.858 14.334 ( -13.540 9.154 -3.928) 16.809 15.197 ( 4.525 -12.699 0.709) 13.499 15.612 ( -7.659 -18.088 0.990) 19.667 16.278 ( -2.379 -2.801 5.823) 6.886 16.457 ( 9.331 -0.130 -14.267) 17.048 20.663 ( 2.633 -0.974 0.891) 2.946 20.892 ( 0.391 -1.190 -0.989) 1.596 21.623 ( 0.856 2.422 1.681) 3.070 21.924 ( -2.536 1.850 0.662) 3.209 24.932 ( -3.803 -0.791 8.564) 9.404 25.114 ( 2.719 0.273 -6.888) 7.410 32.533 ( 2.643 0.675 0.555) 2.784 32.665 ( -0.182 -0.110 -0.056) 0.220 42.651 ( 2.375 5.357 12.096) 13.440 43.678 ( 0.377 14.121 -19.910) 24.413 45.262 ( 10.710 -3.878 15.336) 19.104 46.542 ( -5.318 -9.591 -7.786) 13.449 ======================= Grid point 613 (307/355) ======================= q-point: (-0.33 0.17 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.087 ( 1.954 5.580 7.336) 9.422 3.338 ( -1.464 4.696 4.714) 6.813 3.674 ( 5.280 -4.924 11.039) 13.191 4.667 ( -2.075 -0.066 -5.721) 6.086 5.048 ( -1.577 2.573 -8.523) 9.042 5.324 ( 7.022 -0.175 9.266) 11.627 5.674 ( -9.426 -2.766 -3.901) 10.570 6.024 ( -6.526 -0.259 -1.081) 6.620 6.624 ( 8.859 1.313 5.951) 10.753 6.827 ( -1.489 -6.651 13.212) 14.866 7.585 ( -7.096 -0.694 3.177) 7.805 7.897 ( 3.952 2.490 -22.300) 22.784 10.228 ( 2.932 5.975 0.454) 6.672 10.410 ( -4.048 0.373 1.330) 4.277 10.988 ( 8.933 -5.792 1.984) 10.830 11.395 ( -7.884 -5.004 1.847) 9.519 12.252 ( 24.515 6.709 3.068) 25.601 13.145 ( 1.316 4.230 -6.409) 7.791 13.753 ( -17.901 3.714 4.830) 18.910 13.997 ( -16.680 9.412 -3.096) 19.401 15.478 ( 7.835 -11.185 2.184) 13.830 15.812 ( -4.894 -12.038 0.502) 13.004 16.319 ( 1.419 -1.697 1.392) 2.614 16.539 ( 5.553 -5.469 -9.725) 12.463 20.706 ( 3.520 0.102 0.770) 3.605 20.896 ( -1.157 -0.109 -1.239) 1.699 21.609 ( 2.353 1.932 2.228) 3.773 21.856 ( -4.240 2.170 0.210) 4.767 24.947 ( -3.885 -0.928 8.622) 9.502 25.109 ( 3.144 0.003 -6.940) 7.619 32.537 ( 2.440 2.109 0.482) 3.261 32.645 ( -1.284 1.615 -0.200) 2.073 42.620 ( 0.735 6.293 10.550) 12.307 43.325 ( -4.782 14.315 -17.824) 23.356 45.469 ( 10.285 1.852 19.263) 21.915 46.523 ( -5.169 -0.931 -15.512) 16.377 ======================= Grid point 614 (308/355) ======================= q-point: (-0.25 0.17 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.005 ( 0.779 9.718 11.111) 14.782 3.256 ( -0.911 5.247 -0.993) 5.417 3.784 ( 7.176 8.703 7.803) 13.716 4.379 ( -15.150 16.393 -14.576) 26.659 5.104 ( 6.355 -8.870 12.259) 16.412 5.391 ( 8.854 5.852 14.617) 18.064 5.709 ( -11.768 -11.078 -10.261) 19.144 5.955 ( -4.326 -2.659 -13.135) 14.083 6.642 ( 14.162 16.353 14.109) 25.827 6.992 ( -9.713 -7.260 16.268) 20.290 7.465 ( -5.130 7.364 -0.713) 9.003 7.800 ( 6.356 -0.860 -24.354) 25.185 10.208 ( 1.814 0.312 3.920) 4.330 10.378 ( -4.080 -2.472 -2.720) 5.491 11.209 ( 9.069 -8.909 3.915) 13.302 11.462 ( -6.314 -10.737 -0.530) 12.467 12.460 ( 25.687 0.917 4.582) 26.109 13.033 ( -9.500 0.362 -7.107) 11.870 13.616 ( -12.577 -1.848 6.297) 14.187 13.722 ( -8.502 4.060 -3.904) 10.199 15.698 ( 6.176 -4.188 3.365) 8.185 15.910 ( -3.957 -5.200 -2.350) 6.944 16.386 ( 3.902 -1.595 3.162) 5.270 16.617 ( 0.442 -4.411 -8.392) 9.490 20.734 ( 3.688 1.512 0.960) 4.100 20.852 ( -3.233 1.879 -1.751) 4.129 21.633 ( 4.569 0.650 2.400) 5.201 21.779 ( -4.725 1.274 -0.436) 4.914 24.965 ( -4.156 -1.316 8.530) 9.579 25.113 ( 3.543 -0.341 -6.846) 7.716 32.519 ( 2.476 3.141 0.468) 4.027 32.586 ( -2.149 3.002 -0.509) 3.727 42.559 ( -0.053 6.653 9.488) 11.588 42.967 ( -5.391 12.766 -14.368) 19.962 45.560 ( 6.236 9.156 22.659) 25.222 46.332 ( -2.293 8.421 -23.366) 24.943 ======================= Grid point 615 (309/355) ======================= q-point: (-0.17 0.17 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.909 ( 1.346 9.508 13.879) 16.877 3.115 ( -1.297 8.340 -6.434) 10.612 3.570 ( 0.787 25.339 12.333) 28.192 3.877 ( -2.585 20.825 -17.884) 27.571 5.361 ( -1.423 1.979 20.051) 20.198 5.481 ( 10.593 1.109 15.369) 18.699 5.712 ( -3.165 -3.774 -11.998) 12.969 5.796 ( -11.532 4.980 -12.655) 17.831 6.525 ( 10.652 18.537 18.208) 28.083 6.854 ( -13.976 6.203 -11.350) 19.043 7.442 ( -1.722 -4.885 14.638) 15.527 7.861 ( 9.730 -9.379 -23.489) 27.100 10.268 ( -1.157 -2.837 7.235) 7.857 10.406 ( 0.032 -5.986 -6.172) 8.598 11.521 ( 7.907 -15.533 5.900) 18.401 11.621 ( -6.112 -17.475 -3.708) 18.880 12.737 ( 16.389 -3.348 7.014) 18.139 12.902 ( -14.697 -5.375 -9.051) 18.078 13.594 ( -7.881 -5.725 7.246) 12.140 13.715 ( 7.490 -4.496 -4.732) 9.935 15.770 ( 4.714 3.783 4.180) 7.349 15.859 ( -6.765 3.701 -4.199) 8.781 16.455 ( 3.471 1.814 5.960) 7.131 16.602 ( -2.596 -0.099 -8.528) 8.915 20.733 ( 0.326 2.530 1.705) 3.068 20.770 ( -1.126 2.947 -1.985) 3.727 21.687 ( 2.740 -0.242 2.220) 3.535 21.728 ( -1.082 -0.224 -1.849) 2.154 24.985 ( -4.813 -1.804 8.102) 9.595 25.131 ( 3.982 -1.034 -6.421) 7.626 32.490 ( 2.041 3.363 0.612) 3.981 32.506 ( -1.755 3.376 -0.884) 3.906 42.483 ( -5.483 5.598 9.717) 12.483 42.697 ( 4.043 9.233 -11.526) 15.312 45.478 ( -0.939 16.932 23.547) 29.018 45.994 ( 4.099 18.404 -27.949) 33.715 ======================= Grid point 616 (310/355) ======================= q-point: (-0.08 0.17 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.842 ( 0.728 7.554 12.238) 14.400 2.918 ( 0.808 10.249 -2.580) 10.600 3.208 ( 3.058 22.208 10.033) 24.561 3.460 ( 11.053 26.118 -16.913) 33.021 5.084 ( -16.881 35.912 -7.966) 40.474 5.272 ( 4.625 17.965 14.610) 23.613 5.625 ( 6.718 15.267 14.595) 22.164 5.788 ( -0.198 -6.790 -7.800) 10.343 6.542 ( 1.302 -2.971 14.380) 14.742 6.647 ( -7.423 -5.203 -16.890) 19.169 7.584 ( -10.676 -8.592 17.254) 22.034 8.060 ( 12.760 -12.308 -21.978) 28.237 10.320 ( -4.480 -2.037 9.058) 10.308 10.511 ( 4.924 -7.067 -8.607) 12.177 11.858 ( -7.641 -22.675 -0.098) 23.928 11.971 ( 4.223 -25.299 1.077) 25.672 12.772 ( -18.597 -10.489 -7.421) 22.604 13.034 ( 8.248 -8.038 5.775) 12.883 13.680 ( -1.234 -4.612 3.242) 5.771 13.961 ( 18.312 -11.031 -2.914) 21.575 15.562 ( -14.789 13.966 -1.372) 20.388 15.775 ( 8.808 7.686 3.887) 12.319 16.351 ( -7.926 11.959 4.585) 15.062 16.549 ( 5.862 3.848 -7.705) 10.419 20.665 ( -4.010 1.851 0.582) 4.455 20.742 ( 3.182 2.478 -0.087) 4.034 21.687 ( -2.612 -1.391 -0.804) 3.067 21.765 ( 5.084 0.036 -0.530) 5.111 24.999 ( -5.885 -1.890 7.300) 9.566 25.171 ( 4.220 -2.077 -5.404) 7.164 32.429 ( -1.699 2.379 -0.741) 3.016 32.468 ( 2.727 2.887 0.350) 3.987 42.313 ( -13.290 5.835 4.856) 15.305 42.706 ( 20.279 0.613 -4.828) 20.854 45.191 ( -6.782 22.550 14.489) 27.648 45.569 ( 11.410 27.463 -21.040) 36.429 ======================= Grid point 620 (311/355) ======================= q-point: ( 0.25 0.25 -0.56) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 354 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.230 ( 10.708 0.000 -11.846) 15.968 2.490 ( 24.243 0.000 -4.510) 24.659 3.566 ( 10.670 0.000 6.425) 12.455 4.246 ( 26.780 0.000 -5.264) 27.292 4.540 ( 29.650 0.000 6.650) 30.387 4.895 ( -19.985 -0.000 20.278) 28.471 5.316 ( -21.054 -0.000 0.954) 21.075 6.007 ( 15.689 0.000 -25.806) 30.201 6.436 ( 19.568 0.000 24.172) 31.100 6.909 ( -11.573 -0.000 1.343) 11.651 7.230 ( -9.348 -0.000 15.676) 18.252 8.272 ( 2.182 0.000 -25.593) 25.686 10.255 ( -5.849 -0.000 10.853) 12.329 10.909 ( 8.717 0.000 -12.975) 15.632 11.523 ( -19.761 -0.000 -11.021) 22.626 12.237 ( -22.682 -0.000 8.544) 24.238 13.201 ( -0.384 -0.000 0.083) 0.393 13.226 ( -10.541 -0.000 -3.728) 11.181 14.128 ( -2.670 -0.000 -9.218) 9.596 14.168 ( -4.656 -0.000 -7.584) 8.900 14.674 ( -4.996 -0.000 6.283) 8.027 15.238 ( -0.237 -0.000 10.404) 10.407 16.231 ( 6.535 0.000 9.034) 11.150 16.440 ( 8.550 0.000 -15.340) 17.562 20.631 ( 1.483 0.000 0.801) 1.686 20.776 ( 1.523 0.000 -2.075) 2.574 21.690 ( 0.716 0.000 0.851) 1.112 21.896 ( 1.731 0.000 -0.506) 1.803 24.894 ( -4.758 -0.000 7.946) 9.261 25.258 ( -1.563 -0.000 -4.631) 4.888 32.427 ( 1.094 0.000 -0.806) 1.359 32.503 ( 3.423 0.000 -0.364) 3.443 42.510 ( 17.869 0.000 27.677) 32.944 44.258 ( 24.278 0.000 -24.758) 34.675 44.396 ( 8.890 0.000 0.016) 8.890 44.906 ( 10.432 0.000 -0.165) 10.433 ======================= Grid point 621 (312/355) ======================= q-point: ( 0.33 0.25 -0.56) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.380 ( 14.380 -6.759 -3.962) 16.376 2.838 ( 23.346 -11.185 -0.404) 25.890 3.679 ( 6.980 -0.225 2.917) 7.569 4.400 ( 16.133 4.045 -4.907) 17.341 4.768 ( -25.350 -1.002 16.028) 30.008 4.921 ( 23.471 -6.316 7.184) 25.345 5.188 ( -8.485 -1.816 13.681) 16.201 6.029 ( 15.503 3.588 -19.639) 25.277 6.666 ( 2.508 0.273 8.890) 9.241 6.769 ( -9.853 -0.482 7.381) 12.321 7.328 ( 6.775 -3.534 8.356) 11.323 8.140 ( 2.229 3.603 -26.450) 26.787 10.269 ( -4.964 -2.286 11.408) 12.650 10.907 ( 7.194 2.873 -12.921) 15.065 11.199 ( -12.803 10.736 -11.160) 20.093 12.021 ( -20.435 4.214 7.935) 22.323 12.858 ( -1.665 16.564 -2.353) 16.813 13.432 ( -1.544 -11.906 0.981) 12.045 13.959 ( -1.440 1.010 -7.023) 7.240 14.263 ( -9.042 -13.538 -7.783) 18.045 14.684 ( -5.054 -1.807 5.003) 7.338 15.200 ( -3.765 5.618 4.219) 7.971 16.304 ( 2.315 2.290 9.199) 9.759 16.517 ( 5.316 -6.520 -10.954) 13.812 20.633 ( 1.721 2.016 1.091) 2.867 20.788 ( 2.049 -0.630 -2.323) 3.161 21.701 ( 0.897 0.358 1.313) 1.630 21.917 ( 1.293 -1.090 -0.679) 1.822 24.889 ( -4.116 -0.275 8.167) 9.150 25.210 ( -0.940 1.064 -5.698) 5.873 32.439 ( 2.243 -0.107 -0.458) 2.292 32.544 ( 2.861 -1.128 -0.346) 3.095 42.765 ( 14.819 5.823 29.111) 33.181 44.294 ( 22.405 6.290 -17.532) 29.136 44.557 ( 7.656 -5.599 -4.114) 10.338 45.180 ( 7.292 -19.596 0.102) 20.909 ======================= Grid point 622 (313/355) ======================= q-point: ( 0.42 0.25 -0.56) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.664 ( 14.302 -9.228 1.262) 17.067 3.243 ( 18.671 -8.361 4.981) 21.055 3.742 ( 2.528 -3.043 -2.910) 4.911 4.418 ( -5.611 4.250 6.161) 9.354 4.625 ( 1.297 0.910 2.788) 3.206 5.170 ( 10.976 3.064 7.610) 13.703 5.301 ( -10.305 -9.939 22.705) 26.842 6.021 ( -3.603 -3.019 -7.790) 9.098 6.653 ( 13.949 2.263 -15.992) 21.341 6.851 ( -5.570 -6.772 17.686) 19.740 7.414 ( 5.015 4.253 0.757) 6.619 7.970 ( 2.363 4.569 -26.387) 26.883 10.334 ( -3.601 -3.790 11.796) 12.902 10.818 ( -2.067 4.310 -11.893) 12.818 10.911 ( 4.432 11.297 -7.039) 14.029 11.778 ( -17.524 5.686 6.391) 19.500 12.636 ( 6.619 12.247 -0.202) 13.922 13.535 ( 3.760 2.014 1.442) 4.502 14.050 ( -0.389 -14.946 -4.610) 15.646 14.328 ( -9.238 -6.714 -2.939) 11.792 14.691 ( -11.595 -9.627 -0.195) 15.072 15.063 ( -5.714 4.766 -1.259) 7.547 16.287 ( -0.911 4.756 8.537) 9.815 16.596 ( 2.764 -2.508 -9.341) 10.059 20.622 ( 1.798 1.709 1.356) 2.827 20.814 ( 2.138 -1.141 -2.249) 3.306 21.706 ( 0.959 1.016 1.748) 2.237 21.946 ( 0.456 -1.259 -0.359) 1.387 24.895 ( -3.688 -0.526 8.334) 9.128 25.160 ( 0.351 1.025 -6.422) 6.513 32.474 ( 3.130 -0.850 0.192) 3.249 32.590 ( 1.973 -1.570 -0.317) 2.541 42.878 ( 10.298 9.546 24.180) 27.961 44.301 ( 17.402 8.140 -22.890) 29.883 44.732 ( 7.849 -7.486 6.060) 12.425 45.616 ( 1.494 -24.846 0.937) 24.909 ======================= Grid point 623 (314/355) ======================= q-point: ( 0.50 0.25 -0.56) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.943 ( 11.886 -6.026 4.402) 14.034 3.450 ( 11.957 5.102 10.141) 16.487 3.822 ( -8.078 -5.938 -1.826) 10.191 4.306 ( 4.539 2.625 5.589) 7.664 4.784 ( 12.199 -6.648 0.057) 13.893 5.130 ( -3.848 5.861 3.338) 7.765 5.505 ( -12.077 -13.077 23.062) 29.133 6.027 ( -12.383 -12.873 -4.055) 18.316 6.648 ( 16.371 11.209 -12.872) 23.650 6.913 ( -6.833 3.695 8.545) 11.548 7.422 ( 3.643 -3.587 2.088) 5.523 7.817 ( 3.398 1.102 -27.049) 27.284 10.410 ( -3.004 -2.584 10.507) 11.230 10.690 ( 0.314 4.322 -8.876) 9.877 10.798 ( 9.165 7.872 -2.146) 12.270 11.548 ( -15.359 4.917 4.126) 16.646 12.563 ( 14.449 10.310 1.915) 17.853 13.487 ( 4.236 7.897 -0.652) 8.985 14.202 ( -8.849 2.100 2.534) 9.442 14.355 ( -0.222 -12.573 -6.654) 14.227 14.802 ( -13.175 -14.963 0.769) 19.952 14.959 ( -7.073 -6.267 -4.693) 10.552 16.238 ( -3.065 3.021 10.209) 11.079 16.570 ( 4.249 2.847 -12.740) 13.728 20.634 ( 2.260 0.025 1.675) 2.813 20.843 ( 1.138 -1.368 -2.107) 2.758 21.702 ( 1.446 1.858 2.196) 3.220 21.956 ( -1.053 -0.214 -0.166) 1.087 24.908 ( -3.502 -0.640 8.470) 9.188 25.127 ( 1.505 0.515 -6.772) 6.957 32.525 ( 3.243 -0.935 0.665) 3.440 32.630 ( 1.001 -1.549 -0.238) 1.859 42.899 ( 6.867 9.813 20.094) 23.393 44.136 ( 7.111 12.357 -25.209) 28.961 45.022 ( 12.196 -9.134 12.184) 19.510 45.999 ( -3.740 -21.529 -1.409) 21.897 ======================= Grid point 624 (315/355) ======================= q-point: ( 0.58 0.25 -0.56) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.133 ( 9.372 -1.347 6.157) 11.294 3.495 ( 6.239 5.144 7.979) 11.360 3.708 ( -6.098 6.161 8.606) 12.215 4.525 ( 14.100 -9.830 2.355) 17.349 4.885 ( -6.905 2.120 -11.485) 13.568 5.119 ( 4.338 -8.774 5.904) 11.431 5.648 ( -17.372 -10.783 13.957) 24.756 6.097 ( -22.159 -8.336 -2.519) 23.809 6.542 ( 27.118 12.775 -0.202) 29.977 6.826 ( 0.164 2.549 1.487) 2.956 7.489 ( -8.629 -2.930 4.801) 10.300 7.795 ( 5.571 -5.927 -24.988) 26.279 10.444 ( -2.696 0.415 7.730) 8.197 10.558 ( 4.253 9.847 -4.993) 11.832 10.841 ( 9.292 -1.467 0.768) 9.439 11.355 ( -13.400 2.202 1.882) 13.709 12.578 ( 19.975 10.121 3.107) 22.607 13.366 ( 0.429 7.914 -4.332) 9.033 14.000 ( -11.438 9.145 4.888) 15.438 14.343 ( -8.727 7.259 -6.684) 13.173 14.971 ( 0.795 -17.617 0.336) 17.638 15.173 ( -7.489 -23.451 -1.484) 24.663 16.231 ( -5.083 -1.249 10.767) 11.972 16.504 ( 7.275 3.202 -15.762) 17.653 20.679 ( 2.908 -1.165 1.939) 3.684 20.861 ( -0.377 -1.439 -2.000) 2.493 21.695 ( 2.641 2.586 2.557) 4.494 21.925 ( -2.916 1.401 -0.441) 3.266 24.923 ( -3.498 -0.623 8.591) 9.297 25.110 ( 2.305 0.056 -6.952) 7.324 32.569 ( 2.871 -0.162 0.798) 2.984 32.655 ( -0.060 -0.824 -0.223) 0.856 42.879 ( 4.189 9.499 17.841) 20.642 43.825 ( 0.174 14.856 -24.101) 28.312 45.358 ( 12.850 -7.597 15.640) 21.620 46.237 ( -6.161 -15.205 -7.436) 18.012 ======================= Grid point 625 (316/355) ======================= q-point: (-0.33 0.25 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.232 ( 7.008 2.974 5.937) 9.655 3.423 ( -3.887 5.271 2.074) 6.870 3.762 ( 11.628 -0.961 16.831) 20.480 4.606 ( -10.415 3.404 -13.814) 17.632 4.908 ( 8.501 -11.938 -0.834) 14.679 5.301 ( -6.442 -6.802 3.685) 10.067 5.635 ( -3.412 2.500 1.011) 4.349 5.901 ( -20.447 -1.583 7.288) 21.764 6.793 ( 24.788 -1.954 3.318) 25.086 6.830 ( 3.044 0.198 4.815) 5.699 7.455 ( -12.001 -4.420 4.328) 13.502 7.804 ( 1.232 -3.471 -23.326) 23.615 10.399 ( 1.661 7.031 1.068) 7.303 10.426 ( -1.268 6.197 2.005) 6.635 11.000 ( 9.967 -4.534 1.586) 11.064 11.243 ( -10.249 -2.770 0.255) 10.619 12.650 ( 23.011 8.710 3.830) 24.900 13.178 ( -9.272 6.847 -6.728) 13.346 13.766 ( -5.744 9.982 6.180) 13.070 14.024 ( -10.924 12.462 -5.260) 17.387 15.324 ( 6.749 -17.309 1.012) 18.606 15.479 ( -6.453 -20.506 -0.085) 21.497 16.269 ( -4.877 -4.153 7.940) 10.202 16.482 ( 6.276 -0.618 -14.004) 15.358 20.740 ( 3.183 -1.063 2.105) 3.961 20.862 ( -1.898 -0.964 -2.114) 3.000 21.697 ( 4.316 2.705 2.678) 5.755 21.851 ( -4.324 2.516 -1.017) 5.104 24.937 ( -3.615 -0.572 8.680) 9.420 25.105 ( 2.827 -0.217 -7.063) 7.611 32.592 ( 2.486 1.029 0.764) 2.797 32.650 ( -1.170 0.623 -0.425) 1.392 42.829 ( 1.910 9.546 16.548) 19.199 43.447 ( -3.007 15.267 -21.531) 26.566 45.648 ( 9.079 -3.396 19.969) 22.197 46.322 ( -4.199 -8.023 -16.234) 18.589 ======================= Grid point 626 (317/355) ======================= q-point: (-0.25 0.25 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.213 ( 1.628 7.682 8.010) 11.217 3.330 ( 0.988 4.382 -2.971) 5.386 4.002 ( 12.771 -0.013 15.658) 20.206 4.341 ( -13.336 5.097 -17.230) 22.376 5.127 ( 6.050 -3.081 9.891) 11.997 5.312 ( -11.426 -12.277 -6.733) 18.072 5.591 ( -4.361 3.358 13.514) 14.592 5.836 ( -1.268 -0.724 -5.315) 5.512 6.828 ( -14.522 -2.221 16.614) 22.177 7.074 ( 24.501 2.202 -2.562) 24.733 7.447 ( -5.534 -2.560 4.259) 7.437 7.736 ( 2.876 0.208 -23.671) 23.846 10.307 ( 1.841 5.748 2.088) 6.387 10.326 ( -3.487 3.008 0.354) 4.619 11.192 ( 8.670 -5.966 2.659) 10.855 11.242 ( -6.706 -7.174 -1.955) 10.013 12.777 ( 20.346 5.214 4.453) 21.470 12.892 ( -19.767 4.862 -6.872) 21.485 13.624 ( -1.645 7.466 7.228) 10.521 13.757 ( 1.393 7.484 -5.892) 9.627 15.643 ( 5.554 -11.202 3.344) 12.943 15.699 ( -5.554 -13.111 -1.891) 14.364 16.353 ( -2.291 -6.392 5.346) 8.643 16.503 ( 1.385 -3.029 -9.595) 10.157 20.784 ( 0.465 0.101 2.553) 2.597 20.835 ( -0.923 0.559 -2.517) 2.738 21.716 ( 3.619 1.959 2.517) 4.824 21.761 ( -2.312 2.232 -1.973) 3.771 24.949 ( -3.865 -0.583 8.670) 9.510 25.108 ( 3.210 -0.461 -7.075) 7.783 32.591 ( 1.617 2.202 0.783) 2.842 32.608 ( -1.307 2.231 -0.845) 2.721 42.748 ( -1.126 9.765 15.626) 18.461 43.087 ( -0.863 13.446 -18.018) 22.498 45.803 ( -1.280 2.560 23.734) 23.906 46.290 ( 4.478 0.082 -24.515) 24.921 ======================= Grid point 627 (318/355) ======================= q-point: (-0.17 0.25 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.121 ( -0.735 7.785 7.307) 10.702 3.227 ( 3.242 8.082 -5.571) 10.338 3.912 ( -10.617 15.326 -0.481) 18.651 4.173 ( 14.954 11.866 0.948) 19.114 5.324 ( -7.982 -14.525 6.222) 17.703 5.389 ( -5.989 -5.586 -0.108) 8.191 5.593 ( -0.609 -4.830 10.266) 11.362 5.772 ( 0.031 6.256 -5.116) 8.081 6.734 ( -19.140 1.014 7.926) 20.741 7.102 ( 13.413 18.593 7.574) 24.145 7.494 ( 6.337 1.186 2.256) 6.831 7.690 ( 5.790 -5.971 -23.654) 25.074 10.262 ( -2.953 -1.069 0.715) 3.221 10.310 ( 2.121 -1.040 1.760) 2.946 11.301 ( -7.241 -10.622 -4.606) 13.656 11.421 ( 8.344 -9.343 3.344) 12.965 12.581 ( -24.027 -0.087 -6.968) 25.017 12.912 ( 8.723 0.707 4.569) 9.872 13.594 ( 8.941 1.697 6.556) 11.216 13.752 ( 12.174 0.246 -5.125) 13.211 15.769 ( -7.485 -3.691 -3.133) 8.914 15.829 ( 3.207 -4.065 4.725) 7.009 16.467 ( -2.561 -7.005 0.139) 7.460 16.505 ( -1.080 -0.597 -2.078) 2.417 20.740 ( -5.156 1.792 0.525) 5.484 20.832 ( 3.585 1.911 0.092) 4.064 21.669 ( -4.024 0.772 -1.030) 4.225 21.776 ( 6.690 0.989 -0.246) 6.767 24.958 ( -4.323 -0.644 8.454) 9.517 25.121 ( 3.507 -0.948 -6.857) 7.759 32.531 ( -2.342 3.176 -0.674) 4.003 32.577 ( 2.552 3.044 0.283) 3.982 42.596 ( -7.681 10.554 9.798) 16.321 42.874 ( 9.712 8.444 -9.215) 15.829 45.730 ( -12.414 8.707 15.932) 21.994 46.200 ( 14.352 9.922 -20.272) 26.747 ======================= Grid point 628 (319/355) ======================= q-point: (-0.08 0.25 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.984 ( -1.654 8.235 -2.493) 8.761 3.125 ( 6.647 8.283 3.748) 11.262 3.549 ( -2.714 17.614 -0.416) 17.827 4.034 ( 16.644 25.026 1.595) 30.098 5.331 ( -15.110 2.839 3.817) 15.841 5.389 ( -9.269 3.446 -7.098) 12.173 5.519 ( -10.496 -0.096 3.441) 11.046 5.908 ( 10.611 -7.684 12.308) 17.976 6.512 ( -6.459 5.834 -11.549) 14.461 6.889 ( 6.764 23.381 18.960) 30.853 7.493 ( -2.719 0.423 4.666) 5.417 7.864 ( 11.497 -13.065 -21.018) 27.288 10.291 ( -1.804 -2.888 4.145) 5.364 10.394 ( 2.372 -5.946 -1.938) 6.688 11.420 ( -8.406 -16.254 -6.468) 19.409 11.710 ( 5.380 -14.962 3.611) 16.305 12.380 ( -20.189 -7.571 -8.807) 23.291 12.986 ( -2.286 -3.792 6.901) 8.199 13.752 ( 16.313 0.967 3.642) 16.742 13.945 ( 17.284 -8.877 -4.194) 19.877 15.623 ( -11.527 8.319 -0.873) 14.242 15.917 ( 3.406 -0.251 5.180) 6.205 16.404 ( -8.001 4.468 -3.274) 9.731 16.567 ( 0.860 -3.127 0.627) 3.303 20.661 ( -4.173 2.019 0.710) 4.690 20.823 ( 2.564 3.036 0.554) 4.012 21.636 ( -1.782 -1.037 -1.707) 2.677 21.821 ( 5.358 0.692 -1.033) 5.501 24.961 ( -4.978 -0.608 8.023) 9.461 25.149 ( 3.551 -1.827 -6.264) 7.428 32.454 ( -1.578 2.990 -0.856) 3.487 32.551 ( 2.643 3.260 0.267) 4.205 42.373 ( -7.651 9.903 5.744) 13.769 42.901 ( 17.965 2.115 -2.948) 18.328 45.444 ( -12.528 14.450 2.803) 19.330 46.033 ( 14.686 20.001 -9.236) 26.477 ======================= Grid point 633 (320/355) ======================= q-point: ( 0.33 0.33 -0.56) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 355 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.498 ( 18.834 0.000 2.095) 18.950 3.004 ( 26.956 0.000 1.772) 27.014 3.740 ( 3.392 0.000 1.660) 3.776 4.541 ( 11.498 0.000 -11.508) 16.268 4.577 ( -23.781 -0.000 19.140) 30.527 5.144 ( 22.374 0.000 6.362) 23.260 5.159 ( -8.627 -0.000 20.179) 21.946 6.110 ( 3.428 0.000 -12.238) 12.709 6.700 ( 4.560 0.000 -13.127) 13.897 6.720 ( -7.799 -0.000 22.049) 23.388 7.458 ( 16.370 0.000 5.753) 17.351 8.065 ( 1.271 0.000 -26.741) 26.771 10.248 ( -5.034 -0.000 11.624) 12.667 10.904 ( -0.377 -0.000 -14.350) 14.355 11.168 ( -0.958 -0.000 -10.633) 10.676 11.886 ( -20.786 -0.000 9.004) 22.652 13.007 ( -7.658 -0.000 -1.927) 7.897 13.226 ( 2.453 0.000 0.209) 2.462 13.851 ( -11.878 -0.000 -10.797) 16.052 14.039 ( -2.428 -0.000 -7.640) 8.016 14.725 ( 1.704 0.000 6.092) 6.325 15.235 ( -7.111 -0.000 6.638) 9.727 16.384 ( -0.453 -0.000 10.454) 10.464 16.453 ( 5.963 0.000 -11.879) 13.291 20.680 ( 2.231 0.000 1.182) 2.524 20.791 ( 2.124 0.000 -2.609) 3.364 21.721 ( 1.053 0.000 1.950) 2.216 21.912 ( 0.785 0.000 -1.483) 1.677 24.886 ( -3.624 -0.000 8.260) 9.020 25.181 ( -0.802 -0.000 -6.181) 6.233 32.459 ( 2.503 0.000 -0.228) 2.514 32.561 ( 2.598 0.000 -0.349) 2.621 43.114 ( 11.154 0.000 35.467) 37.179 44.439 ( 17.843 0.000 -26.746) 32.152 44.605 ( 10.172 0.000 3.124) 10.641 45.078 ( 7.530 0.000 -1.859) 7.756 ======================= Grid point 634 (321/355) ======================= q-point: ( 0.42 0.33 -0.56) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.744 ( 19.420 -3.818 4.663) 20.334 3.344 ( 23.663 -7.399 3.647) 25.060 3.748 ( 0.369 2.456 1.270) 2.789 4.441 ( -11.433 1.999 15.082) 19.031 4.614 ( 5.100 -3.622 -7.184) 9.526 5.203 ( -9.001 -2.896 23.962) 25.760 5.359 ( 13.346 0.829 4.839) 14.220 5.913 ( -19.921 5.645 -7.382) 21.982 6.737 ( 2.683 0.178 4.215) 5.000 6.836 ( 18.050 -4.531 -1.689) 18.687 7.577 ( 8.426 5.457 1.020) 10.090 7.925 ( 0.313 2.922 -26.315) 26.479 10.286 ( -4.269 -3.371 12.305) 13.453 10.779 ( -4.363 2.826 -13.034) 14.032 11.110 ( 9.964 6.634 -9.072) 15.019 11.698 ( -19.445 2.928 8.173) 21.295 12.851 ( 1.730 7.605 0.806) 7.841 13.400 ( -2.047 -13.272 -0.791) 13.453 13.808 ( -6.963 -12.022 -8.997) 16.552 14.006 ( -5.894 -5.075 -6.887) 10.389 14.719 ( 1.155 6.078 5.794) 8.477 15.108 ( -7.465 7.128 2.093) 10.531 16.383 ( -2.546 3.318 9.028) 9.950 16.512 ( 4.106 -4.890 -9.421) 11.381 20.685 ( 2.117 2.230 1.403) 3.379 20.808 ( 2.060 -0.788 -2.662) 3.457 21.738 ( 1.156 0.440 2.375) 2.678 21.921 ( 0.100 -1.214 -1.609) 2.019 24.892 ( -3.262 -0.261 8.346) 8.965 25.144 ( 0.136 0.388 -6.591) 6.604 32.492 ( 2.917 -0.710 0.258) 3.013 32.588 ( 1.725 -0.726 -0.415) 1.917 43.271 ( 6.799 9.802 31.895) 34.053 44.440 ( 13.266 4.808 -27.285) 30.718 44.760 ( 10.473 -4.715 6.843) 13.370 45.283 ( 3.736 -16.374 -1.956) 16.908 ======================= Grid point 635 (322/355) ======================= q-point: ( 0.50 0.33 -0.56) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.022 ( 16.613 -4.333 4.869) 17.845 3.636 ( -6.664 -5.131 -3.589) 9.144 3.750 ( 22.079 3.720 12.605) 25.695 4.426 ( 0.565 0.319 12.847) 12.864 4.749 ( 6.973 -8.433 -3.218) 11.405 5.194 ( -12.427 7.578 8.354) 16.783 5.384 ( -5.338 1.049 11.255) 12.500 5.682 ( -15.421 -8.274 -4.940) 18.184 6.793 ( 4.017 -0.619 3.799) 5.564 7.067 ( 16.552 3.152 -1.411) 16.909 7.476 ( 0.330 7.322 -0.624) 7.355 7.748 ( 0.320 3.096 -26.173) 26.358 10.369 ( -4.181 -4.138 12.182) 13.528 10.666 ( -0.115 0.760 -10.212) 10.241 11.055 ( 12.385 9.273 -5.563) 16.442 11.484 ( -17.236 4.253 5.660) 18.634 12.827 ( 10.338 4.571 3.529) 11.842 13.507 ( -6.326 -3.837 -4.170) 8.492 13.992 ( -1.963 -17.294 -6.116) 18.448 14.082 ( -6.017 -14.798 -3.601) 16.376 14.618 ( -1.254 6.730 5.726) 8.925 14.920 ( -5.816 6.529 -2.942) 9.225 16.320 ( -5.080 4.696 11.558) 13.470 16.564 ( 4.776 -1.486 -12.368) 13.341 20.679 ( 2.218 1.536 1.999) 3.358 20.824 ( 0.907 -0.700 -2.841) 3.063 21.754 ( 1.767 0.839 2.774) 3.394 21.930 ( -1.139 -0.983 -1.528) 2.144 24.905 ( -3.090 -0.416 8.442) 8.999 25.115 ( 1.194 0.210 -6.837) 6.944 32.540 ( 2.826 -1.221 0.661) 3.149 32.615 ( 0.735 -1.179 -0.454) 1.462 43.262 ( 4.660 12.819 26.241) 29.574 44.272 ( 5.566 11.164 -26.821) 29.580 45.041 ( 11.864 -9.894 10.427) 18.638 45.603 ( -1.489 -20.302 -3.404) 20.639 ======================= Grid point 636 (323/355) ======================= q-point: ( 0.58 0.33 -0.56) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.244 ( 12.898 -1.861 4.203) 13.692 3.542 ( -9.863 0.825 -1.598) 10.026 3.945 ( 17.126 8.303 17.590) 25.916 4.595 ( 14.990 -5.565 7.460) 17.644 4.837 ( -16.656 10.754 -11.583) 22.962 4.968 ( -0.192 -11.139 1.739) 11.276 5.441 ( -6.318 -7.444 14.529) 17.506 5.702 ( -17.564 -10.471 -1.301) 20.489 6.866 ( 4.647 -0.268 3.675) 5.930 7.007 ( 14.494 13.573 -1.215) 19.894 7.396 ( -9.423 1.724 2.735) 9.963 7.649 ( 4.563 -2.871 -25.042) 25.616 10.437 ( -4.328 -2.398 10.834) 11.911 10.640 ( 3.105 0.585 -8.562) 9.126 11.016 ( 12.313 7.492 -0.036) 14.413 11.274 ( -13.962 3.805 1.598) 14.559 12.903 ( 15.435 4.993 5.130) 17.015 13.386 ( -10.747 3.669 -6.929) 13.303 14.107 ( -2.597 2.940 5.017) 6.369 14.282 ( -0.113 -7.777 -8.078) 11.214 14.657 ( -3.493 -14.223 4.198) 15.235 14.810 ( -3.127 -6.653 -5.175) 8.990 16.250 ( -6.861 3.157 13.965) 15.877 16.548 ( 6.983 2.242 -15.766) 17.389 20.703 ( 2.141 -0.336 2.802) 3.543 20.824 ( -0.652 -0.841 -3.058) 3.238 21.772 ( 3.009 1.379 2.994) 4.463 21.908 ( -2.545 0.537 -1.800) 3.163 24.920 ( -3.094 -0.433 8.550) 9.103 25.098 ( 2.032 -0.139 -6.998) 7.289 32.589 ( 2.250 -1.022 0.801) 2.598 32.635 ( -0.248 -1.133 -0.520) 1.271 43.199 ( 3.017 12.512 23.212) 26.542 43.956 ( -0.358 14.675 -25.561) 29.476 45.389 ( 9.473 -11.017 14.427) 20.475 45.870 ( -2.849 -17.603 -9.531) 20.219 ======================= Grid point 637 (324/355) ======================= q-point: (-0.33 -0.67 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.377 ( 8.763 1.852 3.325) 9.554 3.423 ( -7.017 1.254 -1.266) 7.240 4.051 ( 17.499 7.444 19.748) 27.415 4.451 ( -16.541 6.042 -19.201) 26.054 4.930 ( 16.936 -8.233 7.272) 20.187 5.034 ( -15.952 -7.192 -0.622) 17.509 5.613 ( -20.241 -3.444 8.626) 22.271 5.680 ( 7.364 -10.278 7.297) 14.599 6.872 ( -4.731 4.160 4.387) 7.677 7.047 ( 19.875 1.123 -10.030) 22.290 7.298 ( -10.280 -2.364 11.619) 15.693 7.643 ( 3.450 -4.141 -22.707) 23.338 10.444 ( -5.227 1.788 8.450) 10.096 10.584 ( 3.248 6.297 -5.078) 8.717 11.070 ( 5.150 -0.738 2.440) 5.746 11.121 ( -3.206 1.526 -2.357) 4.262 12.995 ( 15.923 6.187 5.787) 18.036 13.125 ( -16.901 6.992 -7.096) 19.618 13.996 ( 4.054 11.938 6.607) 14.233 14.137 ( -3.022 12.099 -7.346) 14.473 15.005 ( -3.147 -24.306 2.772) 24.665 15.071 ( 3.391 -22.203 -3.811) 22.781 16.213 ( -7.532 -0.125 13.186) 15.186 16.501 ( 6.701 2.693 -15.314) 16.932 20.750 ( 0.359 -1.493 3.373) 3.706 20.817 ( -0.517 -1.103 -3.257) 3.477 21.792 ( 3.118 1.984 2.964) 4.737 21.847 ( -2.196 2.206 -2.496) 3.990 24.935 ( -3.234 -0.347 8.640) 9.232 25.094 ( 2.612 -0.403 -7.124) 7.599 32.622 ( 1.139 -0.290 0.839) 1.444 32.639 ( -0.739 -0.300 -0.802) 1.131 43.117 ( 0.877 12.139 21.663) 24.848 43.570 ( -2.936 15.145 -23.146) 27.816 45.684 ( -2.071 -8.873 19.142) 21.200 46.064 ( 6.032 -12.520 -18.335) 23.007 ======================= Grid point 638 (325/355) ======================= q-point: (-0.25 -0.67 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.300 ( -6.112 2.638 -0.429) 6.671 3.439 ( 8.175 4.460 -0.127) 9.314 4.125 ( -11.918 2.307 -13.914) 18.465 4.269 ( 15.949 0.731 12.509) 20.283 4.936 ( -19.223 -8.294 -1.852) 21.018 5.271 ( 15.052 -6.488 4.778) 17.073 5.485 ( -18.370 0.038 16.806) 24.898 5.947 ( 15.459 -0.071 3.378) 15.824 6.675 ( -23.408 0.838 5.390) 24.035 7.200 ( 15.178 -5.319 -18.409) 24.445 7.385 ( -2.068 -4.958 11.921) 13.076 7.671 ( 8.623 -2.545 -14.054) 16.683 10.346 ( -6.429 5.562 4.319) 9.535 10.473 ( 2.286 7.718 -0.680) 8.078 11.053 ( -7.340 -4.977 -3.322) 9.470 11.230 ( 11.412 -2.474 1.419) 11.763 12.756 ( -22.928 8.771 -6.612) 25.423 13.050 ( 9.527 6.451 5.901) 12.931 13.851 ( 6.045 12.341 0.971) 13.776 13.951 ( 10.753 10.135 -1.358) 14.838 15.336 ( -6.722 -20.048 -0.035) 21.145 15.480 ( 7.352 -18.557 -0.161) 19.961 16.231 ( -7.204 -4.336 10.389) 13.365 16.463 ( 3.536 0.324 -11.022) 11.580 20.757 ( -4.528 -0.676 0.944) 4.674 20.841 ( 2.788 -1.161 -0.624) 3.084 21.739 ( -4.144 2.892 -1.145) 5.182 21.834 ( 6.077 2.114 0.349) 6.444 24.946 ( -3.494 -0.216 8.653) 9.334 25.098 ( 3.009 -0.576 -7.181) 7.807 32.607 ( -2.244 1.067 -0.529) 2.540 32.642 ( 1.575 0.670 0.192) 1.723 42.990 ( -4.516 12.681 16.278) 21.123 43.227 ( 1.780 12.312 -15.401) 19.798 45.782 ( -15.248 -4.885 12.302) 20.192 46.261 ( 17.179 -5.612 -15.629) 23.893 ======================= Grid point 639 (326/355) ======================= q-point: (-0.17 0.33 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.196 ( -4.001 3.507 -1.847) 5.631 3.398 ( 5.738 7.498 -2.233) 9.702 3.916 ( -9.347 2.338 -11.971) 15.366 4.467 ( 12.771 2.236 11.413) 17.273 4.951 ( -12.880 -10.785 1.395) 16.857 5.370 ( -16.046 -4.437 9.447) 19.141 5.548 ( 16.720 -0.764 8.838) 18.928 5.922 ( -1.343 11.179 0.759) 11.285 6.564 ( -15.569 -5.723 11.705) 20.302 7.301 ( 6.083 -3.582 -22.871) 23.936 7.512 ( 5.524 -5.347 4.833) 9.081 7.717 ( 9.716 5.194 -5.067) 12.127 10.224 ( -4.463 2.404 0.870) 5.143 10.392 ( 2.033 4.554 2.776) 5.708 11.066 ( -6.763 -6.799 -5.186) 10.902 11.400 ( 9.021 -4.732 1.462) 10.291 12.353 ( -24.149 6.000 -7.020) 25.855 13.017 ( -0.925 5.103 6.179) 8.067 13.826 ( 18.784 5.005 -0.783) 19.455 13.940 ( 15.166 7.361 0.827) 16.878 15.530 ( -8.357 -12.612 -2.581) 15.349 15.784 ( 4.669 -8.985 3.346) 10.664 16.296 ( -6.171 -7.118 3.658) 10.106 16.467 ( -0.113 -2.226 -3.128) 3.841 20.711 ( -4.897 0.606 0.416) 4.952 20.879 ( 2.140 -0.083 0.386) 2.176 21.651 ( -2.844 2.027 -1.815) 3.936 21.863 ( 5.901 1.814 -0.491) 6.193 24.951 ( -3.877 -0.067 8.524) 9.364 25.108 ( 3.262 -0.826 -7.082) 7.840 32.551 ( -2.345 2.269 -0.835) 3.368 32.640 ( 1.623 1.654 0.230) 2.328 42.747 ( -7.947 12.152 3.737) 14.993 43.086 ( 9.280 8.275 -0.132) 12.434 45.686 ( -17.082 0.314 2.326) 17.242 46.409 ( 17.269 2.681 -8.615) 19.484 ======================= Grid point 640 (327/355) ======================= q-point: (-0.08 0.33 -0.56) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.073 ( -1.665 6.102 -4.543) 7.787 3.318 ( 4.239 6.529 -0.428) 7.796 3.743 ( -0.671 7.883 -3.561) 8.676 4.522 ( 9.603 11.460 8.667) 17.282 4.972 ( -19.304 -12.125 -2.654) 22.950 5.267 ( -7.326 6.063 -3.711) 10.208 5.703 ( -8.735 10.074 14.282) 19.539 5.846 ( 9.412 -13.090 10.616) 19.304 6.542 ( -2.387 4.258 3.271) 5.876 7.246 ( -1.246 4.983 -3.242) 6.074 7.607 ( 3.709 10.063 -5.391) 12.004 7.717 ( 12.843 -6.698 -9.820) 17.499 10.209 ( -0.545 -3.733 -1.409) 4.027 10.389 ( 1.046 0.517 5.388) 5.513 11.100 ( -7.362 -9.409 -6.772) 13.732 11.582 ( 4.898 -8.058 0.874) 9.470 12.064 ( -18.391 -2.183 -6.970) 19.788 12.963 ( -3.587 1.274 7.096) 8.053 13.994 ( 14.255 0.642 -3.161) 14.616 14.020 ( 23.307 1.832 2.304) 23.492 15.556 ( -11.084 -2.828 -1.867) 11.590 15.921 ( 1.092 -3.204 5.557) 6.506 16.353 ( -2.631 -2.365 -4.476) 5.705 16.481 ( -5.709 -3.729 2.900) 7.410 20.654 ( -3.567 1.303 0.927) 3.909 20.883 ( 0.797 1.582 0.350) 1.806 21.609 ( -0.214 0.073 -1.727) 1.741 21.882 ( 4.245 1.449 -1.376) 4.692 24.948 ( -4.335 0.110 8.277) 9.344 25.126 ( 3.276 -1.325 -6.772) 7.639 32.485 ( -1.431 2.729 -0.810) 3.186 32.623 ( 1.760 2.414 0.126) 2.990 42.506 ( -5.639 10.219 4.080) 12.364 43.112 ( 15.281 3.572 1.614) 15.776 45.470 ( -14.378 5.809 -4.046) 16.026 46.417 ( 13.531 11.847 -3.419) 18.307 ======================= Grid point 646 (328/355) ======================= q-point: ( 0.42 0.42 -0.56) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 354 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.936 ( 19.697 0.000 5.139) 20.357 3.465 ( 9.067 0.000 -1.047) 9.127 3.862 ( 14.562 0.000 9.172) 17.210 4.405 ( -13.280 -0.000 21.344) 25.138 4.586 ( 6.532 0.000 -13.599) 15.087 5.221 ( -6.434 -0.000 24.412) 25.245 5.489 ( 7.625 0.000 0.071) 7.625 5.685 ( -27.213 -0.000 -9.504) 28.825 6.786 ( -3.921 -0.000 22.443) 22.783 7.023 ( 31.830 0.000 -15.435) 35.374 7.698 ( 2.397 0.000 -0.849) 2.543 7.829 ( -0.826 -0.000 -25.415) 25.429 10.271 ( -3.827 -0.000 12.665) 13.231 10.708 ( -2.250 -0.000 -13.298) 13.487 11.235 ( 12.408 0.000 -9.226) 15.462 11.567 ( -19.459 -0.000 8.984) 21.433 12.907 ( -1.824 -0.000 1.406) 2.303 13.249 ( -1.778 -0.000 -3.678) 4.085 13.586 ( -3.773 -0.000 -4.352) 5.760 13.907 ( -4.094 -0.000 -7.512) 8.556 14.823 ( 3.925 0.000 3.634) 5.349 15.109 ( -9.404 -0.000 3.860) 10.166 16.416 ( -4.461 -0.000 8.426) 9.534 16.477 ( 6.395 0.000 -9.352) 11.329 20.732 ( 1.540 0.000 1.490) 2.143 20.808 ( 1.870 0.000 -2.731) 3.310 21.764 ( 1.066 0.000 2.664) 2.869 21.901 ( -0.106 -0.000 -2.294) 2.296 24.898 ( -2.896 -0.000 8.362) 8.850 25.119 ( 0.559 0.000 -6.763) 6.786 32.515 ( 2.726 0.000 0.472) 2.766 32.593 ( 0.878 0.000 -0.609) 1.068 43.558 ( 0.911 0.000 34.960) 34.972 44.489 ( 12.501 0.000 -27.853) 30.530 44.833 ( 7.916 0.000 5.695) 9.752 45.165 ( 3.899 0.000 -4.490) 5.947 ======================= Grid point 647 (329/355) ======================= q-point: ( 0.50 0.42 -0.56) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.161 ( 16.893 -1.910 3.864) 17.435 3.482 ( -8.264 -2.733 -2.622) 9.091 4.122 ( 29.308 1.979 12.339) 31.861 4.408 ( -10.971 -3.182 21.154) 24.041 4.649 ( 6.077 -6.935 -9.930) 13.551 5.215 ( -16.552 6.286 1.947) 17.812 5.334 ( -16.643 -1.070 5.099) 17.440 5.542 ( 3.828 2.443 -1.125) 4.678 6.860 ( -0.065 0.586 19.211) 19.220 7.260 ( 23.431 0.256 -11.942) 26.300 7.582 ( -8.322 8.007 -3.217) 11.988 7.690 ( 0.297 2.372 -21.317) 21.450 10.321 ( -3.808 -2.880 12.802) 13.664 10.634 ( 1.462 0.529 -12.253) 12.351 11.280 ( 13.015 5.443 -6.477) 15.523 11.398 ( -17.071 2.372 7.101) 18.641 12.940 ( 4.763 -2.100 4.339) 6.776 13.274 ( -7.385 -9.111 -7.337) 13.835 13.672 ( -0.098 -11.464 0.429) 11.472 13.863 ( -3.432 -5.230 -7.093) 9.458 14.814 ( 3.620 8.287 4.389) 10.052 14.975 ( -5.840 6.216 -0.286) 8.534 16.375 ( -6.528 2.904 9.922) 12.226 16.532 ( 7.612 -2.608 -11.199) 13.790 20.735 ( 1.122 1.593 1.930) 2.743 20.813 ( 0.834 -0.101 -2.952) 3.069 21.788 ( 1.344 -0.062 2.900) 3.197 21.894 ( -0.817 -0.786 -2.456) 2.705 24.910 ( -2.664 -0.163 8.416) 8.829 25.096 ( 1.270 -0.003 -6.902) 7.018 32.550 ( 2.246 -0.844 0.679) 2.493 32.600 ( -0.096 -0.700 -0.782) 1.054 43.613 ( -1.288 9.828 31.125) 32.665 44.384 ( 6.817 9.472 -27.283) 29.674 45.012 ( 6.477 -8.993 7.945) 13.636 45.293 ( 1.603 -13.326 -6.752) 15.024 ======================= Grid point 648 (330/355) ======================= q-point: (-0.42 -0.58 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.359 ( 12.981 -1.980 2.491) 13.366 3.400 ( -12.595 -2.229 -2.019) 12.949 4.385 ( 16.464 7.980 19.413) 26.676 4.520 ( -1.845 -9.029 8.512) 12.545 4.746 ( -13.212 -2.302 -4.725) 14.220 4.877 ( 0.596 1.413 -15.037) 15.115 5.370 ( -2.322 -3.985 15.241) 15.924 5.512 ( -2.104 1.295 0.355) 2.496 6.933 ( 0.542 0.589 15.375) 15.396 7.216 ( -4.731 8.091 -10.857) 14.343 7.422 ( 2.534 5.560 -2.601) 6.640 7.580 ( 2.934 1.261 -16.947) 17.245 10.390 ( -4.501 -3.243 11.971) 13.194 10.622 ( 4.737 -1.495 -10.869) 11.950 11.183 ( -13.852 4.990 6.667) 16.162 11.303 ( 12.748 6.867 -5.387) 15.449 13.092 ( 11.020 -1.929 6.961) 13.177 13.243 ( -12.400 -1.763 -7.864) 14.788 13.913 ( -3.556 -16.726 3.485) 17.451 14.020 ( 2.697 -17.619 -7.089) 19.183 14.696 ( 2.903 9.629 5.524) 11.474 14.805 ( -1.158 8.189 -5.179) 9.759 16.298 ( -8.227 3.528 13.347) 16.071 16.580 ( 9.231 0.344 -14.678) 17.343 20.732 ( 0.106 0.748 3.010) 3.103 20.798 ( -0.136 0.171 -3.477) 3.484 21.822 ( 2.043 -0.163 2.978) 3.615 21.880 ( -1.512 -0.184 -2.722) 3.119 24.926 ( -2.602 -0.183 8.508) 8.899 25.083 ( 1.965 -0.248 -7.031) 7.304 32.590 ( 1.224 -1.239 0.750) 1.897 32.607 ( -0.790 -1.204 -0.944) 1.722 43.540 ( -1.613 12.403 27.497) 30.208 44.082 ( 0.130 15.011 -26.058) 30.073 45.287 ( -1.664 -13.188 12.170) 18.022 45.541 ( 6.115 -17.050 -12.603) 22.066 ======================= Grid point 649 (331/355) ======================= q-point: (-0.33 -0.58 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.301 ( -12.399 -2.327 -1.915) 12.760 3.510 ( 11.100 -0.331 1.685) 11.232 4.293 ( -20.765 4.060 -15.534) 26.248 4.470 ( 10.865 8.629 19.941) 24.293 4.759 ( -8.559 2.154 -4.127) 9.743 4.954 ( 4.877 -11.848 0.095) 12.813 5.478 ( 0.667 0.199 9.395) 9.421 5.631 ( 9.413 -12.543 10.365) 18.798 6.892 ( -12.649 6.792 -2.754) 14.619 7.085 ( -0.204 -1.665 6.480) 6.694 7.309 ( -0.324 4.906 -4.884) 6.930 7.566 ( 6.726 -2.204 -13.287) 15.055 10.437 ( -4.864 -1.269 10.390) 11.542 10.641 ( 3.529 0.690 -7.732) 8.527 10.999 ( -11.763 2.494 1.006) 12.067 11.308 ( 14.898 6.761 -1.604) 16.439 13.023 ( -17.044 5.551 -6.711) 19.140 13.241 ( 11.650 3.067 7.281) 14.076 14.132 ( -1.269 -7.298 4.973) 8.922 14.242 ( 4.087 -0.183 -6.539) 7.714 14.709 ( 3.717 -5.757 4.213) 8.044 14.760 ( 3.479 -13.163 -5.281) 14.603 16.224 ( -8.481 2.682 14.472) 16.987 16.564 ( 8.612 4.009 -15.281) 17.993 20.728 ( -3.276 -0.358 1.727) 3.721 20.795 ( 1.513 -0.936 -1.631) 2.413 21.820 ( -2.814 1.521 -0.926) 3.330 21.879 ( 3.820 0.123 0.342) 3.837 24.941 ( -2.724 -0.078 8.591) 9.013 25.079 ( 2.523 -0.513 -7.147) 7.596 32.605 ( -1.848 -0.934 -0.574) 2.148 32.627 ( 0.636 -1.270 0.111) 1.425 43.424 ( -3.796 12.928 23.702) 27.264 43.690 ( -2.470 15.357 -22.018) 26.958 45.472 ( -13.715 -12.306 8.473) 20.281 45.878 ( 15.614 -16.298 -12.474) 25.788 ======================= Grid point 650 (332/355) ======================= q-point: (-0.25 -0.58 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.216 ( -9.896 -2.136 -2.480) 10.423 3.586 ( 6.766 3.357 -1.568) 7.714 3.989 ( -7.934 4.322 -17.796) 19.958 4.538 ( -2.263 0.539 10.619) 10.871 4.621 ( -5.136 -2.377 4.014) 6.939 5.121 ( -9.369 -7.656 5.010) 13.096 5.626 ( 17.582 -0.207 13.673) 22.273 6.022 ( 11.232 -13.624 10.848) 20.723 6.522 ( -22.912 11.717 -3.583) 25.982 7.130 ( 4.965 -1.688 -20.994) 21.639 7.319 ( -2.360 -6.102 13.651) 15.138 7.662 ( 8.475 -5.325 -8.209) 12.945 10.402 ( -5.729 4.762 7.857) 10.828 10.575 ( -1.341 4.532 -2.357) 5.281 10.905 ( -5.160 -2.340 -5.584) 7.955 11.367 ( 13.474 3.187 0.718) 13.864 12.669 ( -20.761 10.279 -5.909) 23.908 13.260 ( 3.832 7.916 6.053) 10.676 14.109 ( 9.350 9.643 -5.102) 14.368 14.222 ( 8.515 5.636 4.369) 11.106 14.954 ( -1.119 -17.978 1.684) 18.092 15.182 ( 8.132 -24.771 -2.035) 26.151 16.182 ( -7.764 0.194 13.852) 15.881 16.489 ( 4.896 4.673 -12.651) 14.348 20.701 ( -4.356 -0.751 0.122) 4.422 20.835 ( 1.487 -1.908 0.226) 2.429 21.743 ( -3.156 2.799 -1.977) 4.659 21.918 ( 4.813 0.903 0.185) 4.900 24.952 ( -3.024 0.097 8.592) 9.109 25.084 ( 2.932 -0.683 -7.197) 7.802 32.588 ( -2.580 -0.080 -0.930) 2.744 32.651 ( 0.324 -0.871 0.154) 0.942 43.181 ( -9.825 13.902 -1.023) 17.054 43.422 ( 2.539 11.427 4.729) 12.625 45.518 ( -17.352 -9.306 1.834) 19.775 46.240 ( 17.526 -12.232 -9.563) 23.414 ======================= Grid point 651 (333/355) ======================= q-point: (-0.17 -0.58 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.154 ( -6.049 -1.374 -2.825) 6.816 3.510 ( -2.253 3.863 -7.817) 9.006 3.838 ( 4.089 4.419 -12.385) 13.771 4.534 ( -8.972 -6.355 3.129) 11.431 4.767 ( -0.924 -5.791 16.068) 17.105 5.147 ( -8.014 -7.015 6.389) 12.420 5.849 ( 15.561 6.867 10.308) 19.889 6.072 ( -11.885 12.581 0.024) 17.307 6.380 ( 1.793 -11.957 13.253) 17.940 7.106 ( 2.426 -5.825 -28.849) 29.531 7.497 ( 2.405 -6.662 11.203) 13.254 7.791 ( 5.179 -4.047 -5.973) 8.881 10.265 ( -4.947 6.476 4.194) 9.165 10.486 ( -0.795 3.956 0.748) 4.104 10.891 ( -4.107 -3.968 -6.528) 8.673 11.462 ( 10.060 0.307 0.792) 10.096 12.240 ( -21.413 11.114 -5.664) 24.781 13.139 ( -2.455 8.498 4.729) 10.031 14.087 ( 16.089 6.134 -4.281) 17.743 14.243 ( 13.574 7.121 4.787) 16.059 15.213 ( -4.415 -14.646 -0.758) 15.316 15.628 ( 7.831 -18.102 -0.310) 19.726 16.183 ( -7.291 -1.923 11.496) 13.748 16.423 ( 0.981 0.355 -7.691) 7.762 20.670 ( -3.873 -0.347 0.322) 3.902 20.878 ( 0.549 -1.592 0.291) 1.709 21.660 ( -1.829 2.647 -1.881) 3.726 21.940 ( 4.061 1.601 -0.961) 4.470 24.955 ( -3.458 0.291 8.480) 9.162 25.094 ( 3.190 -0.796 -7.130) 7.852 32.550 ( -2.512 0.904 -1.028) 2.861 32.663 ( 0.317 -0.139 0.106) 0.362 42.857 ( -8.517 10.903 -4.792) 14.642 43.330 ( 4.969 8.917 10.760) 14.832 45.465 ( -16.927 -5.389 -2.872) 17.995 46.520 ( 15.577 -5.398 -7.057) 17.933 ======================= Grid point 652 (334/355) ======================= q-point: (-0.08 -0.58 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.103 ( -2.560 1.494 -2.542) 3.905 3.391 ( -3.503 2.623 -7.103) 8.343 3.798 ( 7.528 1.412 -6.812) 10.250 4.562 ( -9.250 -4.881 1.300) 10.539 4.804 ( -9.750 1.493 15.727) 18.564 5.342 ( 5.414 -5.448 5.349) 9.359 5.573 ( -15.199 6.188 -3.356) 16.750 6.065 ( 10.644 7.963 18.409) 22.707 6.597 ( 5.150 -3.470 8.438) 10.476 7.112 ( -0.306 -7.149 -22.500) 23.611 7.653 ( 1.218 -3.197 5.016) 6.072 7.813 ( 5.494 2.346 -9.203) 10.972 10.181 ( -0.820 1.064 1.398) 1.939 10.443 ( 0.119 2.028 3.781) 4.293 10.886 ( -5.160 -4.835 -6.798) 9.809 11.544 ( 3.446 -1.284 -1.093) 3.837 11.890 ( -14.274 3.988 -3.874) 15.318 13.020 ( -1.912 4.984 5.064) 7.358 14.148 ( 13.421 3.103 -2.824) 14.062 14.311 ( 16.608 4.726 2.764) 17.487 15.336 ( -8.135 -8.339 -1.828) 11.792 15.896 ( 3.097 -5.684 3.938) 7.577 16.223 ( -3.059 -6.605 1.742) 7.484 16.406 ( -3.616 -0.571 -1.407) 3.922 20.641 ( -2.438 0.286 0.927) 2.624 20.895 ( -0.462 -0.227 -0.064) 0.519 21.613 ( 0.305 0.981 -1.370) 1.712 21.937 ( 2.376 1.772 -1.563) 3.351 24.951 ( -3.910 0.480 8.326) 9.211 25.108 ( 3.242 -0.970 -6.953) 7.733 32.503 ( -1.483 1.557 -0.847) 2.311 32.662 ( 0.559 0.778 0.039) 0.959 42.616 ( -5.668 8.116 -0.092) 9.899 43.330 ( 10.075 4.455 7.263) 13.195 45.341 ( -14.181 -0.836 -5.464) 15.220 46.651 ( 11.509 3.061 -4.231) 12.638 ======================= Grid point 659 (335/355) ======================= q-point: (-0.50 -0.50 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 355 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.315 ( 13.818 0.000 2.017) 13.965 3.347 ( -12.774 -0.000 -1.634) 12.878 4.300 ( -7.756 -0.000 16.702) 18.415 4.550 ( -4.133 -0.000 -9.619) 10.469 4.577 ( 28.793 0.000 19.517) 34.784 4.975 ( -19.992 -0.000 -18.893) 27.507 5.345 ( -1.726 -0.000 19.020) 19.098 5.594 ( 3.483 0.000 -5.628) 6.619 6.968 ( -0.555 -0.000 22.968) 22.975 7.392 ( 11.371 0.000 -19.282) 22.385 7.513 ( -18.679 -0.000 -1.099) 18.712 7.640 ( 7.461 0.000 -13.731) 15.627 10.328 ( -2.323 -0.000 13.210) 13.412 10.598 ( 2.831 0.000 -13.367) 13.663 11.278 ( -17.478 -0.000 9.001) 19.660 11.440 ( 15.245 0.000 -7.095) 16.815 12.963 ( 4.413 0.000 4.816) 6.532 13.085 ( -5.757 -0.000 -7.291) 9.290 13.634 ( 5.133 0.000 3.508) 6.217 13.738 ( -5.880 -0.000 -6.754) 8.955 14.963 ( -5.995 -0.000 1.313) 6.137 14.963 ( 6.893 0.000 1.512) 7.057 16.381 ( -5.445 -0.000 6.414) 8.413 16.538 ( 8.156 0.000 -9.226) 12.314 20.762 ( -0.059 -0.000 1.678) 1.679 20.807 ( 0.425 0.000 -2.715) 2.748 21.810 ( 0.885 0.000 2.920) 3.051 21.868 ( -0.812 -0.000 -2.778) 2.894 24.923 ( -2.278 -0.000 8.445) 8.747 25.079 ( 1.624 0.000 -6.975) 7.161 32.565 ( 1.514 0.000 0.696) 1.667 32.583 ( -1.101 -0.000 -1.064) 1.531 43.805 ( -6.603 -0.000 32.317) 32.984 44.429 ( 7.458 0.000 -28.873) 29.820 45.003 ( 3.214 0.000 6.212) 6.995 45.143 ( -0.553 -0.000 -8.017) 8.036 ======================= Grid point 660 (336/355) ======================= q-point: (-0.42 -0.50 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.209 ( -16.450 -1.963 -1.242) 16.613 3.452 ( 9.384 -1.999 0.658) 9.617 4.272 ( -19.658 -0.855 7.838) 21.180 4.453 ( -18.687 -8.392 -0.213) 20.486 4.776 ( 6.160 2.099 -13.540) 15.023 4.970 ( 31.115 2.632 11.736) 33.359 5.396 ( -2.276 0.816 14.095) 14.301 5.580 ( 5.786 2.381 -6.301) 8.880 7.006 ( -9.790 2.264 12.932) 16.377 7.199 ( -10.916 7.223 -2.360) 13.300 7.420 ( -4.726 -4.013 -10.049) 11.808 7.648 ( 8.985 6.387 -7.378) 13.265 10.378 ( -1.895 -0.890 12.888) 13.057 10.587 ( 4.743 -1.805 -13.217) 14.158 11.127 ( -15.608 2.968 8.160) 17.861 11.528 ( 15.904 4.372 -5.374) 17.348 13.050 ( -6.816 -3.699 -6.471) 10.100 13.123 ( 7.872 -7.978 6.863) 13.142 13.720 ( -1.679 -6.767 -0.354) 6.981 13.763 ( 2.653 -9.663 -0.751) 10.049 14.855 ( -3.184 5.968 0.522) 6.784 14.977 ( 7.861 8.646 -0.766) 11.711 16.327 ( -6.603 2.753 8.863) 11.390 16.602 ( 9.765 -1.772 -12.189) 15.718 20.753 ( -1.454 1.265 1.792) 2.632 20.791 ( -0.088 0.346 -2.470) 2.496 21.837 ( -0.019 -0.331 1.332) 1.372 21.852 ( -0.063 -0.870 -1.474) 1.713 24.941 ( -2.010 0.030 8.534) 8.767 25.066 ( 2.095 -0.208 -7.069) 7.376 32.569 ( -1.887 -0.792 -1.135) 2.340 32.586 ( 0.509 -0.820 0.535) 1.103 43.800 ( -7.803 7.835 29.769) 31.756 44.218 ( 1.741 13.946 -27.623) 30.993 45.089 ( -6.447 -7.407 4.425) 10.771 45.275 ( 5.695 -16.875 -9.208) 20.050 ======================= Grid point 661 (337/355) ======================= q-point: (-0.33 -0.50 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.085 ( -17.156 -4.437 -1.511) 17.785 3.585 ( 6.818 -3.903 1.231) 7.952 4.007 ( -25.279 -0.157 -11.449) 27.751 4.475 ( -13.446 -6.693 13.382) 20.116 4.758 ( -1.378 1.264 -11.882) 12.028 5.141 ( 22.166 14.122 7.592) 27.357 5.504 ( 4.011 -8.098 9.690) 13.250 5.644 ( 14.116 -2.528 -0.987) 14.374 6.786 ( -21.973 2.418 -2.223) 22.217 7.114 ( -4.409 1.072 13.929) 14.649 7.379 ( -0.262 3.750 -6.873) 7.834 7.558 ( 4.406 3.937 -7.865) 9.837 10.431 ( -1.654 -0.731 11.287) 11.431 10.622 ( 4.143 -2.380 -10.300) 11.354 10.952 ( -11.918 4.308 4.029) 13.298 11.570 ( 15.659 6.893 -2.830) 17.342 12.921 ( -12.471 4.120 -5.916) 14.405 13.387 ( 10.798 -4.399 7.500) 13.864 13.879 ( -3.647 -14.435 4.682) 15.607 14.077 ( 7.930 -20.106 -2.883) 21.805 14.724 ( 0.491 6.023 -3.547) 7.007 14.873 ( 7.836 10.194 0.730) 12.878 16.254 ( -7.492 3.083 11.989) 14.470 16.647 ( 10.147 1.897 -14.366) 17.690 20.706 ( -3.359 1.486 0.207) 3.679 20.788 ( 0.197 -0.674 -0.157) 0.720 21.807 ( -2.139 0.957 -2.269) 3.262 21.900 ( 2.428 -1.832 1.194) 3.268 24.958 ( -1.980 0.261 8.603) 8.832 25.063 ( 2.567 -0.497 -7.151) 7.614 32.560 ( -2.530 -1.238 -1.215) 3.068 32.606 ( -0.431 -1.336 0.353) 1.447 43.663 ( -9.884 13.238 14.089) 21.713 43.842 ( -2.325 14.375 -11.468) 18.535 45.156 ( -13.276 -10.548 0.862) 16.978 45.650 ( 10.943 -21.525 -9.744) 26.039 ======================= Grid point 662 (338/355) ======================= q-point: (-0.25 -0.50 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.009 ( -14.765 -6.571 -1.895) 16.272 3.652 ( -3.564 4.989 -6.830) 9.178 3.819 ( -9.354 -11.884 -4.717) 15.842 4.443 ( -3.800 5.858 -5.181) 8.695 4.630 ( -12.321 -1.923 11.054) 16.664 5.134 ( 5.881 6.411 3.455) 9.361 5.760 ( 13.297 -9.333 1.481) 16.313 5.928 ( 12.024 -10.251 7.865) 17.650 6.509 ( -17.295 6.740 -0.318) 18.564 7.112 ( -0.228 2.178 -6.865) 7.206 7.283 ( -3.397 0.533 12.930) 13.379 7.584 ( 4.240 -4.480 -8.614) 10.595 10.458 ( -1.796 1.821 9.401) 9.743 10.595 ( -4.541 3.167 -1.592) 5.761 10.827 ( -1.936 0.390 -6.373) 6.672 11.593 ( 13.893 6.885 -0.389) 15.511 12.630 ( -16.007 10.201 -4.826) 19.585 13.448 ( 2.304 7.686 3.439) 8.730 14.172 ( 1.842 -15.491 6.028) 16.725 14.314 ( 6.677 2.455 -3.940) 8.132 14.850 ( 9.788 -20.473 -3.093) 22.902 14.866 ( 7.740 -0.057 3.761) 8.606 16.191 ( -6.839 2.183 12.111) 14.079 16.595 ( 6.902 6.923 -12.532) 15.894 20.656 ( -3.464 0.228 -0.170) 3.476 20.812 ( -0.147 -1.832 0.644) 1.947 21.748 ( -2.221 2.116 -2.209) 3.780 21.955 ( 2.776 -1.053 -0.146) 2.973 24.969 ( -2.286 0.574 8.529) 8.848 25.068 ( 2.965 -0.721 -7.126) 7.752 32.545 ( -2.984 -0.968 -1.285) 3.390 32.626 ( -0.921 -1.673 0.186) 1.919 43.276 ( -11.446 14.902 -12.861) 22.771 43.660 ( -3.282 10.014 17.542) 20.464 45.180 ( -15.873 -10.270 -2.349) 19.051 46.082 ( 13.135 -20.136 -10.347) 26.174 ======================= Grid point 663 (339/355) ======================= q-point: (-0.17 -0.50 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.995 ( -9.481 -7.139 -1.615) 11.978 3.450 ( -7.892 3.047 -11.622) 14.375 3.989 ( 7.962 -3.165 -1.372) 8.677 4.288 ( -4.925 -0.555 -2.046) 5.362 4.673 ( -11.092 -8.243 13.052) 19.009 5.074 ( -6.461 1.108 2.604) 7.053 6.073 ( 13.144 -4.545 1.186) 13.958 6.106 ( -2.299 3.376 4.838) 6.332 6.347 ( 2.823 -4.415 7.046) 8.780 7.004 ( 4.473 3.977 -16.429) 17.485 7.405 ( -8.242 -9.879 18.802) 22.782 7.680 ( 4.728 -6.484 -10.887) 13.525 10.368 ( -5.695 8.466 7.141) 12.454 10.506 ( -2.462 1.007 0.168) 2.666 10.807 ( 1.585 -0.701 -7.997) 8.182 11.614 ( 9.951 5.237 0.618) 11.262 12.237 ( -16.880 13.739 -3.962) 22.122 13.284 ( -2.940 9.993 0.341) 10.422 14.280 ( 7.450 4.479 -3.470) 9.360 14.402 ( 4.221 -3.748 5.799) 8.092 15.026 ( 6.798 -7.518 1.345) 10.224 15.367 ( 12.475 -23.480 -0.041) 26.589 16.167 ( -5.325 -0.029 11.778) 12.926 16.462 ( 2.579 7.369 -9.228) 12.088 20.630 ( -2.472 -0.618 0.131) 2.552 20.846 ( -0.553 -2.218 0.465) 2.333 21.680 ( -1.421 2.508 -1.721) 3.357 21.981 ( 1.726 0.328 -1.486) 2.301 24.971 ( -2.871 0.803 8.354) 8.870 25.080 ( 3.227 -0.810 -7.009) 7.759 32.521 ( -2.829 -0.433 -1.276) 3.134 32.645 ( -0.893 -1.595 0.126) 1.832 42.902 ( -9.881 9.896 -10.375) 17.413 43.557 ( -2.366 8.300 16.831) 18.914 45.167 ( -15.037 -8.570 -4.109) 17.789 46.458 ( 12.422 -14.447 -9.974) 21.506 ======================= Grid point 664 (340/355) ======================= q-point: (-0.08 -0.50 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.030 ( -4.608 -5.382 -0.521) 7.105 3.314 ( -4.827 0.326 -8.289) 9.598 3.968 ( 10.120 10.187 -5.100) 15.238 4.368 ( -7.782 -9.186 3.964) 12.675 4.760 ( -7.665 -4.408 12.820) 15.574 5.093 ( -8.396 -15.141 2.006) 17.429 5.814 ( 3.228 21.562 0.277) 21.804 6.337 ( 8.655 0.241 10.456) 13.576 6.543 ( 0.826 -10.662 3.041) 11.118 6.955 ( 4.933 -0.949 -12.875) 13.820 7.554 ( -10.790 -8.879 12.791) 18.944 7.784 ( 8.190 -4.947 -13.429) 16.489 10.225 ( -3.419 4.587 3.573) 6.745 10.481 ( -0.220 1.264 2.273) 2.610 10.791 ( 0.838 0.059 -6.547) 6.601 11.597 ( 1.577 5.154 -1.234) 5.529 11.870 ( -9.800 9.062 -1.422) 13.423 13.118 ( -1.263 6.575 0.061) 6.696 14.275 ( 3.255 1.585 -1.148) 3.798 14.481 ( 4.089 0.504 2.995) 5.094 15.185 ( 3.230 -4.286 -0.685) 5.410 15.804 ( 9.629 -13.479 0.793) 16.584 16.174 ( -1.803 0.737 8.709) 8.924 16.364 ( -0.451 0.777 -5.691) 5.762 20.625 ( -1.042 -0.553 0.621) 1.333 20.873 ( -0.721 -1.473 0.050) 1.641 21.630 ( -0.254 1.531 -1.014) 1.853 21.967 ( 0.028 1.168 -1.880) 2.213 24.963 ( -3.508 0.889 8.258) 9.017 25.094 ( 3.315 -0.823 -6.907) 7.705 32.496 ( -1.744 -0.029 -1.020) 2.021 32.660 ( -0.552 -0.991 0.102) 1.139 42.659 ( -6.456 5.564 -4.299) 9.545 43.504 ( 1.058 4.072 10.384) 11.204 45.134 ( -11.506 -5.440 -3.405) 13.175 46.701 ( 9.089 -6.291 -8.349) 13.852 ======================= Grid point 672 (341/355) ======================= q-point: (-0.42 -0.42 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 354 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.001 ( -20.058 -0.000 -1.199) 20.094 3.469 ( -1.833 -0.000 -1.692) 2.495 4.073 ( -22.020 -0.000 -11.142) 24.679 4.254 ( -10.512 -0.000 19.751) 22.374 4.765 ( 7.017 0.000 -15.345) 16.874 5.348 ( 13.921 0.000 13.501) 19.393 5.499 ( 15.676 0.000 10.811) 19.042 5.610 ( 6.490 0.000 -12.328) 13.932 6.833 ( -31.864 -0.000 2.360) 31.951 7.222 ( 0.026 0.000 -21.254) 21.254 7.303 ( -4.527 -0.000 26.255) 26.642 7.753 ( 4.362 0.000 -7.120) 8.350 10.431 ( 0.516 0.000 14.051) 14.060 10.549 ( 4.793 0.000 -14.724) 15.484 11.046 ( -13.862 -0.000 9.525) 16.819 11.704 ( 16.479 0.000 -4.755) 17.151 12.962 ( -0.673 -0.000 -4.296) 4.348 13.145 ( 7.040 0.000 5.962) 9.225 13.587 ( -2.407 -0.000 -3.846) 4.537 13.774 ( 4.086 0.000 5.619) 6.948 14.867 ( -2.935 -0.000 -0.984) 3.095 15.152 ( 9.837 0.000 -0.211) 9.839 16.326 ( -5.525 -0.000 5.753) 7.977 16.621 ( 9.268 0.000 -11.842) 15.037 20.761 ( -1.512 -0.000 1.802) 2.353 20.774 ( -1.299 -0.000 -2.569) 2.878 21.820 ( -1.307 -0.000 -2.849) 3.134 21.850 ( 0.488 0.000 2.701) 2.744 24.964 ( -1.372 -0.000 8.637) 8.745 25.054 ( 2.374 0.000 -7.134) 7.519 32.533 ( -2.560 -0.000 -1.358) 2.898 32.582 ( -0.494 -0.000 0.527) 0.722 43.905 ( -11.800 -0.000 30.031) 32.266 44.248 ( 1.850 0.000 -31.813) 31.867 44.989 ( -6.264 -0.000 -10.770) 12.460 45.069 ( -1.848 -0.000 5.093) 5.418 ======================= Grid point 673 (342/355) ======================= q-point: (-0.33 -0.42 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.814 ( -21.335 -3.565 -1.556) 21.687 3.419 ( -17.740 -7.858 -4.044) 19.819 3.829 ( -9.173 4.147 -6.713) 12.100 4.300 ( -10.814 -5.575 17.585) 21.384 4.778 ( 9.946 1.936 -13.183) 16.627 5.381 ( -9.222 0.096 4.413) 10.224 5.588 ( 10.410 2.312 -8.703) 13.765 5.767 ( 19.690 1.203 4.896) 20.325 6.529 ( -28.202 -0.770 5.968) 28.837 7.128 ( 0.104 1.930 -8.751) 8.962 7.401 ( -1.033 -0.435 19.007) 19.040 7.671 ( -0.268 6.124 -8.453) 10.442 10.493 ( 1.759 1.393 11.032) 11.258 10.564 ( 4.505 -3.026 -10.656) 11.958 10.935 ( -10.153 3.598 7.971) 13.400 11.812 ( 16.271 4.382 -3.254) 17.162 12.892 ( -4.023 5.894 -3.504) 7.950 13.349 ( 7.186 -12.604 4.819) 15.288 13.697 ( 1.812 -9.695 1.591) 9.990 13.885 ( 6.326 -8.619 4.627) 11.650 14.804 ( -0.909 4.100 -2.622) 4.951 15.141 ( 8.374 10.876 -1.148) 13.774 16.279 ( -6.221 2.003 8.607) 10.807 16.677 ( 9.294 -1.922 -14.771) 17.557 20.712 ( -2.525 2.571 -0.600) 3.653 20.770 ( -1.360 -0.922 0.405) 1.692 21.790 ( -1.615 0.473 -2.606) 3.102 21.885 ( 0.704 -2.123 1.837) 2.894 24.989 ( -0.926 0.449 8.671) 8.732 25.049 ( 2.744 -0.332 -7.144) 7.660 32.507 ( -2.891 -0.855 -1.321) 3.292 32.580 ( -1.476 -0.781 0.372) 1.711 43.817 ( -12.131 12.309 8.458) 19.241 43.971 ( -5.586 9.976 -10.123) 15.271 44.891 ( -11.550 -4.835 -4.555) 13.324 45.295 ( 1.595 -22.573 -5.502) 23.288 ======================= Grid point 674 (343/355) ======================= q-point: (-0.25 -0.42 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.700 ( -19.276 -8.486 -1.188) 21.095 3.362 ( -23.983 -13.458 -6.217) 28.195 3.701 ( -2.034 2.518 -0.599) 3.292 4.354 ( -12.034 -6.242 12.472) 18.421 4.736 ( 11.822 10.388 -8.859) 18.059 5.248 ( -9.167 5.164 0.888) 10.559 5.672 ( 3.865 -8.578 -8.637) 12.772 5.918 ( -0.319 -8.403 0.754) 8.443 6.394 ( -7.386 0.755 8.478) 11.269 7.086 ( -0.785 0.694 1.505) 1.835 7.427 ( 3.782 7.335 4.018) 9.180 7.566 ( 0.474 0.541 -0.325) 0.790 10.521 ( 2.464 1.300 2.809) 3.956 10.591 ( -3.112 1.177 3.316) 4.698 10.823 ( -0.965 3.521 -0.472) 3.681 11.855 ( 14.394 7.573 -1.258) 16.313 12.662 ( -8.819 11.361 -2.904) 14.672 13.558 ( 0.378 1.687 -0.333) 1.760 13.915 ( 3.010 -18.050 7.893) 19.929 14.278 ( 11.166 -16.174 1.543) 19.715 14.732 ( 5.193 -0.739 -3.144) 6.115 15.037 ( 7.111 7.975 0.822) 10.716 16.221 ( -6.181 2.600 10.261) 12.258 16.695 ( 7.292 2.521 -14.300) 16.249 20.643 ( -2.429 1.922 -0.424) 3.127 20.779 ( -1.451 -1.513 0.953) 2.303 21.747 ( -1.719 1.258 -2.232) 3.086 21.940 ( 0.771 -2.530 0.106) 2.647 25.006 ( -0.995 1.159 8.097) 8.240 25.055 ( 3.069 -0.617 -6.627) 7.329 32.489 ( -3.105 -1.155 -1.302) 3.559 32.584 ( -1.964 -1.612 0.275) 2.556 43.349 ( -13.104 17.435 -19.226) 29.075 43.821 ( -10.770 6.474 20.811) 24.311 44.857 ( -13.726 -8.354 -4.290) 16.631 45.726 ( 5.778 -27.502 -10.990) 30.174 ======================= Grid point 675 (344/355) ======================= q-point: (-0.17 -0.42 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.718 ( -12.422 -12.340 1.128) 17.546 3.315 ( -12.712 -6.013 -8.381) 16.371 3.733 ( -8.458 -12.201 6.517) 16.214 4.401 ( -11.792 -9.795 5.110) 16.159 4.607 ( 15.454 16.771 -5.476) 23.454 5.054 ( -10.731 6.442 3.462) 12.986 5.874 ( -0.381 -17.942 -7.644) 19.506 6.108 ( -8.486 -19.753 -2.500) 21.643 6.361 ( 6.534 8.920 6.279) 12.716 7.079 ( -0.832 2.740 6.994) 7.557 7.347 ( 2.951 4.590 2.020) 5.819 7.624 ( 4.371 -3.069 -0.976) 5.429 10.464 ( -8.492 7.273 5.847) 12.617 10.529 ( 2.122 2.060 1.975) 3.556 10.813 ( 6.141 0.949 -4.821) 7.864 11.836 ( 9.976 9.024 0.339) 13.457 12.326 ( -10.671 15.270 -1.989) 18.734 13.398 ( -4.992 9.221 -3.568) 11.075 14.282 ( 1.503 -14.157 5.721) 15.343 14.369 ( 0.084 3.711 -2.936) 4.733 15.061 ( 8.215 -1.217 2.059) 8.556 15.137 ( 19.795 -23.227 3.228) 30.688 16.174 ( -4.363 1.255 8.316) 9.474 16.600 ( 3.807 8.364 -9.654) 13.328 20.606 ( -1.204 0.104 -0.169) 1.220 20.802 ( -1.228 -2.295 0.852) 2.738 21.696 ( -1.443 1.861 -1.573) 2.832 21.972 ( -0.426 -1.185 -1.534) 1.984 25.004 ( -1.727 1.626 7.617) 7.977 25.068 ( 3.259 -0.681 -6.235) 7.068 32.471 ( -2.973 -1.136 -1.304) 3.439 32.599 ( -1.812 -2.258 0.282) 2.909 42.901 ( -12.418 10.306 -14.775) 21.879 43.692 ( -11.757 6.176 18.206) 22.535 44.861 ( -11.717 -9.542 -2.921) 15.391 46.181 ( 7.453 -24.421 -13.420) 28.844 ======================= Grid point 676 (345/355) ======================= q-point: (-0.08 -0.42 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.837 ( -6.818 -10.939 3.081) 13.253 3.253 ( -2.699 -0.718 -5.713) 6.359 3.926 ( -14.005 -14.866 5.617) 21.182 4.464 ( 14.349 13.173 -0.431) 19.484 4.543 ( -3.053 -15.785 -0.066) 16.078 4.897 ( -8.337 2.477 6.454) 10.830 6.159 ( 1.743 -18.612 -11.881) 22.150 6.232 ( 7.760 16.141 -0.788) 17.927 6.344 ( -11.129 -17.155 5.228) 21.107 7.027 ( -0.376 6.261 8.265) 10.375 7.384 ( -2.029 -4.571 8.906) 10.214 7.731 ( 8.128 -4.783 -9.104) 13.108 10.285 ( -6.642 6.741 4.830) 10.625 10.523 ( 2.188 1.753 0.039) 2.804 10.832 ( 6.791 2.709 -2.962) 7.888 11.739 ( 1.452 10.664 -0.067) 10.763 11.975 ( -5.901 13.074 -0.106) 14.344 13.200 ( -2.091 6.672 -5.088) 8.647 14.277 ( -5.537 2.288 0.198) 5.994 14.432 ( -6.588 -5.250 2.916) 8.915 15.216 ( 10.487 -3.322 -0.018) 11.001 15.695 ( 17.070 -15.883 3.783) 23.621 16.189 ( -0.170 -2.985 4.741) 5.605 16.437 ( 2.427 9.591 -4.990) 11.081 20.609 ( 0.154 -0.900 0.040) 0.914 20.836 ( -0.469 -2.327 0.536) 2.434 21.646 ( -1.210 1.681 -0.785) 2.215 21.958 ( -2.127 0.116 -1.950) 2.888 24.989 ( -2.841 1.686 7.873) 8.538 25.084 ( 3.407 -0.687 -6.494) 7.366 32.460 ( -1.958 -1.275 -1.114) 2.589 32.623 ( -1.398 -2.285 0.276) 2.693 42.635 ( -7.893 3.473 -7.996) 11.760 43.562 ( -10.822 2.829 9.736) 14.829 44.919 ( -6.640 -8.550 1.506) 10.930 46.536 ( 5.958 -16.705 -13.511) 22.296 ======================= Grid point 685 (346/355) ======================= q-point: (-0.33 -0.33 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 355 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.550 ( -22.900 -0.000 -1.654) 22.960 3.078 ( -28.599 -0.000 -5.608) 29.144 3.775 ( -5.772 -0.000 -3.242) 6.620 4.252 ( -8.224 -0.000 17.848) 19.651 4.883 ( 18.645 0.000 -12.431) 22.410 5.236 ( -19.747 -0.000 -2.111) 19.860 5.568 ( 1.242 0.000 -16.677) 16.724 5.830 ( -22.986 -0.000 14.135) 26.984 6.482 ( 12.268 0.000 8.522) 14.938 7.120 ( 6.895 0.000 -17.291) 18.615 7.499 ( -2.766 -0.000 29.134) 29.265 7.626 ( -6.310 -0.000 -12.090) 13.638 10.518 ( 5.865 0.000 -15.141) 16.237 10.598 ( 0.262 0.000 15.892) 15.894 10.946 ( -2.718 -0.000 11.306) 11.628 12.002 ( 16.691 0.000 -2.637) 16.898 12.985 ( 4.872 0.000 -0.114) 4.873 13.239 ( -0.182 -0.000 -0.580) 0.608 13.681 ( 10.490 0.000 5.531) 11.859 13.893 ( 2.231 0.000 6.721) 7.081 14.813 ( -1.038 -0.000 -2.902) 3.082 15.323 ( 7.579 0.000 -1.936) 7.823 16.267 ( -6.106 -0.000 6.680) 9.050 16.657 ( 6.226 0.000 -16.519) 17.653 20.715 ( -2.162 -0.000 -2.225) 3.103 20.743 ( -1.818 -0.000 1.993) 2.698 21.766 ( -1.604 -0.000 -2.468) 2.944 21.876 ( -0.154 -0.000 2.052) 2.058 25.031 ( 0.234 0.000 8.769) 8.772 25.042 ( 3.055 0.000 -7.222) 7.842 32.466 ( -2.756 -0.000 -1.034) 2.943 32.555 ( -2.412 -0.000 0.285) 2.428 43.883 ( -7.122 -0.000 -39.119) 39.762 43.891 ( -16.237 -0.000 27.779) 32.176 44.711 ( -11.671 -0.000 -8.625) 14.513 45.026 ( -6.143 -0.000 3.312) 6.979 ======================= Grid point 686 (347/355) ======================= q-point: (-0.25 -0.33 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.362 ( -21.802 -5.768 -0.482) 22.558 2.860 ( -28.212 -11.640 -2.871) 30.654 3.693 ( -6.576 1.185 -0.669) 6.715 4.233 ( -12.377 -0.363 12.295) 17.449 5.004 ( 22.104 5.422 -8.722) 24.373 5.036 ( -27.108 -8.802 -4.626) 28.874 5.513 ( -4.639 -3.178 -10.468) 11.883 5.647 ( -24.684 -2.665 13.244) 28.139 6.604 ( 15.588 8.422 5.608) 18.584 7.114 ( 6.641 -1.093 -14.651) 16.123 7.519 ( -1.403 1.010 -11.203) 11.335 7.603 ( 0.484 0.922 24.093) 24.115 10.523 ( 5.356 -1.211 -13.388) 14.470 10.631 ( -5.496 1.508 14.483) 15.564 10.969 ( 8.343 7.125 10.963) 15.510 12.112 ( 15.741 5.490 -1.182) 16.713 12.833 ( -0.176 15.630 -0.076) 15.631 13.461 ( 3.301 -14.645 -1.582) 15.095 13.801 ( 3.239 -1.762 7.860) 8.682 14.119 ( 10.258 -16.649 6.365) 20.565 14.775 ( 1.874 1.413 -3.563) 4.267 15.264 ( 4.969 10.954 -2.291) 12.245 16.231 ( -6.861 0.814 8.999) 11.345 16.664 ( 3.421 -3.864 -17.893) 18.622 20.659 ( -1.783 2.396 -1.184) 3.212 20.746 ( -1.689 -0.997 1.552) 2.501 21.735 ( -1.654 0.508 -2.059) 2.690 21.901 ( -0.488 -2.133 0.928) 2.377 25.042 ( 3.145 -0.012 -6.004) 6.777 25.069 ( 1.036 0.972 7.383) 7.519 32.441 ( -2.500 -0.480 -0.754) 2.655 32.538 ( -2.849 -1.068 0.260) 3.054 43.400 ( -15.708 17.436 -30.540) 38.516 43.842 ( -17.613 1.510 21.864) 28.117 44.597 ( -12.148 -4.764 -4.537) 13.815 45.223 ( -3.699 -26.259 -5.359) 27.054 ======================= Grid point 687 (348/355) ======================= q-point: (-0.17 -0.33 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.364 ( -13.537 -15.457 4.519) 21.038 2.881 ( -20.056 -19.582 0.246) 28.031 3.603 ( -8.739 0.005 1.457) 8.859 4.132 ( -18.514 -3.359 3.553) 19.149 4.984 ( -16.422 -11.334 -4.796) 20.522 5.034 ( 17.971 11.135 -2.262) 21.261 5.467 ( -20.419 -7.345 18.781) 28.699 5.649 ( -3.706 -13.987 -15.387) 21.122 6.603 ( 6.768 6.321 3.848) 10.028 7.159 ( 8.464 -1.170 -10.112) 13.238 7.436 ( -0.492 4.103 -3.263) 5.266 7.695 ( 6.437 2.536 12.501) 14.288 10.515 ( 0.245 2.602 -4.014) 4.790 10.579 ( -4.158 2.714 5.621) 7.500 10.984 ( 13.385 8.734 8.027) 17.885 12.113 ( 11.680 10.748 0.509) 15.881 12.530 ( -3.428 18.247 0.598) 18.576 13.470 ( -4.237 7.086 -3.828) 9.100 14.066 ( 4.251 -15.687 3.637) 16.654 14.377 ( -2.670 -1.444 0.361) 3.057 15.002 ( 19.385 -19.025 4.117) 27.471 15.150 ( 5.032 4.037 -0.396) 6.463 16.187 ( -5.796 1.290 7.858) 9.849 16.656 ( 1.300 -0.324 -13.540) 13.606 20.608 ( -0.563 1.344 -0.690) 1.612 20.759 ( -1.269 -1.701 1.361) 2.521 21.697 ( -1.666 1.065 -1.398) 2.422 21.928 ( -1.625 -1.843 -0.741) 2.567 25.047 ( 2.597 0.480 -3.387) 4.295 25.083 ( 0.957 1.754 4.560) 4.979 32.422 ( -2.468 -0.645 -0.760) 2.662 32.541 ( -2.454 -2.235 0.373) 3.340 42.857 ( -16.723 11.082 -21.110) 29.122 43.694 ( -20.372 4.022 17.229) 26.982 44.597 ( -8.725 -9.150 -0.081) 12.643 45.674 ( 0.175 -32.479 -13.111) 35.026 ======================= Grid point 688 (349/355) ======================= q-point: (-0.08 -0.33 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.581 ( -5.955 -14.784 8.633) 18.126 3.077 ( -6.196 -17.064 0.157) 18.155 3.569 ( -14.926 -9.042 4.450) 18.010 4.109 ( -12.381 -16.115 -3.821) 20.678 4.940 ( 0.321 6.005 5.179) 7.936 4.991 ( 13.726 13.039 -0.635) 18.943 5.648 ( -24.688 -30.374 16.929) 42.645 5.819 ( 0.902 -16.491 -20.032) 25.962 6.555 ( 3.098 8.256 2.141) 9.074 7.198 ( 5.177 3.936 2.639) 7.018 7.362 ( -0.856 0.654 -2.731) 2.935 7.760 ( 8.863 2.294 0.862) 9.195 10.380 ( -5.728 8.638 6.931) 12.469 10.554 ( 2.166 0.411 -5.733) 6.143 11.015 ( 13.184 7.764 6.178) 16.501 11.986 ( 4.391 14.845 1.431) 15.547 12.188 ( -2.727 17.398 1.263) 17.655 13.272 ( -1.273 8.101 -6.710) 10.596 14.215 ( -10.818 -3.750 -2.479) 11.715 14.318 ( -5.036 1.834 5.272) 7.518 15.211 ( 6.278 -7.208 -0.311) 9.564 15.635 ( 23.091 -19.124 5.426) 30.469 16.156 ( -2.909 -0.478 2.381) 3.789 16.582 ( 2.296 4.887 -6.433) 8.399 20.600 ( 0.726 -0.488 -0.579) 1.049 20.793 ( -0.202 -2.659 0.891) 2.812 21.653 ( -2.000 1.479 -0.574) 2.553 21.918 ( -3.174 -0.539 -1.296) 3.470 25.036 ( -0.869 2.450 4.733) 5.400 25.084 ( 2.707 0.214 -3.510) 4.438 32.413 ( -1.765 -1.383 -0.770) 2.371 32.564 ( -1.958 -2.819 0.377) 3.453 42.542 ( -10.242 1.583 -11.898) 15.778 43.482 ( -20.893 2.569 8.246) 22.608 44.727 ( -3.065 -11.292 6.630) 13.449 46.130 ( 1.601 -27.865 -16.948) 32.654 ======================= Grid point 698 (350/355) ======================= q-point: (-0.25 -0.25 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 354 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.102 ( -21.009 -0.000 2.364) 21.141 2.436 ( -30.817 -0.000 0.360) 30.819 3.610 ( -10.586 -0.000 -0.085) 10.587 4.126 ( -21.927 -0.000 6.929) 22.996 4.592 ( -35.320 -0.000 1.950) 35.374 5.231 ( 17.292 0.000 -12.237) 21.184 5.413 ( 4.784 0.000 -7.645) 9.018 5.507 ( -18.654 -0.000 22.693) 29.376 6.881 ( 12.106 0.000 4.630) 12.961 6.950 ( -8.663 -0.000 -26.692) 28.063 7.531 ( 14.026 0.000 -13.921) 19.762 7.741 ( 1.826 0.000 26.210) 26.273 10.507 ( 6.734 0.000 -14.525) 16.010 10.639 ( -7.859 -0.000 13.907) 15.974 11.253 ( 18.653 0.000 16.002) 24.576 12.323 ( 16.814 0.000 -0.184) 16.815 13.147 ( 9.151 0.000 3.794) 9.906 13.226 ( 1.610 0.000 -2.237) 2.756 13.956 ( 7.651 0.000 7.336) 10.600 14.004 ( 3.049 0.000 8.325) 8.866 14.777 ( 1.521 0.000 -3.750) 4.047 15.398 ( 2.594 0.000 -4.949) 5.587 16.199 ( -8.042 -0.000 8.594) 11.770 16.518 ( -4.380 -0.000 -19.918) 20.394 20.657 ( -1.584 -0.000 -1.693) 2.319 20.733 ( -0.957 -0.000 2.060) 2.272 21.714 ( -1.591 -0.000 -1.592) 2.251 21.880 ( -0.972 -0.000 1.102) 1.469 25.045 ( 3.902 0.000 -7.058) 8.065 25.135 ( 2.287 0.000 7.852) 8.179 32.418 ( -1.328 -0.000 -0.027) 1.328 32.497 ( -3.425 -0.000 0.210) 3.431 43.211 ( -21.983 -0.000 -42.240) 47.618 43.760 ( -21.207 -0.000 24.768) 32.607 44.420 ( -11.225 -0.000 -2.719) 11.550 44.893 ( -9.088 -0.000 1.332) 9.185 ======================= Grid point 699 (351/355) ======================= q-point: (-0.17 -0.25 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.008 ( -15.359 -11.777 9.690) 21.645 2.351 ( -22.190 -19.045 4.926) 29.654 3.480 ( -15.622 -0.050 -0.590) 15.633 3.922 ( -26.690 -4.043 3.805) 27.261 4.353 ( -32.264 -11.589 0.220) 34.283 5.271 ( -5.965 -5.399 2.118) 8.319 5.367 ( -2.489 5.872 6.492) 9.101 5.609 ( 18.516 0.630 3.589) 18.872 6.669 ( -7.311 3.323 -17.406) 19.169 7.051 ( 3.250 -6.471 -8.523) 11.184 7.589 ( 14.984 6.127 -6.079) 17.292 7.872 ( 6.755 1.610 15.623) 17.097 10.517 ( 6.381 -0.549 -13.156) 14.632 10.603 ( -8.094 2.230 12.361) 14.943 11.423 ( 22.919 12.883 14.764) 30.153 12.419 ( 14.735 8.694 1.684) 17.191 12.879 ( 3.143 22.698 2.680) 23.071 13.477 ( 1.100 -4.318 -2.990) 5.366 13.965 ( 5.099 -2.269 4.918) 7.439 14.270 ( -0.283 -9.992 5.582) 11.449 14.900 ( 11.936 -12.914 0.437) 17.591 15.284 ( 0.956 7.842 -4.877) 9.284 16.158 ( -8.798 -0.437 7.981) 11.887 16.459 ( -7.904 -10.202 -16.429) 20.892 20.624 ( -0.447 1.360 -1.209) 1.874 20.738 ( -0.736 -0.472 1.746) 1.953 21.689 ( -1.474 0.555 -0.903) 1.815 21.883 ( -1.755 -1.147 0.120) 2.100 25.056 ( 4.316 -0.134 -6.716) 7.984 25.169 ( 1.758 2.738 6.772) 7.513 32.402 ( -1.166 0.671 0.124) 1.351 32.481 ( -2.773 -1.822 0.350) 3.336 42.708 ( -22.960 7.246 -29.177) 37.828 43.610 ( -24.417 3.615 18.922) 31.101 44.376 ( -8.083 -7.408 1.240) 11.034 45.059 ( -7.318 -27.657 -5.703) 29.171 ======================= Grid point 700 (352/355) ======================= q-point: (-0.08 -0.25 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.301 ( -3.378 -20.519 16.370) 26.465 2.611 ( -9.458 -27.392 8.068) 30.081 3.322 ( -19.592 -3.805 -1.230) 19.996 3.774 ( -13.962 -5.974 -4.572) 15.859 4.428 ( -29.729 -33.975 -1.315) 45.164 5.246 ( -2.723 7.982 18.980) 20.769 5.393 ( -7.916 -11.795 3.529) 14.637 5.756 ( 24.804 8.335 -3.558) 26.408 6.532 ( -9.906 -4.481 -11.232) 15.632 7.118 ( 2.434 -4.802 -14.178) 15.166 7.562 ( 8.862 11.285 5.998) 15.552 7.943 ( 9.840 5.095 2.495) 11.358 10.491 ( -3.900 5.870 5.528) 8.957 10.543 ( 1.641 0.069 -6.373) 6.581 11.449 ( 22.252 17.650 13.009) 31.239 12.323 ( 7.547 16.936 2.480) 18.706 12.522 ( 0.261 22.542 3.789) 22.860 13.395 ( 2.471 8.726 -5.875) 10.806 14.015 ( -10.801 -3.849 -3.033) 11.861 14.357 ( -1.325 2.424 6.632) 7.184 15.114 ( -1.066 -6.999 -1.508) 7.238 15.551 ( 24.538 -20.978 2.183) 32.357 16.116 ( -7.056 -1.094 2.680) 7.626 16.507 ( -5.197 -9.315 -8.558) 13.676 20.605 ( 0.906 0.469 -0.880) 1.347 20.756 ( -0.460 -1.803 0.964) 2.096 21.656 ( -1.597 1.344 0.058) 2.088 21.873 ( -2.988 -0.535 -0.521) 3.080 25.071 ( 4.164 0.244 -5.533) 6.929 25.140 ( -0.649 4.276 5.745) 7.191 32.382 ( -1.117 -0.089 -0.017) 1.121 32.498 ( -2.068 -2.614 0.318) 3.349 42.370 ( -12.475 -1.037 -14.914) 19.471 43.345 ( -25.613 4.756 9.879) 27.861 44.523 ( -3.048 -13.814 8.020) 16.261 45.505 ( -3.830 -35.126 -14.642) 38.248 ======================= Grid point 711 (353/355) ======================= q-point: (-0.17 -0.17 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 355 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.821 ( -14.667 -0.000 17.916) 23.154 1.951 ( -20.295 -0.000 11.369) 23.262 3.321 ( -17.572 -0.000 -1.620) 17.646 3.488 ( -39.238 -0.000 10.608) 40.646 4.075 ( -20.729 -0.000 -4.002) 21.112 5.070 ( -12.560 -0.000 -4.301) 13.276 5.471 ( -9.515 -0.000 24.394) 26.184 5.823 ( 22.050 0.000 -4.305) 22.466 6.496 ( 0.205 0.000 -34.942) 34.943 7.026 ( -1.259 -0.000 7.876) 7.976 7.796 ( 23.456 0.000 -16.327) 28.579 8.014 ( 3.529 0.000 18.060) 18.402 10.521 ( 7.615 0.000 -13.593) 15.581 10.597 ( -8.380 -0.000 12.437) 14.997 11.878 ( 28.796 0.000 12.275) 31.303 12.671 ( 16.353 0.000 3.420) 16.707 13.284 ( 6.702 0.000 -2.614) 7.194 13.359 ( 6.230 0.000 3.656) 7.224 14.001 ( -8.376 -0.000 1.810) 8.569 14.253 ( 15.757 0.000 11.219) 19.343 14.872 ( 9.982 0.000 0.010) 9.982 15.290 ( -7.817 -0.000 -12.248) 14.530 16.091 ( -11.490 -0.000 9.668) 15.017 16.128 ( -17.091 -0.000 -12.803) 21.355 20.628 ( 0.076 0.000 -1.041) 1.044 20.737 ( -0.519 -0.000 1.419) 1.511 21.680 ( -0.850 -0.000 -0.246) 0.884 21.857 ( -1.777 -0.000 0.050) 1.778 25.072 ( 4.987 0.000 -6.410) 8.121 25.243 ( 1.913 0.000 4.557) 4.942 32.414 ( 0.429 0.000 0.452) 0.623 32.432 ( -3.068 -0.000 0.330) 3.086 42.389 ( -22.654 -0.000 -25.239) 33.915 43.487 ( -27.162 -0.000 20.310) 33.916 44.232 ( -6.651 -0.000 0.875) 6.708 44.700 ( -10.150 -0.000 -0.747) 10.177 ======================= Grid point 712 (354/355) ======================= q-point: (-0.08 -0.17 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 648 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.988 ( -5.122 -20.783 26.019) 33.692 2.123 ( -7.083 -25.405 13.442) 29.602 3.063 ( -22.146 0.831 0.458) 22.166 3.418 ( -23.718 -18.050 7.956) 30.849 3.817 ( -19.261 -1.799 -8.873) 21.283 5.034 ( -16.131 -14.275 -2.093) 21.642 5.429 ( -6.494 5.862 20.150) 21.967 6.003 ( 7.272 -7.118 -7.170) 12.448 6.384 ( 13.629 7.799 -22.123) 27.129 7.053 ( -2.074 -1.563 3.356) 4.244 7.871 ( 16.963 9.232 -6.343) 20.327 8.104 ( 6.016 1.889 5.155) 8.145 10.537 ( 7.352 0.281 -12.225) 14.268 10.545 ( -8.442 2.505 10.762) 13.906 12.082 ( 29.880 15.864 9.671) 35.185 12.720 ( 11.332 15.364 6.002) 20.012 12.973 ( 2.005 27.962 3.991) 28.317 13.504 ( 7.007 -0.451 -4.312) 8.240 13.867 ( -13.857 2.145 -3.692) 14.500 14.478 ( 11.027 4.721 9.787) 15.481 14.948 ( -7.699 -4.599 -5.864) 10.715 15.417 ( 18.587 -24.392 -2.955) 30.809 15.958 ( -15.277 -4.776 -4.646) 16.666 16.147 ( -13.329 -14.769 4.169) 20.326 20.623 ( 1.198 0.701 -0.755) 1.580 20.736 ( -0.985 -0.241 0.820) 1.304 21.668 ( -0.266 0.872 0.663) 1.127 21.838 ( -2.409 -0.113 -0.468) 2.456 25.095 ( 5.370 0.146 -5.869) 7.956 25.231 ( -1.101 4.049 3.755) 5.631 32.386 ( -0.865 1.275 0.401) 1.592 32.444 ( -1.319 -1.843 0.120) 2.270 42.158 ( -7.734 -2.832 -11.810) 14.398 43.226 ( -28.691 6.115 13.500) 32.293 44.293 ( -3.322 -12.017 5.203) 13.510 44.843 ( -8.072 -27.257 -6.674) 29.200 ======================= Grid point 724 (355/355) ======================= q-point: (-0.08 -0.08 0.44) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 7.39e-05 7.39e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 354 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.869 ( -4.650 -0.000 31.179) 31.523 1.915 ( 2.022 0.000 19.869) 19.972 2.937 ( -16.223 -0.000 -2.723) 16.450 3.049 ( -14.480 -0.000 19.430) 24.232 3.609 ( -17.985 -0.000 -12.528) 21.918 4.651 ( -22.406 -0.000 -12.953) 25.881 5.479 ( -11.815 -0.000 22.459) 25.377 5.888 ( 5.470 0.000 -22.178) 22.842 6.632 ( 24.809 0.000 -9.562) 26.588 7.028 ( -7.019 -0.000 10.508) 12.637 8.115 ( 23.278 0.000 -17.618) 29.194 8.161 ( -3.656 -0.000 12.077) 12.618 10.527 ( -9.405 -0.000 10.864) 14.369 10.565 ( 8.891 0.000 -12.590) 15.413 12.552 ( 29.829 0.000 4.689) 30.195 13.012 ( 11.556 0.000 7.515) 13.785 13.413 ( -1.946 -0.000 0.417) 1.990 13.448 ( 8.035 0.000 0.023) 8.035 13.736 ( -10.539 -0.000 -5.756) 12.008 14.752 ( -21.310 -0.000 -14.459) 25.752 14.865 ( 23.725 0.000 4.103) 24.077 15.103 ( 8.995 0.000 4.059) 9.868 15.760 ( -12.665 -0.000 1.264) 12.728 15.912 ( -13.798 -0.000 7.102) 15.518 20.641 ( 1.762 0.000 -0.403) 1.808 20.726 ( -1.583 -0.000 0.390) 1.630 21.682 ( 0.800 0.000 1.013) 1.291 21.812 ( -2.293 -0.000 -0.864) 2.450 25.129 ( 5.994 0.000 -5.065) 7.847 25.258 ( -3.609 -0.000 1.653) 3.969 32.389 ( -1.465 -0.000 0.556) 1.566 32.420 ( -0.248 -0.000 -0.444) 0.509 42.096 ( 9.757 0.000 -4.356) 10.685 43.046 ( -32.408 -0.000 13.685) 35.179 44.173 ( -0.921 -0.000 2.855) 3.000 44.491 ( -8.732 -0.000 -2.651) 9.126 =================== 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 3/46656 10.0 771.276 1125.240 603.177 0.000 9.169 0.000 3/46656 20.0 283.980 370.132 200.499 0.000 -1.703 0.000 3/46656 30.0 145.897 167.165 79.874 0.000 5.472 0.000 3/46656 40.0 96.893 102.461 47.926 0.000 6.425 0.000 3/46656 50.0 72.739 73.306 34.881 0.000 5.776 0.000 3/46656 60.0 58.142 56.961 27.835 0.000 4.915 0.000 3/46656 70.0 48.136 46.384 23.275 0.000 4.135 0.000 3/46656 80.0 40.761 38.899 19.992 0.000 3.483 0.000 3/46656 90.0 35.096 33.303 17.478 0.000 2.951 0.000 3/46656 100.0 30.632 28.971 15.483 0.000 2.520 0.000 3/46656 110.0 27.052 25.535 13.863 0.000 2.173 0.000 3/46656 120.0 24.141 22.760 12.526 0.000 1.891 0.000 3/46656 130.0 21.742 20.484 11.407 0.000 1.661 0.000 3/46656 140.0 19.745 18.594 10.461 0.000 1.472 0.000 3/46656 150.0 18.064 17.006 9.653 0.000 1.315 0.000 3/46656 160.0 16.634 15.657 8.957 0.000 1.185 0.000 3/46656 170.0 15.408 14.501 8.353 0.000 1.074 0.000 3/46656 180.0 14.347 13.500 7.824 0.000 0.981 0.000 3/46656 190.0 13.422 12.628 7.358 0.000 0.900 0.000 3/46656 200.0 12.609 11.862 6.946 0.000 0.831 0.000 3/46656 210.0 11.890 11.185 6.579 0.000 0.770 0.000 3/46656 220.0 11.250 10.583 6.250 0.000 0.717 0.000 3/46656 230.0 10.678 10.044 5.954 0.000 0.670 0.000 3/46656 240.0 10.163 9.560 5.688 0.000 0.628 0.000 3/46656 250.0 9.698 9.123 5.446 0.000 0.590 0.000 3/46656 260.0 9.275 8.727 5.226 0.000 0.556 0.000 3/46656 270.0 8.891 8.367 5.026 0.000 0.525 0.000 3/46656 280.0 8.539 8.038 4.843 0.000 0.497 0.000 3/46656 290.0 8.216 7.737 4.676 0.000 0.472 0.000 3/46656 300.0 7.919 7.461 4.522 0.000 0.448 0.000 3/46656 310.0 7.645 7.206 4.380 0.000 0.427 0.000 3/46656 320.0 7.391 6.971 4.249 0.000 0.407 0.000 3/46656 330.0 7.156 6.753 4.128 0.000 0.388 0.000 3/46656 340.0 6.937 6.552 4.016 0.000 0.371 0.000 3/46656 350.0 6.732 6.364 3.911 0.000 0.355 0.000 3/46656 360.0 6.541 6.189 3.814 0.000 0.340 0.000 3/46656 370.0 6.363 6.026 3.724 0.000 0.325 0.000 3/46656 380.0 6.195 5.873 3.640 0.000 0.312 0.000 3/46656 390.0 6.037 5.730 3.560 0.000 0.299 0.000 3/46656 400.0 5.888 5.596 3.486 0.000 0.288 0.000 3/46656 410.0 5.748 5.470 3.417 0.000 0.276 0.000 3/46656 420.0 5.615 5.351 3.351 0.000 0.266 0.000 3/46656 430.0 5.490 5.238 3.289 0.000 0.256 0.000 3/46656 440.0 5.371 5.132 3.231 0.000 0.246 0.000 3/46656 450.0 5.257 5.031 3.175 0.000 0.237 0.000 3/46656 460.0 5.150 4.936 3.123 0.000 0.228 0.000 3/46656 470.0 5.047 4.845 3.073 0.000 0.220 0.000 3/46656 480.0 4.950 4.758 3.026 0.000 0.212 0.000 3/46656 490.0 4.856 4.676 2.980 0.000 0.205 0.000 3/46656 500.0 4.767 4.598 2.937 0.000 0.198 0.000 3/46656 510.0 4.681 4.522 2.896 0.000 0.191 0.000 3/46656 520.0 4.599 4.450 2.856 0.000 0.185 0.000 3/46656 530.0 4.521 4.382 2.818 0.000 0.178 0.000 3/46656 540.0 4.445 4.315 2.782 0.000 0.172 0.000 3/46656 550.0 4.373 4.252 2.746 0.000 0.167 0.000 3/46656 560.0 4.303 4.191 2.713 0.000 0.161 0.000 3/46656 570.0 4.235 4.132 2.680 0.000 0.156 0.000 3/46656 580.0 4.170 4.075 2.648 0.000 0.151 0.000 3/46656 590.0 4.108 4.020 2.618 0.000 0.147 0.000 3/46656 600.0 4.047 3.967 2.588 0.000 0.142 0.000 3/46656 610.0 3.989 3.916 2.559 0.000 0.138 0.000 3/46656 620.0 3.932 3.866 2.531 0.000 0.133 0.000 3/46656 630.0 3.877 3.818 2.504 0.000 0.129 0.000 3/46656 640.0 3.824 3.772 2.478 0.000 0.126 0.000 3/46656 650.0 3.772 3.727 2.452 0.000 0.122 0.000 3/46656 660.0 3.722 3.683 2.427 0.000 0.118 0.000 3/46656 670.0 3.674 3.640 2.403 0.000 0.115 0.000 3/46656 680.0 3.627 3.599 2.379 0.000 0.112 0.000 3/46656 690.0 3.581 3.558 2.356 0.000 0.108 0.000 3/46656 700.0 3.536 3.519 2.333 0.000 0.105 0.000 3/46656 710.0 3.493 3.481 2.311 0.000 0.102 0.000 3/46656 720.0 3.451 3.443 2.289 0.000 0.100 0.000 3/46656 730.0 3.410 3.407 2.268 0.000 0.097 0.000 3/46656 740.0 3.370 3.371 2.247 0.000 0.094 0.000 3/46656 750.0 3.330 3.337 2.227 0.000 0.092 0.000 3/46656 760.0 3.292 3.303 2.207 0.000 0.089 0.000 3/46656 770.0 3.255 3.270 2.187 0.000 0.087 0.000 3/46656 780.0 3.219 3.237 2.168 0.000 0.085 0.000 3/46656 790.0 3.183 3.205 2.149 0.000 0.083 0.000 3/46656 800.0 3.149 3.174 2.131 0.000 0.081 0.000 3/46656 810.0 3.115 3.144 2.113 0.000 0.079 0.000 3/46656 820.0 3.082 3.114 2.095 0.000 0.077 0.000 3/46656 830.0 3.050 3.085 2.077 0.000 0.075 0.000 3/46656 840.0 3.018 3.056 2.060 0.000 0.073 0.000 3/46656 850.0 2.987 3.028 2.043 0.000 0.071 0.000 3/46656 860.0 2.957 3.001 2.026 0.000 0.069 0.000 3/46656 870.0 2.927 2.974 2.010 0.000 0.068 0.000 3/46656 880.0 2.898 2.947 1.994 0.000 0.066 0.000 3/46656 890.0 2.870 2.921 1.978 0.000 0.065 0.000 3/46656 900.0 2.842 2.896 1.962 0.000 0.063 0.000 3/46656 910.0 2.814 2.871 1.947 0.000 0.062 0.000 3/46656 920.0 2.788 2.846 1.932 0.000 0.060 0.000 3/46656 930.0 2.761 2.822 1.917 0.000 0.059 0.000 3/46656 940.0 2.736 2.798 1.902 0.000 0.058 0.000 3/46656 950.0 2.710 2.775 1.887 0.000 0.057 0.000 3/46656 960.0 2.686 2.752 1.873 0.000 0.055 0.000 3/46656 970.0 2.661 2.730 1.859 0.000 0.054 0.000 3/46656 980.0 2.637 2.707 1.845 0.000 0.053 0.000 3/46656 990.0 2.614 2.686 1.831 0.000 0.052 0.000 3/46656 1000.0 2.591 2.664 1.818 0.000 0.051 0.000 3/46656 Thermal conductivity related properties were written into "kappa-m12129.hdf5". Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-07 19:24:40]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|