----------------------------- ------- calculate fc2 ------- ----------------------------- _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1 -------------------------[time 2026-01-07 20:39:49]------------------------- Compiled with OpenMP support (max 128 threads). Running in phonopy.load mode. Python version 3.14.2 Spglib version 2.6.1 Crystal structure was read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". Unit of length: angstrom Settings: Supercell: [2 1 2] Primitive matrix: [0.5 0.5 0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/m (12) Number of symmetry operations in supercell: 32 ------------------------------ primitive cell ------------------------------ Lattice vectors: a 2.511485705000247 -4.337058665000000 0.000000000000000 b 2.511485705000247 4.337058665000000 0.000000000000000 c -1.699738123698862 0.000000000000000 4.693434515384179 Atomic positions (fractional): *1 Li 0.33365372129767 0.66634627870233 0.00000000000000 6.941 2 Li 0.66634627870233 0.33365372129767 0.00000000000000 6.941 *3 Li 0.50000000000000 0.50000000000000 0.50000000000000 6.941 *4 Li 0.17715969137545 0.82284030862455 0.50000000000000 6.941 5 Li 0.82284030862455 0.17715969137545 0.50000000000000 6.941 *6 O 0.38657558150494 0.07780011998929 0.23509233672467 15.999 7 O 0.07780011998929 0.38657558150494 0.23509233672467 15.999 8 O 0.92219988001071 0.61342441849506 0.76490766327533 15.999 9 O 0.61342441849506 0.92219988001071 0.76490766327533 15.999 *10 O 0.23007859846314 0.23007859846314 0.77059257452623 15.999 11 O 0.76992140153686 0.76992140153686 0.22940742547377 15.999 *12 Re 0.00000000000000 0.00000000000000 0.00000000000000 186.207 -------------------------------- unit cell --------------------------------- Lattice vectors: a 5.022971410000494 0.000000000000000 0.000000000000000 b 0.000000000000000 8.674117330000000 0.000000000000000 c -1.699738123698862 0.000000000000000 4.693434515384179 Atomic positions (fractional): *1 Li 0.50000000000000 0.16634627870233 0.00000000000000 6.941 > 1 2 Li 0.50000000000000 0.83365372129767 0.00000000000000 6.941 > 2 *3 Li 0.50000000000000 0.00000000000000 0.50000000000000 6.941 > 3 *4 Li 0.50000000000000 0.32284030862455 0.50000000000000 6.941 > 4 5 Li 0.50000000000000 0.67715969137545 0.50000000000000 6.941 > 5 6 Li 0.00000000000000 0.66634627870233 0.00000000000000 6.941 > 1 7 Li 0.00000000000000 0.33365372129767 0.00000000000000 6.941 > 2 8 Li 0.00000000000000 0.50000000000000 0.50000000000000 6.941 > 3 9 Li 0.00000000000000 0.82284030862455 0.50000000000000 6.941 > 4 10 Li 0.00000000000000 0.17715969137545 0.50000000000000 6.941 > 5 *11 O 0.23218785074712 0.84561226924218 0.23509233672467 15.999 > 6 12 O 0.23218785074712 0.15438773075782 0.23509233672467 15.999 > 7 13 O 0.76781214925288 0.84561226924218 0.76490766327533 15.999 > 8 14 O 0.76781214925288 0.15438773075782 0.76490766327533 15.999 > 9 *15 O 0.23007859846314 0.00000000000000 0.77059257452623 15.999 > 10 16 O 0.76992140153686 0.00000000000000 0.22940742547377 15.999 > 11 17 O 0.73218785074712 0.34561226924218 0.23509233672467 15.999 > 6 18 O 0.73218785074712 0.65438773075782 0.23509233672467 15.999 > 7 19 O 0.26781214925288 0.34561226924218 0.76490766327533 15.999 > 8 20 O 0.26781214925288 0.65438773075782 0.76490766327533 15.999 > 9 21 O 0.73007859846314 0.50000000000000 0.77059257452623 15.999 > 10 22 O 0.26992140153686 0.50000000000000 0.22940742547377 15.999 > 11 *23 Re 0.00000000000000 0.00000000000000 0.00000000000000 186.207 > 12 24 Re 0.50000000000000 0.50000000000000 0.00000000000000 186.207 > 12 -------------------------------- super cell -------------------------------- Lattice vectors: a 10.045942820000988 0.000000000000000 0.000000000000000 b 0.000000000000000 8.674117330000000 0.000000000000000 c -3.399476247397724 0.000000000000000 9.386869030768358 Atomic positions (fractional): *1 Li 0.25000000000000 0.16634627870233 0.00000000000000 6.941 > 1 2 Li 0.75000000000000 0.16634627870233 0.00000000000000 6.941 > 1 3 Li 0.25000000000000 0.16634627870233 0.50000000000000 6.941 > 1 4 Li 0.75000000000000 0.16634627870233 0.50000000000000 6.941 > 1 5 Li 0.25000000000000 0.83365372129767 0.00000000000000 6.941 > 2 6 Li 0.75000000000000 0.83365372129767 0.00000000000000 6.941 > 2 7 Li 0.25000000000000 0.83365372129767 0.50000000000000 6.941 > 2 8 Li 0.75000000000000 0.83365372129767 0.50000000000000 6.941 > 2 *9 Li 0.25000000000000 0.00000000000000 0.25000000000000 6.941 > 3 10 Li 0.75000000000000 0.00000000000000 0.25000000000000 6.941 > 3 11 Li 0.25000000000000 0.00000000000000 0.75000000000000 6.941 > 3 12 Li 0.75000000000000 0.00000000000000 0.75000000000000 6.941 > 3 *13 Li 0.25000000000000 0.32284030862455 0.25000000000000 6.941 > 4 14 Li 0.75000000000000 0.32284030862455 0.25000000000000 6.941 > 4 15 Li 0.25000000000000 0.32284030862455 0.75000000000000 6.941 > 4 16 Li 0.75000000000000 0.32284030862455 0.75000000000000 6.941 > 4 17 Li 0.25000000000000 0.67715969137545 0.25000000000000 6.941 > 5 18 Li 0.75000000000000 0.67715969137545 0.25000000000000 6.941 > 5 19 Li 0.25000000000000 0.67715969137545 0.75000000000000 6.941 > 5 20 Li 0.75000000000000 0.67715969137545 0.75000000000000 6.941 > 5 21 Li 0.00000000000000 0.66634627870233 0.00000000000000 6.941 > 1 22 Li 0.50000000000000 0.66634627870233 0.00000000000000 6.941 > 1 23 Li 0.00000000000000 0.66634627870233 0.50000000000000 6.941 > 1 24 Li 0.50000000000000 0.66634627870233 0.50000000000000 6.941 > 1 25 Li 0.00000000000000 0.33365372129767 0.00000000000000 6.941 > 2 26 Li 0.50000000000000 0.33365372129767 0.00000000000000 6.941 > 2 27 Li 0.00000000000000 0.33365372129767 0.50000000000000 6.941 > 2 28 Li 0.50000000000000 0.33365372129767 0.50000000000000 6.941 > 2 29 Li 0.00000000000000 0.50000000000000 0.25000000000000 6.941 > 3 30 Li 0.50000000000000 0.50000000000000 0.25000000000000 6.941 > 3 31 Li 0.00000000000000 0.50000000000000 0.75000000000000 6.941 > 3 32 Li 0.50000000000000 0.50000000000000 0.75000000000000 6.941 > 3 33 Li 0.00000000000000 0.82284030862455 0.25000000000000 6.941 > 4 34 Li 0.50000000000000 0.82284030862455 0.25000000000000 6.941 > 4 35 Li 0.00000000000000 0.82284030862455 0.75000000000000 6.941 > 4 36 Li 0.50000000000000 0.82284030862455 0.75000000000000 6.941 > 4 37 Li 0.00000000000000 0.17715969137545 0.25000000000000 6.941 > 5 38 Li 0.50000000000000 0.17715969137545 0.25000000000000 6.941 > 5 39 Li 0.00000000000000 0.17715969137545 0.75000000000000 6.941 > 5 40 Li 0.50000000000000 0.17715969137545 0.75000000000000 6.941 > 5 *41 O 0.11609392537356 0.84561226924218 0.11754616836234 15.999 > 6 42 O 0.61609392537356 0.84561226924218 0.11754616836234 15.999 > 6 43 O 0.11609392537356 0.84561226924218 0.61754616836234 15.999 > 6 44 O 0.61609392537356 0.84561226924218 0.61754616836234 15.999 > 6 45 O 0.11609392537356 0.15438773075782 0.11754616836234 15.999 > 7 46 O 0.61609392537356 0.15438773075782 0.11754616836234 15.999 > 7 47 O 0.11609392537356 0.15438773075782 0.61754616836234 15.999 > 7 48 O 0.61609392537356 0.15438773075782 0.61754616836234 15.999 > 7 49 O 0.38390607462644 0.84561226924218 0.38245383163766 15.999 > 8 50 O 0.88390607462644 0.84561226924218 0.38245383163766 15.999 > 8 51 O 0.38390607462644 0.84561226924218 0.88245383163766 15.999 > 8 52 O 0.88390607462644 0.84561226924218 0.88245383163766 15.999 > 8 53 O 0.38390607462644 0.15438773075782 0.38245383163766 15.999 > 9 54 O 0.88390607462644 0.15438773075782 0.38245383163766 15.999 > 9 55 O 0.38390607462644 0.15438773075782 0.88245383163766 15.999 > 9 56 O 0.88390607462644 0.15438773075782 0.88245383163766 15.999 > 9 *57 O 0.11503929923157 0.00000000000000 0.38529628726312 15.999 > 10 58 O 0.61503929923157 0.00000000000000 0.38529628726312 15.999 > 10 59 O 0.11503929923157 0.00000000000000 0.88529628726312 15.999 > 10 60 O 0.61503929923157 0.00000000000000 0.88529628726312 15.999 > 10 61 O 0.38496070076843 0.00000000000000 0.11470371273688 15.999 > 11 62 O 0.88496070076843 0.00000000000000 0.11470371273688 15.999 > 11 63 O 0.38496070076843 0.00000000000000 0.61470371273688 15.999 > 11 64 O 0.88496070076843 0.00000000000000 0.61470371273688 15.999 > 11 65 O 0.36609392537356 0.34561226924218 0.11754616836234 15.999 > 6 66 O 0.86609392537356 0.34561226924218 0.11754616836234 15.999 > 6 67 O 0.36609392537356 0.34561226924218 0.61754616836234 15.999 > 6 68 O 0.86609392537356 0.34561226924218 0.61754616836234 15.999 > 6 69 O 0.36609392537356 0.65438773075782 0.11754616836234 15.999 > 7 70 O 0.86609392537356 0.65438773075782 0.11754616836234 15.999 > 7 71 O 0.36609392537356 0.65438773075782 0.61754616836234 15.999 > 7 72 O 0.86609392537356 0.65438773075782 0.61754616836234 15.999 > 7 73 O 0.13390607462644 0.34561226924218 0.38245383163766 15.999 > 8 74 O 0.63390607462644 0.34561226924218 0.38245383163766 15.999 > 8 75 O 0.13390607462644 0.34561226924218 0.88245383163766 15.999 > 8 76 O 0.63390607462644 0.34561226924218 0.88245383163766 15.999 > 8 77 O 0.13390607462644 0.65438773075782 0.38245383163766 15.999 > 9 78 O 0.63390607462644 0.65438773075782 0.38245383163766 15.999 > 9 79 O 0.13390607462644 0.65438773075782 0.88245383163766 15.999 > 9 80 O 0.63390607462644 0.65438773075782 0.88245383163766 15.999 > 9 81 O 0.36503929923157 0.50000000000000 0.38529628726312 15.999 > 10 82 O 0.86503929923157 0.50000000000000 0.38529628726312 15.999 > 10 83 O 0.36503929923157 0.50000000000000 0.88529628726312 15.999 > 10 84 O 0.86503929923157 0.50000000000000 0.88529628726312 15.999 > 10 85 O 0.13496070076843 0.50000000000000 0.11470371273688 15.999 > 11 86 O 0.63496070076843 0.50000000000000 0.11470371273688 15.999 > 11 87 O 0.13496070076843 0.50000000000000 0.61470371273688 15.999 > 11 88 O 0.63496070076843 0.50000000000000 0.61470371273688 15.999 > 11 *89 Re 0.00000000000000 0.00000000000000 0.00000000000000 186.207 > 12 90 Re 0.50000000000000 0.00000000000000 0.00000000000000 186.207 > 12 91 Re 0.00000000000000 0.00000000000000 0.50000000000000 186.207 > 12 92 Re 0.50000000000000 0.00000000000000 0.50000000000000 186.207 > 12 93 Re 0.25000000000000 0.50000000000000 0.00000000000000 186.207 > 12 94 Re 0.75000000000000 0.50000000000000 0.00000000000000 186.207 > 12 95 Re 0.25000000000000 0.50000000000000 0.50000000000000 186.207 > 12 96 Re 0.75000000000000 0.50000000000000 0.50000000000000 186.207 > 12 ---------------------------------------------------------------------------- NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". --------------------------- Dielectric constant ---------------------------- 4.7540840 0.0000000 -0.0965552 0.0000000 4.6946120 0.0000000 -0.0965514 0.0000000 4.4449106 -------------------------- Born effective charges -------------------------- 1 Li 1.3076581 0.0000000 0.0392693 0.0000000 1.3042007 0.0000000 -0.0031494 0.0000000 0.3241531 2 Li 1.3076581 0.0000000 0.0392693 0.0000000 1.3042007 0.0000000 -0.0031494 0.0000000 0.3241531 3 Li 1.5139269 0.0000000 0.0873409 0.0000000 0.3947949 0.0000000 0.0854343 0.0000000 1.6383909 4 Li 0.7274604 0.0000000 -0.0401854 0.0000000 1.3016600 0.0000000 -0.0347388 0.0000000 1.6585570 5 Li 0.7274604 0.0000000 -0.0401854 0.0000000 1.3016600 0.0000000 -0.0347388 0.0000000 1.6585570 6 O -1.7058480 0.7269726 -0.5295038 0.6579394 -2.5505846 0.9086254 -0.4426586 0.7705478 -1.9756332 7 O -1.7058480 -0.7269726 -0.5295038 -0.6579394 -2.5505846 -0.9086254 -0.4426586 -0.7705478 -1.9756332 8 O -1.7058480 -0.7269726 -0.5295038 -0.6579394 -2.5505846 -0.9086254 -0.4426586 -0.7705478 -1.9756332 9 O -1.7058480 0.7269726 -0.5295038 0.6579394 -2.5505846 0.9086254 -0.4426586 0.7705478 -1.9756332 10 O -2.9163374 0.0000000 1.0396881 0.0000000 -1.2094852 0.0000000 0.9545296 0.0000000 -1.9911196 11 O -2.9163374 0.0000000 1.0396881 0.0000000 -1.2094852 0.0000000 0.9545296 0.0000000 -1.9911196 12 Re 7.0719028 0.0000000 -0.0468697 0.0000000 7.0147923 0.0000000 -0.1480827 0.0000000 6.2809609 ---------------------------------------------------------------------------- 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: 6444/6444 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 1438 Number of blocks in projector: 1438 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: 340 Use standard eigh solver. --- Eigsh_solver_block: 2 / 6 --- Block_size: 240 Use standard eigh solver. --- Eigsh_solver_block: 3 / 6 --- Block_size: 240 Use standard eigh solver. --- Eigsh_solver_block: 4 / 6 --- Block_size: 206 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 206 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 206 Use standard eigh solver. Tree of FC basis block matrices: - (1438, 1405), data: False |-- (206, 200), data: True |-- (206, 200), data: True |-- (206, 200), data: True |-- (240, 238), data: True |-- (240, 238), data: True |-- (340, 329), data: True ----- Solver_atoms: 1 -- 96 / 96 Time (Solver_compr_matrix_reshape): 0.003 Solver_block: 100 / 400 - Time: 1.598 Solver_block: 200 / 400 - Time: 1.626 Solver_block: 300 / 400 - Time: 1.615 Solver_block: 400 / 400 - Time: 1.616 Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 6.491 --------------------------------- Symfc end -------------------------------- Max drift of force constants: -0.00000000 (xx) -0.00000000 (xx) Permutation basis: 288/288 Permutation basis: 6444/6444 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 1438 Number of blocks in projector: 1438 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: 340 Use standard eigh solver. --- Eigsh_solver_block: 2 / 6 --- Block_size: 240 Use standard eigh solver. --- Eigsh_solver_block: 3 / 6 --- Block_size: 240 Use standard eigh solver. --- Eigsh_solver_block: 4 / 6 --- Block_size: 206 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 206 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 206 Use standard eigh solver. Tree of FC basis block matrices: - (1438, 1405), data: False |-- (206, 200), data: True |-- (206, 200), data: True |-- (206, 200), data: True |-- (240, 238), data: True |-- (240, 238), data: True |-- (340, 329), 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 20:40:09]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate fc3 ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-07 20:40:10]------------------------- Compiled with OpenMP support (max 128 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: force constants HDF5 data compression filter: gzip Crystal structure was read from "phono3py_mlp_eval_fc3_disp.yaml.xz". Supercell (dim): [2 1 2] Primitive matrix: [0.5 0.5 0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/m (12) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 2.511485705000247 -4.337058665000000 0.000000000000000 b 2.511485705000247 4.337058665000000 0.000000000000000 c -1.699738123698862 0.000000000000000 4.693434515384179 Atomic positions (fractional): 1 Li 0.33365372129767 0.66634627870233 0.00000000000000 6.941 2 Li 0.66634627870233 0.33365372129767 0.00000000000000 6.941 3 Li 0.50000000000000 0.50000000000000 0.50000000000000 6.941 4 Li 0.17715969137545 0.82284030862455 0.50000000000000 6.941 5 Li 0.82284030862455 0.17715969137545 0.50000000000000 6.941 6 O 0.38657558150494 0.07780011998929 0.23509233672467 15.999 7 O 0.07780011998929 0.38657558150494 0.23509233672467 15.999 8 O 0.92219988001071 0.61342441849506 0.76490766327533 15.999 9 O 0.61342441849506 0.92219988001071 0.76490766327533 15.999 10 O 0.23007859846314 0.23007859846314 0.77059257452623 15.999 11 O 0.76992140153686 0.76992140153686 0.22940742547377 15.999 12 Re 0.00000000000000 0.00000000000000 0.00000000000000 186.207 -------------------------------- supercell --------------------------------- Lattice vectors: a 10.045942820000988 0.000000000000000 0.000000000000000 b 0.000000000000000 8.674117330000000 0.000000000000000 c -3.399476247397724 0.000000000000000 9.386869030768358 Atomic positions (fractional): 1 Li 0.25000000000000 0.16634627870233 0.00000000000000 6.941 > 1 2 Li 0.75000000000000 0.16634627870233 0.00000000000000 6.941 > 1 3 Li 0.25000000000000 0.16634627870233 0.50000000000000 6.941 > 1 4 Li 0.75000000000000 0.16634627870233 0.50000000000000 6.941 > 1 5 Li 0.25000000000000 0.83365372129767 0.00000000000000 6.941 > 5 6 Li 0.75000000000000 0.83365372129767 0.00000000000000 6.941 > 5 7 Li 0.25000000000000 0.83365372129767 0.50000000000000 6.941 > 5 8 Li 0.75000000000000 0.83365372129767 0.50000000000000 6.941 > 5 9 Li 0.25000000000000 0.00000000000000 0.25000000000000 6.941 > 9 10 Li 0.75000000000000 0.00000000000000 0.25000000000000 6.941 > 9 11 Li 0.25000000000000 0.00000000000000 0.75000000000000 6.941 > 9 12 Li 0.75000000000000 0.00000000000000 0.75000000000000 6.941 > 9 13 Li 0.25000000000000 0.32284030862455 0.25000000000000 6.941 > 13 14 Li 0.75000000000000 0.32284030862455 0.25000000000000 6.941 > 13 15 Li 0.25000000000000 0.32284030862455 0.75000000000000 6.941 > 13 16 Li 0.75000000000000 0.32284030862455 0.75000000000000 6.941 > 13 17 Li 0.25000000000000 0.67715969137545 0.25000000000000 6.941 > 17 18 Li 0.75000000000000 0.67715969137545 0.25000000000000 6.941 > 17 19 Li 0.25000000000000 0.67715969137545 0.75000000000000 6.941 > 17 20 Li 0.75000000000000 0.67715969137545 0.75000000000000 6.941 > 17 21 Li 0.00000000000000 0.66634627870233 0.00000000000000 6.941 > 1 22 Li 0.50000000000000 0.66634627870233 0.00000000000000 6.941 > 1 23 Li 0.00000000000000 0.66634627870233 0.50000000000000 6.941 > 1 24 Li 0.50000000000000 0.66634627870233 0.50000000000000 6.941 > 1 25 Li 0.00000000000000 0.33365372129767 0.00000000000000 6.941 > 5 26 Li 0.50000000000000 0.33365372129767 0.00000000000000 6.941 > 5 27 Li 0.00000000000000 0.33365372129767 0.50000000000000 6.941 > 5 28 Li 0.50000000000000 0.33365372129767 0.50000000000000 6.941 > 5 29 Li 0.00000000000000 0.50000000000000 0.25000000000000 6.941 > 9 30 Li 0.50000000000000 0.50000000000000 0.25000000000000 6.941 > 9 31 Li 0.00000000000000 0.50000000000000 0.75000000000000 6.941 > 9 32 Li 0.50000000000000 0.50000000000000 0.75000000000000 6.941 > 9 33 Li 0.00000000000000 0.82284030862455 0.25000000000000 6.941 > 13 34 Li 0.50000000000000 0.82284030862455 0.25000000000000 6.941 > 13 35 Li 0.00000000000000 0.82284030862455 0.75000000000000 6.941 > 13 36 Li 0.50000000000000 0.82284030862455 0.75000000000000 6.941 > 13 37 Li 0.00000000000000 0.17715969137545 0.25000000000000 6.941 > 17 38 Li 0.50000000000000 0.17715969137545 0.25000000000000 6.941 > 17 39 Li 0.00000000000000 0.17715969137545 0.75000000000000 6.941 > 17 40 Li 0.50000000000000 0.17715969137545 0.75000000000000 6.941 > 17 41 O 0.11609392537356 0.84561226924218 0.11754616836234 15.999 > 41 42 O 0.61609392537356 0.84561226924218 0.11754616836234 15.999 > 41 43 O 0.11609392537356 0.84561226924218 0.61754616836234 15.999 > 41 44 O 0.61609392537356 0.84561226924218 0.61754616836234 15.999 > 41 45 O 0.11609392537356 0.15438773075782 0.11754616836234 15.999 > 45 46 O 0.61609392537356 0.15438773075782 0.11754616836234 15.999 > 45 47 O 0.11609392537356 0.15438773075782 0.61754616836234 15.999 > 45 48 O 0.61609392537356 0.15438773075782 0.61754616836234 15.999 > 45 49 O 0.38390607462644 0.84561226924218 0.38245383163766 15.999 > 49 50 O 0.88390607462644 0.84561226924218 0.38245383163766 15.999 > 49 51 O 0.38390607462644 0.84561226924218 0.88245383163766 15.999 > 49 52 O 0.88390607462644 0.84561226924218 0.88245383163766 15.999 > 49 53 O 0.38390607462644 0.15438773075782 0.38245383163766 15.999 > 53 54 O 0.88390607462644 0.15438773075782 0.38245383163766 15.999 > 53 55 O 0.38390607462644 0.15438773075782 0.88245383163766 15.999 > 53 56 O 0.88390607462644 0.15438773075782 0.88245383163766 15.999 > 53 57 O 0.11503929923157 0.00000000000000 0.38529628726312 15.999 > 57 58 O 0.61503929923157 0.00000000000000 0.38529628726312 15.999 > 57 59 O 0.11503929923157 0.00000000000000 0.88529628726312 15.999 > 57 60 O 0.61503929923157 0.00000000000000 0.88529628726312 15.999 > 57 61 O 0.38496070076843 0.00000000000000 0.11470371273688 15.999 > 61 62 O 0.88496070076843 0.00000000000000 0.11470371273688 15.999 > 61 63 O 0.38496070076843 0.00000000000000 0.61470371273688 15.999 > 61 64 O 0.88496070076843 0.00000000000000 0.61470371273688 15.999 > 61 65 O 0.36609392537356 0.34561226924218 0.11754616836234 15.999 > 41 66 O 0.86609392537356 0.34561226924218 0.11754616836234 15.999 > 41 67 O 0.36609392537356 0.34561226924218 0.61754616836234 15.999 > 41 68 O 0.86609392537356 0.34561226924218 0.61754616836234 15.999 > 41 69 O 0.36609392537356 0.65438773075782 0.11754616836234 15.999 > 45 70 O 0.86609392537356 0.65438773075782 0.11754616836234 15.999 > 45 71 O 0.36609392537356 0.65438773075782 0.61754616836234 15.999 > 45 72 O 0.86609392537356 0.65438773075782 0.61754616836234 15.999 > 45 73 O 0.13390607462644 0.34561226924218 0.38245383163766 15.999 > 49 74 O 0.63390607462644 0.34561226924218 0.38245383163766 15.999 > 49 75 O 0.13390607462644 0.34561226924218 0.88245383163766 15.999 > 49 76 O 0.63390607462644 0.34561226924218 0.88245383163766 15.999 > 49 77 O 0.13390607462644 0.65438773075782 0.38245383163766 15.999 > 53 78 O 0.63390607462644 0.65438773075782 0.38245383163766 15.999 > 53 79 O 0.13390607462644 0.65438773075782 0.88245383163766 15.999 > 53 80 O 0.63390607462644 0.65438773075782 0.88245383163766 15.999 > 53 81 O 0.36503929923157 0.50000000000000 0.38529628726312 15.999 > 57 82 O 0.86503929923157 0.50000000000000 0.38529628726312 15.999 > 57 83 O 0.36503929923157 0.50000000000000 0.88529628726312 15.999 > 57 84 O 0.86503929923157 0.50000000000000 0.88529628726312 15.999 > 57 85 O 0.13496070076843 0.50000000000000 0.11470371273688 15.999 > 61 86 O 0.63496070076843 0.50000000000000 0.11470371273688 15.999 > 61 87 O 0.13496070076843 0.50000000000000 0.61470371273688 15.999 > 61 88 O 0.63496070076843 0.50000000000000 0.61470371273688 15.999 > 61 89 Re 0.00000000000000 0.00000000000000 0.00000000000000 186.207 > 89 90 Re 0.50000000000000 0.00000000000000 0.00000000000000 186.207 > 89 91 Re 0.00000000000000 0.00000000000000 0.50000000000000 186.207 > 89 92 Re 0.50000000000000 0.00000000000000 0.50000000000000 186.207 > 89 93 Re 0.25000000000000 0.50000000000000 0.00000000000000 186.207 > 89 94 Re 0.75000000000000 0.50000000000000 0.00000000000000 186.207 > 89 95 Re 0.25000000000000 0.50000000000000 0.50000000000000 186.207 > 89 96 Re 0.75000000000000 0.50000000000000 0.50000000000000 186.207 > 89 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz". --------------------------- Dielectric constant ---------------------------- 4.7540840 0.0000000 -0.0965552 0.0000000 4.6946120 0.0000000 -0.0965514 0.0000000 4.4449106 -------------------------- Born effective charges -------------------------- 1 Li 1.3076581 0.0000000 0.0392693 0.0000000 1.3042007 0.0000000 -0.0031494 0.0000000 0.3241531 2 Li 1.3076581 0.0000000 0.0392693 0.0000000 1.3042007 0.0000000 -0.0031494 0.0000000 0.3241531 3 Li 1.5139269 0.0000000 0.0873409 0.0000000 0.3947949 0.0000000 0.0854343 0.0000000 1.6383909 4 Li 0.7274604 0.0000000 -0.0401854 0.0000000 1.3016600 0.0000000 -0.0347388 0.0000000 1.6585570 5 Li 0.7274604 0.0000000 -0.0401854 0.0000000 1.3016600 0.0000000 -0.0347388 0.0000000 1.6585570 6 O -1.7058480 0.7269726 -0.5295038 0.6579394 -2.5505846 0.9086254 -0.4426586 0.7705478 -1.9756332 7 O -1.7058480 -0.7269726 -0.5295038 -0.6579394 -2.5505846 -0.9086254 -0.4426586 -0.7705478 -1.9756332 8 O -1.7058480 -0.7269726 -0.5295038 -0.6579394 -2.5505846 -0.9086254 -0.4426586 -0.7705478 -1.9756332 9 O -1.7058480 0.7269726 -0.5295038 0.6579394 -2.5505846 0.9086254 -0.4426586 0.7705478 -1.9756332 10 O -2.9163374 0.0000000 1.0396881 0.0000000 -1.2094852 0.0000000 0.9545296 0.0000000 -1.9911196 11 O -2.9163374 0.0000000 1.0396881 0.0000000 -1.2094852 0.0000000 0.9545296 0.0000000 -1.9911196 12 Re 7.0719028 0.0000000 -0.0468697 0.0000000 7.0147923 0.0000000 -0.1480827 0.0000000 6.2809609 ---------------------------------------------------------------------------- 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] [-0.0034 0.0000 0.0094] [ 0.0034 0.0000 -0.0094] Computing fc3[ 9, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0034 0.0000 0.0094] [ 0.0034 0.0000 -0.0094] Computing fc3[ 13, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0034 0.0000 0.0094] [ 0.0034 0.0000 -0.0094] Computing fc3[ 41, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0034 0.0000 0.0094] [ 0.0034 0.0000 -0.0094] 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] [-0.0034 0.0000 0.0094] [ 0.0034 0.0000 -0.0094] Computing fc3[ 89, 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] [-0.0034 0.0000 0.0094] [ 0.0034 0.0000 -0.0094] Expanding fc3. Symmetrizing fc3 by traditional approach (N=3). Symmetrizing fc2 by traditional approach (N=3). Max drift of fc3: -0.00000004 (yyz) -0.00000004 (yyz) -0.00000004 (yzy) fc3 was written into "fc3.hdf5". Max drift of fc2: -0.00000008 (zx) -0.00000008 (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 20:40:25]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate LTC ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-07 20:40:25]------------------------- 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: conductivity-RTA HDF5 data compression filter: gzip Crystal structure was read from "phono3py.yaml". Supercell (dim): [2 1 2] Primitive matrix: [0.5 0.5 0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/m (12) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 2.511485705000247 -4.337058665000000 0.000000000000000 b 2.511485705000247 4.337058665000000 0.000000000000000 c -1.699738123698862 0.000000000000000 4.693434515384179 Atomic positions (fractional): 1 Li 0.33365372129767 0.66634627870233 0.00000000000000 6.941 2 Li 0.66634627870233 0.33365372129767 0.00000000000000 6.941 3 Li 0.50000000000000 0.50000000000000 0.50000000000000 6.941 4 Li 0.17715969137545 0.82284030862455 0.50000000000000 6.941 5 Li 0.82284030862455 0.17715969137545 0.50000000000000 6.941 6 O 0.38657558150494 0.07780011998929 0.23509233672467 15.999 7 O 0.07780011998929 0.38657558150494 0.23509233672467 15.999 8 O 0.92219988001071 0.61342441849506 0.76490766327533 15.999 9 O 0.61342441849506 0.92219988001071 0.76490766327533 15.999 10 O 0.23007859846314 0.23007859846314 0.77059257452623 15.999 11 O 0.76992140153686 0.76992140153686 0.22940742547377 15.999 12 Re 0.00000000000000 0.00000000000000 0.00000000000000 186.207 -------------------------------- supercell --------------------------------- Lattice vectors: a 10.045942820000988 0.000000000000000 0.000000000000000 b 0.000000000000000 8.674117330000000 0.000000000000000 c -3.399476247397724 0.000000000000000 9.386869030768358 Atomic positions (fractional): 1 Li 0.25000000000000 0.16634627870233 0.00000000000000 6.941 > 1 2 Li 0.75000000000000 0.16634627870233 0.00000000000000 6.941 > 1 3 Li 0.25000000000000 0.16634627870233 0.50000000000000 6.941 > 1 4 Li 0.75000000000000 0.16634627870233 0.50000000000000 6.941 > 1 5 Li 0.25000000000000 0.83365372129767 0.00000000000000 6.941 > 5 6 Li 0.75000000000000 0.83365372129767 0.00000000000000 6.941 > 5 7 Li 0.25000000000000 0.83365372129767 0.50000000000000 6.941 > 5 8 Li 0.75000000000000 0.83365372129767 0.50000000000000 6.941 > 5 9 Li 0.25000000000000 0.00000000000000 0.25000000000000 6.941 > 9 10 Li 0.75000000000000 0.00000000000000 0.25000000000000 6.941 > 9 11 Li 0.25000000000000 0.00000000000000 0.75000000000000 6.941 > 9 12 Li 0.75000000000000 0.00000000000000 0.75000000000000 6.941 > 9 13 Li 0.25000000000000 0.32284030862455 0.25000000000000 6.941 > 13 14 Li 0.75000000000000 0.32284030862455 0.25000000000000 6.941 > 13 15 Li 0.25000000000000 0.32284030862455 0.75000000000000 6.941 > 13 16 Li 0.75000000000000 0.32284030862455 0.75000000000000 6.941 > 13 17 Li 0.25000000000000 0.67715969137545 0.25000000000000 6.941 > 17 18 Li 0.75000000000000 0.67715969137545 0.25000000000000 6.941 > 17 19 Li 0.25000000000000 0.67715969137545 0.75000000000000 6.941 > 17 20 Li 0.75000000000000 0.67715969137545 0.75000000000000 6.941 > 17 21 Li 0.00000000000000 0.66634627870233 0.00000000000000 6.941 > 1 22 Li 0.50000000000000 0.66634627870233 0.00000000000000 6.941 > 1 23 Li 0.00000000000000 0.66634627870233 0.50000000000000 6.941 > 1 24 Li 0.50000000000000 0.66634627870233 0.50000000000000 6.941 > 1 25 Li 0.00000000000000 0.33365372129767 0.00000000000000 6.941 > 5 26 Li 0.50000000000000 0.33365372129767 0.00000000000000 6.941 > 5 27 Li 0.00000000000000 0.33365372129767 0.50000000000000 6.941 > 5 28 Li 0.50000000000000 0.33365372129767 0.50000000000000 6.941 > 5 29 Li 0.00000000000000 0.50000000000000 0.25000000000000 6.941 > 9 30 Li 0.50000000000000 0.50000000000000 0.25000000000000 6.941 > 9 31 Li 0.00000000000000 0.50000000000000 0.75000000000000 6.941 > 9 32 Li 0.50000000000000 0.50000000000000 0.75000000000000 6.941 > 9 33 Li 0.00000000000000 0.82284030862455 0.25000000000000 6.941 > 13 34 Li 0.50000000000000 0.82284030862455 0.25000000000000 6.941 > 13 35 Li 0.00000000000000 0.82284030862455 0.75000000000000 6.941 > 13 36 Li 0.50000000000000 0.82284030862455 0.75000000000000 6.941 > 13 37 Li 0.00000000000000 0.17715969137545 0.25000000000000 6.941 > 17 38 Li 0.50000000000000 0.17715969137545 0.25000000000000 6.941 > 17 39 Li 0.00000000000000 0.17715969137545 0.75000000000000 6.941 > 17 40 Li 0.50000000000000 0.17715969137545 0.75000000000000 6.941 > 17 41 O 0.11609392537356 0.84561226924218 0.11754616836234 15.999 > 41 42 O 0.61609392537356 0.84561226924218 0.11754616836234 15.999 > 41 43 O 0.11609392537356 0.84561226924218 0.61754616836234 15.999 > 41 44 O 0.61609392537356 0.84561226924218 0.61754616836234 15.999 > 41 45 O 0.11609392537356 0.15438773075782 0.11754616836234 15.999 > 45 46 O 0.61609392537356 0.15438773075782 0.11754616836234 15.999 > 45 47 O 0.11609392537356 0.15438773075782 0.61754616836234 15.999 > 45 48 O 0.61609392537356 0.15438773075782 0.61754616836234 15.999 > 45 49 O 0.38390607462644 0.84561226924218 0.38245383163766 15.999 > 49 50 O 0.88390607462644 0.84561226924218 0.38245383163766 15.999 > 49 51 O 0.38390607462644 0.84561226924218 0.88245383163766 15.999 > 49 52 O 0.88390607462644 0.84561226924218 0.88245383163766 15.999 > 49 53 O 0.38390607462644 0.15438773075782 0.38245383163766 15.999 > 53 54 O 0.88390607462644 0.15438773075782 0.38245383163766 15.999 > 53 55 O 0.38390607462644 0.15438773075782 0.88245383163766 15.999 > 53 56 O 0.88390607462644 0.15438773075782 0.88245383163766 15.999 > 53 57 O 0.11503929923157 0.00000000000000 0.38529628726312 15.999 > 57 58 O 0.61503929923157 0.00000000000000 0.38529628726312 15.999 > 57 59 O 0.11503929923157 0.00000000000000 0.88529628726312 15.999 > 57 60 O 0.61503929923157 0.00000000000000 0.88529628726312 15.999 > 57 61 O 0.38496070076843 0.00000000000000 0.11470371273688 15.999 > 61 62 O 0.88496070076843 0.00000000000000 0.11470371273688 15.999 > 61 63 O 0.38496070076843 0.00000000000000 0.61470371273688 15.999 > 61 64 O 0.88496070076843 0.00000000000000 0.61470371273688 15.999 > 61 65 O 0.36609392537356 0.34561226924218 0.11754616836234 15.999 > 41 66 O 0.86609392537356 0.34561226924218 0.11754616836234 15.999 > 41 67 O 0.36609392537356 0.34561226924218 0.61754616836234 15.999 > 41 68 O 0.86609392537356 0.34561226924218 0.61754616836234 15.999 > 41 69 O 0.36609392537356 0.65438773075782 0.11754616836234 15.999 > 45 70 O 0.86609392537356 0.65438773075782 0.11754616836234 15.999 > 45 71 O 0.36609392537356 0.65438773075782 0.61754616836234 15.999 > 45 72 O 0.86609392537356 0.65438773075782 0.61754616836234 15.999 > 45 73 O 0.13390607462644 0.34561226924218 0.38245383163766 15.999 > 49 74 O 0.63390607462644 0.34561226924218 0.38245383163766 15.999 > 49 75 O 0.13390607462644 0.34561226924218 0.88245383163766 15.999 > 49 76 O 0.63390607462644 0.34561226924218 0.88245383163766 15.999 > 49 77 O 0.13390607462644 0.65438773075782 0.38245383163766 15.999 > 53 78 O 0.63390607462644 0.65438773075782 0.38245383163766 15.999 > 53 79 O 0.13390607462644 0.65438773075782 0.88245383163766 15.999 > 53 80 O 0.63390607462644 0.65438773075782 0.88245383163766 15.999 > 53 81 O 0.36503929923157 0.50000000000000 0.38529628726312 15.999 > 57 82 O 0.86503929923157 0.50000000000000 0.38529628726312 15.999 > 57 83 O 0.36503929923157 0.50000000000000 0.88529628726312 15.999 > 57 84 O 0.86503929923157 0.50000000000000 0.88529628726312 15.999 > 57 85 O 0.13496070076843 0.50000000000000 0.11470371273688 15.999 > 61 86 O 0.63496070076843 0.50000000000000 0.11470371273688 15.999 > 61 87 O 0.13496070076843 0.50000000000000 0.61470371273688 15.999 > 61 88 O 0.63496070076843 0.50000000000000 0.61470371273688 15.999 > 61 89 Re 0.00000000000000 0.00000000000000 0.00000000000000 186.207 > 89 90 Re 0.50000000000000 0.00000000000000 0.00000000000000 186.207 > 89 91 Re 0.00000000000000 0.00000000000000 0.50000000000000 186.207 > 89 92 Re 0.50000000000000 0.00000000000000 0.50000000000000 186.207 > 89 93 Re 0.25000000000000 0.50000000000000 0.00000000000000 186.207 > 89 94 Re 0.75000000000000 0.50000000000000 0.00000000000000 186.207 > 89 95 Re 0.25000000000000 0.50000000000000 0.50000000000000 186.207 > 89 96 Re 0.75000000000000 0.50000000000000 0.50000000000000 186.207 > 89 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py.yaml". --------------------------- Dielectric constant ---------------------------- 4.7540840 0.0000000 -0.0965552 0.0000000 4.6946120 0.0000000 -0.0965514 0.0000000 4.4449106 -------------------------- Born effective charges -------------------------- 1 Li 1.3076581 0.0000000 0.0392693 0.0000000 1.3042007 0.0000000 -0.0031494 0.0000000 0.3241531 2 Li 1.3076581 0.0000000 0.0392693 0.0000000 1.3042007 0.0000000 -0.0031494 0.0000000 0.3241531 3 Li 1.5139269 0.0000000 0.0873409 0.0000000 0.3947949 0.0000000 0.0854343 0.0000000 1.6383909 4 Li 0.7274604 0.0000000 -0.0401854 0.0000000 1.3016600 0.0000000 -0.0347388 0.0000000 1.6585570 5 Li 0.7274604 0.0000000 -0.0401854 0.0000000 1.3016600 0.0000000 -0.0347388 0.0000000 1.6585570 6 O -1.7058480 0.7269726 -0.5295038 0.6579394 -2.5505846 0.9086254 -0.4426586 0.7705478 -1.9756332 7 O -1.7058480 -0.7269726 -0.5295038 -0.6579394 -2.5505846 -0.9086254 -0.4426586 -0.7705478 -1.9756332 8 O -1.7058480 -0.7269726 -0.5295038 -0.6579394 -2.5505846 -0.9086254 -0.4426586 -0.7705478 -1.9756332 9 O -1.7058480 0.7269726 -0.5295038 0.6579394 -2.5505846 0.9086254 -0.4426586 0.7705478 -1.9756332 10 O -2.9163374 0.0000000 1.0396881 0.0000000 -1.2094852 0.0000000 0.9545296 0.0000000 -1.9911196 11 O -2.9163374 0.0000000 1.0396881 0.0000000 -1.2094852 0.0000000 0.9545296 0.0000000 -1.9911196 12 Re 7.0719028 0.0000000 -0.0468697 0.0000000 7.0147923 0.0000000 -0.1480827 0.0000000 6.2809609 ---------------------------------------------------------------------------- fc3 was read from "fc3.hdf5". fc2 was read from "fc2.hdf5". ----------------------------- Force constants ------------------------------ Max drift of fc3: -0.00000004 (yyz) -0.00000004 (yyz) -0.00000004 (yzy) 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 11 ] fc3-r2q-transformation over three atoms: True --------------------------- Phonon calculations ---------------------------- Use NAC by Gonze et al. (no real space sum in current implementation) PRB 50, 13035(R) (1994), PRB 55, 10355 (1997) G-cutoff distance: 0.89, Number of G-points: 315, Lambda: 0.20 Running harmonic phonon calculations... -------------------- Lattice thermal conductivity (RTA) -------------------- ======================= Grid point 0 (1/433) ======================= 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 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 433 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 4.975 ( 0.000 0.000 0.000) 0.000 6.361 ( 0.000 0.000 0.000) 0.000 7.313 ( 0.000 0.000 0.000) 0.000 7.667 ( 0.000 0.000 0.000) 0.000 8.056 ( 0.000 0.000 0.000) 0.000 8.122 ( 0.000 0.000 0.000) 0.000 8.503 ( 0.000 0.000 0.000) 0.000 8.973 ( 0.000 0.000 0.000) 0.000 9.043 ( 0.000 0.000 0.000) 0.000 9.354 ( 0.000 0.000 0.000) 0.000 9.769 ( 0.000 0.000 0.000) 0.000 9.993 ( 0.000 0.000 0.000) 0.000 10.028 ( 0.000 0.000 0.000) 0.000 10.230 ( 0.000 0.000 0.000) 0.000 11.156 ( 0.000 0.000 0.000) 0.000 11.225 ( 0.000 0.000 0.000) 0.000 11.660 ( 0.000 0.000 0.000) 0.000 11.972 ( 0.000 0.000 0.000) 0.000 12.372 ( 0.000 0.000 0.000) 0.000 12.547 ( 0.000 0.000 0.000) 0.000 12.960 ( 0.000 0.000 0.000) 0.000 13.090 ( 0.000 0.000 0.000) 0.000 13.129 ( 0.000 0.000 0.000) 0.000 13.799 ( 0.000 0.000 0.000) 0.000 14.028 ( 0.000 0.000 0.000) 0.000 14.176 ( 0.000 0.000 0.000) 0.000 14.927 ( 0.000 0.000 0.000) 0.000 18.553 ( 0.000 0.000 0.000) 0.000 18.587 ( 0.000 0.000 0.000) 0.000 19.026 ( 0.000 0.000 0.000) 0.000 19.283 ( 0.000 0.000 0.000) 0.000 20.360 ( 0.000 0.000 0.000) 0.000 23.779 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 1 (2/433) ======================= 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 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.618 ( 17.906 -15.176 27.989) 36.528 0.749 ( 25.943 -19.405 20.709) 38.451 1.233 ( 50.908 -28.223 13.482) 59.749 5.492 ( 23.172 28.670 -30.447) 47.811 6.453 ( 6.393 3.113 8.139) 10.808 7.264 ( -3.645 -4.593 -9.863) 11.474 7.685 ( 5.956 2.548 -9.467) 11.472 8.107 ( 6.582 2.801 -0.072) 7.154 8.269 ( 8.582 -6.142 12.474) 16.339 8.475 ( -4.084 -0.280 1.409) 4.329 8.990 ( -22.563 -22.510 -18.053) 36.629 9.100 ( 2.800 11.411 6.974) 13.663 9.501 ( -3.254 -6.399 -0.581) 7.203 9.857 ( 0.588 -6.545 1.665) 6.779 9.896 ( -1.892 -3.281 -1.573) 4.101 10.243 ( 13.951 -1.857 5.881) 15.254 10.918 ( -10.074 12.318 41.182) 44.149 11.066 ( -10.650 9.680 1.046) 14.430 11.331 ( 1.225 8.185 3.685) 9.060 11.760 ( -10.545 -12.424 6.039) 17.379 12.317 ( -3.103 0.040 -8.005) 8.585 12.490 ( -5.764 -0.226 -0.273) 5.775 12.805 ( -16.104 -0.793 10.669) 19.333 12.944 ( 6.943 -15.442 -17.606) 24.426 13.191 ( 10.487 -1.580 -12.586) 16.459 13.755 ( 2.259 8.084 -8.745) 12.121 13.899 ( 3.275 -6.084 -9.394) 11.661 14.179 ( -1.918 -7.628 -6.881) 10.451 14.903 ( -2.737 0.922 1.306) 3.169 15.740 ( -5.653 23.563 59.173) 63.942 18.461 ( -3.981 4.682 -6.145) 8.691 19.152 ( 7.950 -2.724 3.139) 8.971 19.330 ( 1.941 -9.898 -2.109) 10.304 20.317 ( -2.889 1.954 -2.291) 4.173 22.990 ( 0.997 2.436 -6.786) 7.278 23.788 ( 1.878 -0.146 -2.514) 3.141 ======================= Grid point 2 (3/433) ======================= 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 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 794 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.216 ( 17.062 -14.263 27.202) 35.135 1.473 ( 24.990 -18.621 17.781) 35.880 2.356 ( 43.535 -24.205 12.713) 51.409 5.388 ( 6.012 13.663 -16.243) 22.060 6.632 ( 11.901 4.144 10.234) 16.234 7.208 ( -2.602 -9.387 -11.090) 14.761 7.688 ( 2.995 5.176 -4.865) 7.709 8.202 ( 8.810 6.223 0.926) 10.826 8.350 ( -10.800 1.565 -2.564) 11.210 8.590 ( 6.643 -8.980 10.069) 15.039 8.748 ( -4.546 -7.952 -1.668) 9.310 9.171 ( -3.540 -7.982 8.892) 12.462 9.500 ( 5.993 8.916 3.455) 11.285 9.790 ( -4.610 1.960 1.732) 5.300 10.030 ( 5.466 -3.995 -2.540) 7.231 10.541 ( 10.856 -2.054 11.241) 15.761 10.730 ( -14.644 10.668 1.848) 18.212 10.864 ( -7.347 7.486 21.719) 24.119 11.300 ( 1.268 5.989 1.848) 6.395 11.748 ( -4.606 -5.171 3.815) 7.906 12.204 ( -5.624 -4.206 -10.431) 12.574 12.343 ( -10.510 2.555 -0.268) 10.820 12.615 ( -15.632 -2.272 11.375) 19.466 13.104 ( 6.967 -8.738 -9.065) 14.390 13.275 ( 6.394 -1.940 -12.903) 14.530 13.640 ( -1.118 7.202 -5.062) 8.873 13.967 ( 4.238 -1.998 -4.391) 6.421 14.165 ( -4.390 -10.388 -9.594) 14.806 14.835 ( -5.064 1.699 1.944) 5.685 15.788 ( 3.231 16.266 26.620) 31.363 18.335 ( -0.263 3.945 -7.512) 8.490 19.260 ( 2.905 -2.023 -3.414) 4.918 19.552 ( 9.249 -13.862 1.516) 16.733 20.213 ( -6.218 2.287 2.078) 6.944 22.914 ( -3.677 5.637 1.446) 6.884 23.808 ( 2.612 -0.070 -4.371) 5.093 ======================= Grid point 3 (4/433) ======================= 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 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.778 ( 15.574 -13.039 25.348) 32.482 2.134 ( 22.338 -16.680 13.583) 31.012 3.262 ( 31.866 -18.052 10.925) 38.218 5.242 ( -0.610 8.579 -11.031) 13.988 6.823 ( 8.354 6.712 5.631) 12.105 7.257 ( 2.653 -7.524 -0.495) 7.994 7.616 ( 0.724 4.935 -5.963) 7.775 8.112 ( -11.056 -4.520 -8.389) 14.596 8.274 ( 6.797 8.307 1.284) 10.810 8.744 ( 5.289 -5.805 8.890) 11.862 8.969 ( 7.957 -3.617 5.411) 10.279 9.235 ( -4.542 -10.936 10.716) 15.971 9.557 ( 1.349 4.067 7.548) 8.680 9.723 ( 1.593 5.136 -5.429) 7.641 10.019 ( -5.675 7.013 6.172) 10.931 10.467 ( -3.758 -0.557 0.926) 3.910 10.765 ( -1.881 5.169 9.969) 11.386 10.880 ( 8.430 1.706 15.771) 17.964 11.282 ( 1.480 4.971 2.051) 5.577 11.724 ( -4.314 -0.518 -0.437) 4.367 12.043 ( -14.717 -8.613 -10.894) 20.235 12.192 ( -2.281 1.473 2.170) 3.476 12.461 ( -13.045 -1.735 9.305) 16.118 13.215 ( 5.212 -0.978 -5.803) 7.861 13.275 ( 0.542 -1.894 -10.396) 10.581 13.554 ( -0.239 0.782 -4.950) 5.017 13.994 ( 2.199 3.031 -5.532) 6.681 14.128 ( -5.262 -10.593 -7.979) 14.268 14.729 ( -6.601 2.068 1.624) 7.106 15.848 ( 5.986 13.149 14.494) 20.465 18.302 ( 4.405 0.853 -6.987) 8.304 19.273 ( 0.083 -2.291 -6.850) 7.224 19.803 ( 3.763 -5.312 0.512) 6.530 20.169 ( 0.392 -6.042 7.168) 9.383 22.774 ( -6.718 8.484 3.390) 11.340 23.818 ( 2.095 0.200 -5.286) 5.689 ======================= Grid point 4 (5/433) ======================= 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 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 794 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.274 ( 12.815 -11.047 21.138) 27.075 2.678 ( 17.296 -13.017 8.866) 23.392 3.882 ( 19.165 -11.356 8.382) 23.801 5.074 ( -3.622 6.744 -8.706) 11.593 6.790 ( -5.017 7.018 -1.317) 8.727 7.297 ( 0.492 5.374 3.288) 6.319 7.754 ( 14.568 -7.400 2.317) 16.503 7.988 ( -5.205 -7.754 -8.684) 12.753 8.310 ( 6.469 8.178 2.270) 10.672 8.954 ( 1.772 -3.624 10.997) 11.714 9.087 ( 10.551 2.510 -0.317) 10.850 9.263 ( -10.863 1.252 5.417) 12.203 9.484 ( -10.234 -2.944 -0.166) 10.651 9.700 ( 5.704 1.689 8.299) 10.211 10.027 ( 5.766 0.738 4.610) 7.419 10.494 ( 0.218 -3.557 -0.455) 3.593 10.714 ( -3.394 4.255 8.529) 10.118 11.110 ( 10.323 3.910 10.946) 15.546 11.281 ( 1.385 3.411 3.933) 5.387 11.586 ( -7.475 2.243 -5.446) 9.516 11.840 ( -11.365 -8.215 -9.031) 16.680 12.190 ( -4.166 -0.618 3.663) 5.582 12.363 ( -4.273 -2.592 7.318) 8.862 13.175 ( -1.430 2.894 -4.243) 5.331 13.287 ( 2.138 -2.314 -5.273) 6.142 13.553 ( 1.577 -4.180 -6.481) 7.872 13.909 ( -2.135 6.066 -6.568) 9.193 14.100 ( -4.267 -6.599 -3.864) 8.757 14.606 ( -6.338 1.638 0.403) 6.559 15.903 ( 5.554 9.573 7.692) 13.478 18.375 ( 7.668 -2.001 -5.428) 9.605 19.232 ( -1.423 -0.499 -6.389) 6.565 19.759 ( -6.863 2.117 1.019) 7.254 20.442 ( 10.937 -13.378 7.183) 18.714 22.575 ( -8.348 10.037 2.656) 13.323 23.810 ( 1.047 0.411 -4.964) 5.090 ======================= Grid point 5 (6/433) ======================= 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 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.641 ( 7.701 -6.926 12.771) 16.443 3.043 ( 9.649 -7.303 4.269) 12.832 4.243 ( 9.686 -6.325 5.944) 13.006 4.894 ( -4.617 5.657 -7.024) 10.132 6.599 ( -6.820 5.433 -1.247) 8.809 7.296 ( 1.604 1.586 0.650) 2.348 7.917 ( -0.248 -1.345 -2.863) 3.173 8.113 ( 8.488 -8.062 2.818) 12.040 8.386 ( 9.247 4.374 2.404) 10.508 8.971 ( -5.507 3.092 3.582) 7.261 9.006 ( -7.471 4.810 0.391) 8.894 9.232 ( -1.498 -2.067 1.593) 3.009 9.480 ( 7.672 -2.232 2.047) 8.248 9.881 ( 6.231 -3.049 7.969) 10.566 10.122 ( 2.249 -1.154 0.549) 2.587 10.462 ( -6.033 -0.631 -1.988) 6.383 10.688 ( -1.057 1.991 4.986) 5.472 11.231 ( 3.607 3.236 2.147) 5.300 11.317 ( 1.552 2.762 5.415) 6.273 11.482 ( 2.473 1.682 -0.982) 3.148 11.699 ( -9.556 -7.917 -7.125) 14.309 12.088 ( -6.997 1.419 2.210) 7.473 12.430 ( 2.131 -1.417 4.225) 4.940 13.140 ( -0.349 -0.371 2.725) 2.772 13.312 ( 2.853 -3.582 -7.393) 8.696 13.585 ( 0.692 -4.344 -4.999) 6.659 13.745 ( -4.262 9.739 -2.613) 10.947 14.065 ( -3.297 -3.295 -1.696) 4.960 14.509 ( -3.623 0.674 -0.525) 3.722 15.938 ( 3.208 5.091 3.283) 6.855 18.501 ( 6.829 -2.650 -3.312) 8.039 19.177 ( -1.262 0.659 -2.999) 3.320 19.627 ( -6.338 1.697 0.644) 6.593 20.772 ( 9.032 -10.022 4.540) 14.235 22.362 ( -6.924 8.139 1.040) 10.736 23.791 ( 0.272 0.338 -3.094) 3.125 ======================= Grid point 6 (7/433) ======================= 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 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 398 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.783 ( 0.000 -0.000 0.000) 0.000 3.173 ( 0.000 -0.000 0.000) 0.000 4.387 ( 0.000 -0.000 0.000) 0.000 4.784 ( 0.000 0.000 -0.000) 0.000 6.506 ( 0.000 -0.000 0.000) 0.000 7.306 ( 0.000 -0.000 0.000) 0.000 7.912 ( 0.000 0.000 0.000) 0.000 8.220 ( 0.000 -0.000 0.000) 0.000 8.491 ( 0.000 -0.000 0.000) 0.000 8.854 ( 0.000 -0.000 0.000) 0.000 8.970 ( 0.000 -0.000 0.000) 0.000 9.205 ( 0.000 -0.000 -0.000) 0.000 9.606 ( 0.000 -0.000 0.000) 0.000 9.994 ( 0.000 -0.000 0.000) 0.000 10.140 ( 0.000 -0.000 -0.000) 0.000 10.367 ( 0.000 -0.000 0.000) 0.000 10.688 ( 0.000 -0.000 0.000) 0.000 11.246 ( 0.000 -0.000 0.000) 0.000 11.325 ( 0.000 -0.000 0.000) 0.000 11.557 ( 0.000 0.000 0.000) 0.000 11.597 ( -0.000 -0.000 -0.000) 0.000 12.019 ( 0.000 -0.000 0.000) 0.000 12.466 ( 0.000 -0.000 0.000) 0.000 13.161 ( 0.000 -0.000 0.000) 0.000 13.359 ( 0.000 0.000 -0.000) 0.000 13.568 ( 0.000 -0.000 0.000) 0.000 13.643 ( 0.000 -0.000 0.000) 0.000 14.046 ( 0.000 -0.000 0.000) 0.000 14.474 ( 0.000 -0.000 -0.000) 0.000 15.950 ( 0.000 -0.000 0.000) 0.000 18.569 ( 0.000 0.000 0.000) 0.000 19.153 ( 0.000 -0.000 0.000) 0.000 19.560 ( 0.000 -0.000 -0.000) 0.000 20.923 ( 0.000 -0.000 0.000) 0.000 22.256 ( 0.000 -0.000 0.000) 0.000 23.781 ( 0.000 -0.000 0.000) 0.000 ======================= Grid point 14 (8/433) ======================= 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 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 432 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.170 ( 32.959 -0.000 4.988) 33.334 1.181 ( 21.744 -0.000 34.365) 40.666 2.108 ( 49.842 -0.000 20.677) 53.961 5.576 ( 1.112 -0.000 -25.462) 25.486 6.678 ( 12.886 -0.000 11.484) 17.261 7.108 ( -3.569 0.000 -11.956) 12.477 7.740 ( 4.239 -0.000 -4.566) 6.230 8.319 ( 14.691 -0.000 -0.649) 14.706 8.321 ( -10.409 0.000 -2.715) 10.757 8.482 ( 9.000 -0.000 17.725) 19.879 8.561 ( -12.202 0.000 -7.124) 14.129 9.151 ( -4.844 0.000 7.457) 8.892 9.612 ( 0.828 -0.000 17.809) 17.828 9.839 ( 1.379 -0.000 -2.186) 2.585 9.933 ( 10.718 -0.000 -5.695) 12.137 10.515 ( 12.680 -0.000 11.571) 17.166 10.863 ( -19.321 0.000 1.896) 19.414 10.916 ( -10.958 0.000 19.495) 22.364 11.430 ( -1.189 0.000 7.764) 7.855 11.618 ( -1.492 0.000 0.218) 1.508 12.179 ( -9.795 0.000 -7.438) 12.299 12.387 ( -6.957 0.000 1.539) 7.125 12.601 ( -16.269 0.000 11.171) 19.735 12.964 ( 12.086 -0.000 -10.665) 16.119 13.256 ( 7.707 -0.000 -14.374) 16.310 13.728 ( -6.337 0.000 -5.613) 8.465 13.927 ( 7.455 -0.000 -3.549) 8.256 14.061 ( -1.019 0.000 -10.670) 10.718 14.851 ( -5.059 0.000 1.591) 5.304 15.978 ( -5.350 0.000 33.034) 33.465 18.395 ( -0.837 0.000 -10.514) 10.547 19.240 ( -0.030 0.000 -6.821) 6.821 19.388 ( 14.736 -0.000 6.245) 16.005 20.238 ( -6.665 0.000 0.024) 6.665 22.975 ( -2.960 0.000 1.149) 3.175 23.807 ( 2.804 -0.000 -4.510) 5.311 ======================= Grid point 15 (9/433) ======================= 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 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.674 ( 23.998 2.466 21.101) 32.050 1.840 ( 25.952 -13.221 14.681) 32.616 3.003 ( 38.287 -7.467 16.535) 42.369 5.397 ( -3.119 5.631 -15.062) 16.380 6.944 ( 6.334 6.089 0.026) 8.787 7.089 ( 10.733 -8.009 3.337) 13.801 7.745 ( 0.618 5.735 -3.676) 6.841 8.019 ( -17.546 -4.315 -9.991) 20.647 8.414 ( 2.558 5.397 0.389) 5.986 8.619 ( 10.952 -5.452 3.802) 12.811 8.805 ( 10.128 -8.743 16.947) 21.592 9.134 ( -2.526 -0.462 8.048) 8.447 9.595 ( -9.506 0.337 9.906) 13.733 9.868 ( 3.695 6.907 0.205) 7.836 10.088 ( 6.779 -0.163 -3.006) 7.418 10.497 ( -14.992 2.696 4.640) 15.923 10.829 ( 4.089 2.100 10.085) 11.083 10.877 ( 0.968 -2.115 15.570) 15.743 11.418 ( 1.466 7.603 2.898) 8.268 11.635 ( -2.581 -6.388 0.424) 6.902 11.938 ( -13.830 -2.235 -7.467) 15.875 12.270 ( -5.680 3.936 2.613) 7.388 12.423 ( -12.932 -1.554 8.900) 15.775 13.124 ( 8.729 -4.702 -5.398) 11.289 13.270 ( 4.178 -0.195 -14.448) 15.041 13.561 ( -8.976 -0.095 -3.397) 9.598 13.994 ( -0.960 -2.385 -11.818) 12.094 14.028 ( 6.593 0.084 -3.846) 7.633 14.756 ( -7.236 0.706 2.085) 7.563 16.050 ( -0.415 6.263 18.469) 19.506 18.336 ( 3.499 1.758 -11.464) 12.114 19.207 ( -0.260 -3.205 -8.913) 9.476 19.709 ( 15.533 -3.020 6.375) 17.060 20.117 ( -8.109 -0.667 3.751) 8.959 22.895 ( -6.942 3.500 4.751) 9.111 23.821 ( 2.588 0.105 -5.872) 6.418 ======================= Grid point 16 (10/433) ======================= 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 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.156 ( 19.600 -0.899 19.783) 27.863 2.441 ( 22.382 -11.593 10.270) 27.219 3.682 ( 23.994 -8.253 11.228) 27.747 5.204 ( -4.305 6.031 -9.662) 12.176 6.871 ( -5.370 1.685 -5.591) 7.933 7.405 ( 4.694 5.271 5.638) 9.033 7.645 ( 7.379 -3.175 -1.583) 8.188 7.870 ( -2.042 -4.814 -5.762) 7.781 8.430 ( 3.148 3.153 2.650) 5.184 8.872 ( 7.266 -2.844 10.830) 13.349 9.101 ( 8.422 -3.183 4.745) 10.177 9.196 ( 0.714 -3.435 11.920) 12.425 9.437 ( -14.231 -2.037 -2.205) 14.544 9.764 ( -8.494 4.316 10.957) 14.520 10.124 ( 6.458 6.724 -1.783) 9.492 10.422 ( 0.341 -3.306 -0.863) 3.433 10.802 ( -3.152 3.941 9.024) 10.340 11.135 ( 8.436 -2.127 12.008) 14.828 11.371 ( -0.365 6.900 0.992) 6.981 11.595 ( -5.858 -0.883 -4.865) 7.665 11.734 ( -8.844 -3.723 -1.987) 9.799 12.197 ( -3.252 1.990 5.533) 6.720 12.318 ( -6.173 -2.548 7.155) 9.787 13.184 ( -1.589 -0.423 -10.915) 11.038 13.282 ( 5.644 -0.179 -2.410) 6.140 13.434 ( -5.555 -6.531 -6.463) 10.737 13.930 ( -0.726 -1.689 -10.826) 10.981 14.084 ( 3.713 2.670 -2.455) 5.191 14.629 ( -8.247 0.762 1.908) 8.499 16.069 ( 0.164 6.907 9.572) 11.804 18.354 ( 7.452 -0.347 -10.585) 12.950 19.175 ( -1.156 -4.185 -10.018) 10.918 19.851 ( -2.798 6.955 4.522) 8.755 20.209 ( 10.462 -10.914 9.124) 17.659 22.733 ( -10.332 5.980 4.482) 12.751 23.818 ( 1.681 0.424 -5.968) 6.214 ======================= Grid point 17 (11/433) ======================= 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 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.557 ( 14.286 -1.423 14.429) 20.355 2.908 ( 16.444 -6.948 6.608) 19.036 4.100 ( 11.692 -7.441 6.405) 15.267 5.019 ( -4.401 6.705 -7.536) 11.005 6.673 ( -11.152 2.226 -3.609) 11.931 7.337 ( 0.440 2.538 -4.576) 5.251 7.792 ( -1.714 -8.888 -7.619) 11.832 8.058 ( 17.001 1.788 10.973) 20.313 8.489 ( 5.425 3.057 4.148) 7.483 8.975 ( -5.105 -0.894 7.287) 8.942 9.078 ( -15.063 2.063 0.237) 15.205 9.214 ( -0.828 0.430 5.302) 5.384 9.422 ( 9.719 -3.390 4.471) 11.222 9.799 ( 2.300 -4.818 9.959) 11.300 10.148 ( 3.118 3.453 -2.412) 5.240 10.433 ( -2.484 -1.860 -1.706) 3.541 10.777 ( 1.125 5.810 3.736) 6.999 11.224 ( -8.446 -9.176 -3.904) 13.069 11.326 ( 2.926 6.240 1.388) 7.031 11.515 ( 0.040 0.554 -1.404) 1.510 11.677 ( 0.638 3.858 7.487) 8.446 12.115 ( -7.364 1.371 4.778) 8.885 12.399 ( 4.646 -2.050 7.233) 8.837 13.089 ( -2.978 -2.810 -5.866) 7.154 13.294 ( -0.764 0.386 -5.538) 5.603 13.448 ( 0.725 -9.225 -5.694) 10.865 13.872 ( 0.243 2.815 -6.651) 7.226 14.071 ( 0.293 4.187 0.115) 4.199 14.512 ( -5.930 -0.398 0.927) 6.015 16.038 ( -1.799 4.875 3.652) 6.351 18.450 ( 8.819 -2.453 -8.678) 12.613 19.130 ( -1.673 -4.205 -9.740) 10.740 19.725 ( -5.872 7.317 6.749) 11.557 20.586 ( 14.196 -9.018 8.839) 18.999 22.502 ( -12.304 6.074 2.169) 13.892 23.801 ( 0.864 0.656 -4.496) 4.625 ======================= Grid point 18 (12/433) ======================= 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 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.800 ( 7.453 1.864 4.486) 8.896 3.177 ( 7.897 0.181 3.154) 8.506 4.312 ( 2.560 -6.694 1.974) 7.433 4.854 ( -2.227 6.306 -4.761) 8.210 6.490 ( -6.782 -1.505 -2.088) 7.254 7.316 ( 0.808 0.944 -3.582) 3.791 7.810 ( 0.634 -8.439 -9.143) 12.458 8.240 ( -0.982 2.524 7.905) 8.356 8.598 ( 7.026 6.592 5.872) 11.283 8.823 ( -6.496 -3.474 -0.333) 7.374 8.948 ( -7.349 1.007 2.457) 7.814 9.226 ( 2.059 1.806 4.533) 5.296 9.586 ( -0.090 -2.083 1.919) 2.833 9.943 ( 1.551 -5.239 5.157) 7.513 10.148 ( 1.258 1.340 -0.003) 1.838 10.372 ( -0.542 0.555 -3.631) 3.713 10.764 ( 3.820 6.553 -2.790) 8.082 11.159 ( -6.992 -12.007 -5.998) 15.134 11.292 ( -0.901 3.439 -0.372) 3.575 11.497 ( -1.942 -1.585 -2.105) 3.273 11.777 ( 9.836 10.252 12.875) 19.173 12.030 ( -2.896 1.057 2.632) 4.054 12.487 ( 1.113 2.063 3.184) 3.954 13.108 ( -0.814 -5.623 2.457) 6.190 13.263 ( 3.162 -5.658 -10.859) 12.646 13.496 ( -1.417 -6.834 -4.241) 8.167 13.773 ( -3.281 9.303 2.007) 10.067 14.069 ( 3.841 2.398 1.180) 4.679 14.464 ( -1.519 -1.205 0.785) 2.092 15.963 ( -4.893 1.186 -0.192) 5.039 18.553 ( 5.096 -1.537 -5.693) 7.793 19.093 ( -1.063 -4.946 -8.779) 10.132 19.635 ( -1.555 6.346 8.049) 10.368 20.901 ( 9.782 -2.056 6.562) 11.957 22.271 ( -10.152 1.380 -0.223) 10.248 23.787 ( 0.492 0.534 -1.664) 1.816 ======================= Grid point 19 (13/433) ======================= 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 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.800 ( -0.012 8.934 -8.155) 12.096 3.191 ( -2.358 7.971 -1.042) 8.378 4.305 ( -6.780 -0.639 -4.943) 8.415 4.830 ( 3.746 -0.217 3.468) 5.109 6.475 ( 0.923 -7.059 -0.810) 7.165 7.280 ( -2.021 -0.033 -4.245) 4.702 7.857 ( 1.303 -6.874 -7.436) 10.210 8.167 ( -8.281 -2.426 3.577) 9.342 8.515 ( -7.279 16.405 4.069) 18.403 8.877 ( 6.154 -5.826 -1.397) 8.588 8.908 ( -0.073 -4.377 2.439) 5.011 9.266 ( -0.483 1.236 -1.555) 2.044 9.496 ( -7.909 -0.561 3.082) 8.506 9.926 ( -6.086 1.490 -6.507) 9.034 10.147 ( -0.626 0.611 1.613) 1.835 10.446 ( 6.594 -1.818 0.791) 6.886 10.741 ( 5.098 6.751 -7.920) 11.589 11.118 ( -7.817 -10.876 -6.814) 15.028 11.247 ( -1.215 0.617 -1.185) 1.806 11.476 ( 0.210 0.350 0.614) 0.738 11.902 ( 8.477 10.989 11.872) 18.264 12.062 ( 5.266 -1.171 0.356) 5.406 12.467 ( -0.262 2.849 -0.886) 2.995 13.107 ( -1.768 -2.613 -3.609) 4.793 13.363 ( 0.694 -1.887 -0.923) 2.212 13.533 ( 3.702 -10.349 -2.229) 11.215 13.662 ( -4.284 4.990 7.032) 9.628 14.155 ( 8.399 5.106 3.502) 10.435 14.487 ( 1.607 -1.720 1.443) 2.761 15.855 ( -8.086 -3.333 -2.789) 9.180 18.548 ( -2.424 2.191 -2.419) 4.065 19.102 ( 1.212 -6.046 -5.247) 8.096 19.659 ( 4.710 3.874 6.371) 8.819 20.963 ( -1.797 9.569 1.513) 9.853 22.203 ( -0.715 -8.095 -0.387) 8.136 23.789 ( 0.202 0.153 1.504) 1.525 ======================= Grid point 20 (14/433) ======================= 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 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.547 ( -5.143 16.313 -18.508) 25.202 2.941 ( -11.705 14.287 -6.365) 19.535 4.071 ( -13.120 7.196 -7.098) 16.562 4.965 ( 4.069 -4.274 7.586) 9.611 6.613 ( 3.750 -10.766 -0.977) 11.443 7.212 ( -3.210 -3.319 -5.558) 7.226 7.849 ( -3.812 0.549 -4.196) 5.695 8.109 ( -4.810 -5.362 1.522) 7.363 8.248 ( -6.452 13.238 6.393) 16.054 8.972 ( 2.977 -1.302 -2.419) 4.051 9.016 ( -7.713 -5.510 -4.314) 10.415 9.171 ( 4.803 -5.454 -1.008) 7.337 9.518 ( 4.850 0.401 3.248) 5.851 9.702 ( -10.869 2.316 -8.342) 13.896 10.100 ( -1.830 5.250 -4.067) 6.888 10.513 ( -1.755 -1.750 0.109) 2.481 10.713 ( 4.884 4.920 -10.325) 12.437 11.012 ( -9.255 -6.589 -9.035) 14.516 11.228 ( -0.764 -1.347 -1.823) 2.392 11.534 ( 4.408 -2.185 3.175) 5.856 12.014 ( 8.450 8.391 10.209) 15.686 12.187 ( 7.409 -1.415 -0.450) 7.556 12.437 ( 4.062 5.396 -4.354) 8.036 13.105 ( 0.148 -3.266 -0.428) 3.297 13.332 ( -2.245 0.477 1.350) 2.663 13.602 ( -4.198 2.406 7.042) 8.545 13.739 ( 5.319 -10.715 1.974) 12.124 14.269 ( 9.559 9.264 6.430) 14.783 14.563 ( 3.983 -2.988 0.598) 5.015 15.730 ( -10.517 -7.852 -5.174) 14.108 18.432 ( -5.633 3.938 -0.350) 6.882 19.179 ( 2.364 -5.419 1.200) 6.033 19.765 ( 7.331 1.917 2.342) 7.931 20.721 ( -9.874 15.389 -3.156) 18.555 22.361 ( 6.298 -11.925 -0.125) 13.487 23.804 ( -0.505 -0.147 3.745) 3.781 ======================= Grid point 21 (15/433) ======================= 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 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.130 ( -6.563 22.016 -24.302) 33.442 2.473 ( -18.293 18.490 -12.167) 28.715 3.626 ( -21.571 18.055 -6.627) 28.900 5.105 ( 0.871 -5.413 8.745) 10.321 6.679 ( -6.390 -8.390 -6.686) 12.487 7.248 ( 5.045 -7.389 -1.459) 9.065 7.682 ( -7.319 9.896 6.386) 13.867 8.100 ( -5.620 -9.379 -3.223) 11.398 8.202 ( 5.081 5.361 7.069) 10.224 8.784 ( -9.942 -1.727 -8.247) 13.032 9.028 ( 1.314 3.767 -2.258) 4.585 9.286 ( -6.780 -6.065 -6.245) 11.034 9.537 ( 4.570 -0.342 -0.651) 4.629 9.669 ( 4.971 -2.257 5.020) 7.417 9.958 ( 0.243 4.951 -11.912) 12.903 10.466 ( -4.271 -2.874 -0.901) 5.226 10.689 ( 3.244 0.196 -11.394) 11.849 10.834 ( -9.916 -2.912 -11.361) 15.358 11.223 ( -0.449 -1.754 -1.255) 2.203 11.662 ( 3.126 -5.069 2.490) 6.455 12.134 ( 7.133 1.340 0.847) 7.307 12.314 ( 9.629 9.449 9.046) 16.243 12.488 ( 12.097 2.627 -8.178) 14.836 13.163 ( -0.403 -3.877 6.026) 7.177 13.305 ( -2.936 -1.483 1.522) 3.624 13.559 ( -3.124 2.293 6.498) 7.566 13.899 ( 1.607 -6.778 3.265) 7.693 14.359 ( 7.940 11.980 8.457) 16.676 14.674 ( 5.363 -3.856 -1.634) 6.805 15.601 ( -11.129 -11.498 -8.362) 18.055 18.320 ( -3.618 2.754 1.484) 4.783 19.273 ( 1.048 -2.369 5.783) 6.337 19.867 ( 5.492 1.628 -0.813) 5.786 20.373 ( -9.475 14.378 -5.335) 18.026 22.587 ( 7.290 -10.605 -0.695) 12.887 23.815 ( -1.510 -0.139 4.514) 4.762 ======================= Grid point 22 (16/433) ======================= 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 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.639 ( -5.400 26.891 -26.599) 38.207 1.859 ( -21.175 21.498 -17.003) 34.636 2.925 ( -29.504 31.846 -4.410) 43.635 5.188 ( -4.942 -6.687 9.292) 12.469 6.537 ( -10.240 -5.539 -9.288) 14.893 7.402 ( 6.011 5.310 6.938) 10.605 7.578 ( -4.506 -1.493 8.296) 9.558 8.066 ( -5.287 -8.048 -4.733) 10.730 8.307 ( 4.548 -2.281 0.265) 5.095 8.698 ( -2.948 -6.307 -1.125) 7.052 8.797 ( -8.762 10.922 -10.078) 17.252 9.300 ( 1.325 -8.279 3.070) 8.929 9.511 ( 1.522 17.635 -1.121) 17.736 9.758 ( 5.391 -1.495 -1.216) 5.725 10.007 ( 2.341 -6.762 -1.390) 7.289 10.496 ( 2.904 -11.819 -4.296) 12.907 10.573 ( -11.960 0.276 -9.432) 15.234 10.725 ( 6.416 -3.978 -16.361) 18.019 11.231 ( -0.512 -2.361 -0.457) 2.458 11.740 ( 0.507 -4.379 -0.707) 4.465 12.235 ( 6.237 -1.294 -1.818) 6.624 12.459 ( 12.947 13.050 11.463) 21.664 12.655 ( 15.214 1.061 -9.872) 18.168 13.182 ( -6.231 -0.107 9.360) 11.245 13.293 ( -3.622 -2.806 5.008) 6.788 13.544 ( -0.384 0.002 4.378) 4.395 13.964 ( -1.495 -2.369 4.689) 5.463 14.393 ( 3.520 11.153 7.272) 13.772 14.784 ( 4.937 -3.652 -3.095) 6.876 15.486 ( -8.968 -12.972 -13.250) 20.597 18.294 ( 0.813 -0.050 2.777) 2.894 19.307 ( -1.408 2.294 5.591) 6.205 19.816 ( -5.456 11.351 -1.740) 12.714 20.183 ( 1.702 1.045 -4.818) 5.216 22.781 ( 5.646 -7.832 -0.558) 9.671 23.810 ( -2.130 0.129 4.018) 4.550 ======================= Grid point 23 (17/433) ======================= 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 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.108 ( -10.548 27.000 -25.367) 38.520 1.208 ( -10.874 30.389 -17.485) 36.707 2.027 ( -29.203 46.996 -0.037) 55.330 5.157 ( -14.035 -6.906 8.234) 17.677 6.389 ( -6.600 -3.821 -6.230) 9.847 7.425 ( 2.438 11.596 10.901) 16.101 7.603 ( -3.591 -5.885 3.498) 7.731 8.046 ( -0.816 -4.140 -2.662) 4.990 8.370 ( -0.030 -5.384 -4.871) 7.261 8.390 ( -15.406 1.192 -11.757) 19.416 8.897 ( 7.410 -3.650 5.019) 9.666 9.414 ( 6.567 12.554 12.131) 18.652 9.462 ( 7.755 -3.179 0.913) 8.430 9.871 ( 8.188 -0.579 -2.782) 8.668 10.036 ( -0.290 3.082 7.818) 8.408 10.291 ( -13.045 2.044 -8.408) 15.654 10.584 ( -5.077 -18.143 -21.274) 28.417 10.907 ( 16.492 -7.138 -7.499) 19.473 11.234 ( -3.326 -4.064 0.552) 5.280 11.785 ( 1.909 -4.887 -3.134) 6.111 12.364 ( 8.860 0.210 2.042) 9.095 12.575 ( 6.262 10.165 6.446) 13.568 12.837 ( 15.837 1.555 -11.488) 19.626 13.108 ( -7.035 1.750 9.690) 12.102 13.240 ( -8.310 1.775 7.691) 11.461 13.626 ( 4.188 -4.001 5.300) 7.850 13.973 ( -1.668 1.475 8.582) 8.866 14.336 ( -4.035 5.697 1.119) 7.070 14.864 ( 3.080 -2.978 -3.129) 5.304 15.382 ( -5.920 -10.096 -20.048) 23.214 18.378 ( 4.935 -3.281 2.667) 6.499 19.256 ( -1.472 7.226 2.355) 7.742 19.552 ( -8.377 12.471 -2.039) 15.161 20.248 ( 3.340 -4.687 -1.749) 6.015 22.917 ( 3.020 -5.022 1.274) 5.997 23.794 ( -1.667 0.399 2.545) 3.069 ======================= Grid point 24 (18/433) ======================= 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 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 432 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.569 ( 0.000 29.670 0.000) 29.670 0.749 ( 0.000 38.438 0.000) 38.438 1.195 ( 0.000 60.457 0.000) 60.457 4.996 ( 0.000 2.100 0.000) 2.100 6.338 ( -0.000 -2.294 -0.000) 2.294 7.394 ( 0.000 8.088 0.000) 8.088 7.621 ( -0.000 -4.168 -0.000) 4.168 8.069 ( 0.000 1.492 0.000) 1.492 8.161 ( 0.000 1.838 0.000) 1.838 8.417 ( -0.000 -7.714 -0.000) 7.714 8.985 ( -0.000 -3.376 -0.000) 3.376 9.461 ( 0.000 8.826 0.000) 8.826 9.668 ( -0.000 -9.925 -0.000) 9.925 10.001 ( 0.000 1.548 0.000) 1.548 10.031 ( 0.000 0.613 0.000) 0.613 10.214 ( -0.000 -1.854 -0.000) 1.854 10.425 ( -0.000 -6.073 -0.000) 6.073 11.130 ( -0.000 -2.450 -0.000) 2.450 11.231 ( -0.000 -8.791 -0.000) 8.791 11.867 ( -0.000 -7.948 -0.000) 7.948 12.517 ( 0.000 11.644 0.000) 11.644 12.519 ( -0.000 -2.740 -0.000) 2.740 12.962 ( -0.000 -0.096 -0.000) 0.096 13.084 ( 0.000 1.224 0.000) 1.224 13.135 ( 0.000 0.844 0.000) 0.844 13.755 ( -0.000 -3.698 -0.000) 3.698 14.044 ( 0.000 0.939 0.000) 0.939 14.183 ( 0.000 0.528 0.000) 0.528 14.903 ( -0.000 -2.156 -0.000) 2.156 15.240 ( 0.000 2.031 0.000) 2.031 18.504 ( -0.000 -6.309 -0.000) 6.309 19.162 ( 0.000 11.527 0.000) 11.527 19.351 ( 0.000 6.866 0.000) 6.866 20.318 ( -0.000 -4.186 -0.000) 4.186 22.990 ( -0.000 -3.254 -0.000) 3.254 23.783 ( 0.000 0.403 0.000) 0.403 ======================= Grid point 27 (19/433) ======================= 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 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 433 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.209 ( 19.001 -0.000 21.289) 28.535 2.268 ( 27.900 -0.000 7.351) 28.852 3.599 ( 25.725 -0.000 13.062) 28.851 5.269 ( -5.104 0.000 -10.389) 11.575 6.881 ( -5.193 0.000 -7.639) 9.237 7.466 ( 18.659 -0.000 13.341) 22.938 7.618 ( -14.986 0.000 -12.664) 19.621 7.818 ( 6.756 -0.000 -1.277) 6.875 8.442 ( -0.365 0.000 3.788) 3.805 8.871 ( 12.870 -0.000 5.969) 14.187 9.019 ( 6.011 -0.000 20.740) 21.594 9.187 ( 6.008 -0.000 2.267) 6.421 9.413 ( -15.685 0.000 -0.929) 15.713 9.815 ( -14.077 0.000 12.404) 18.762 10.202 ( 6.883 -0.000 -6.214) 9.274 10.385 ( -0.869 0.000 -0.438) 0.974 10.846 ( -2.540 0.000 10.405) 10.710 11.092 ( 5.527 -0.000 9.245) 10.772 11.488 ( 0.785 -0.000 -0.872) 1.173 11.562 ( -2.849 0.000 0.187) 2.855 11.687 ( -8.641 0.000 0.347) 8.648 12.256 ( -0.639 0.000 5.496) 5.533 12.260 ( -10.779 0.000 6.681) 12.682 13.204 ( 4.394 -0.000 -3.584) 5.670 13.233 ( 2.102 -0.000 -14.945) 15.092 13.380 ( -8.200 0.000 -1.402) 8.319 13.913 ( 0.609 -0.000 -10.950) 10.966 14.114 ( 5.970 -0.000 -4.276) 7.343 14.636 ( -9.170 0.000 2.719) 9.565 16.140 ( -2.324 0.000 10.325) 10.583 18.352 ( 6.735 -0.000 -12.893) 14.546 19.125 ( -0.344 0.000 -10.787) 10.792 19.985 ( -9.598 0.000 6.011) 11.325 20.041 ( 18.684 -0.000 9.274) 20.859 22.792 ( -11.248 0.000 5.123) 12.359 23.823 ( 1.976 -0.000 -6.367) 6.666 ======================= Grid point 28 (20/433) ======================= 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 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.584 ( 16.674 3.235 13.603) 21.761 2.777 ( 22.078 -5.892 7.523) 24.057 3.993 ( 12.548 -3.081 7.642) 15.012 5.122 ( -4.294 3.151 -7.339) 9.068 6.693 ( -12.521 0.249 -5.179) 13.552 7.384 ( -1.978 1.901 -10.861) 11.202 7.656 ( -0.157 -4.296 -1.971) 4.729 8.116 ( 21.864 2.940 11.248) 24.763 8.467 ( -1.323 -3.318 3.863) 5.261 9.014 ( -4.270 4.476 8.441) 10.465 9.081 ( -13.365 -1.590 1.348) 13.527 9.213 ( -1.224 -1.150 16.498) 16.583 9.374 ( 14.115 -1.080 -3.136) 14.500 9.730 ( -4.101 -1.889 12.021) 12.841 10.213 ( 1.024 2.413 -4.925) 5.579 10.400 ( 1.123 -1.275 -2.400) 2.941 10.878 ( 2.491 4.092 4.213) 6.380 11.064 ( -10.643 -5.984 -4.197) 12.911 11.445 ( 0.015 5.198 -1.225) 5.340 11.510 ( -3.628 -1.303 -2.884) 4.814 11.745 ( 7.234 2.132 14.403) 16.258 12.137 ( -8.018 0.806 6.585) 10.407 12.356 ( 6.244 -1.792 8.171) 10.439 13.093 ( -4.398 3.691 -7.734) 9.632 13.227 ( -3.559 -8.293 -9.475) 13.085 13.333 ( 1.581 -0.744 -2.899) 3.385 13.893 ( 3.760 0.257 -6.640) 7.635 14.160 ( 3.508 3.217 -2.913) 5.580 14.498 ( -9.129 -0.734 2.904) 9.608 16.109 ( -5.109 2.061 3.909) 6.755 18.415 ( 9.218 -1.047 -12.053) 15.210 19.061 ( -0.781 -2.194 -11.355) 11.591 19.853 ( -7.863 4.511 8.385) 12.348 20.447 ( 18.906 -4.562 10.891) 22.290 22.584 ( -15.198 2.247 2.927) 15.640 23.812 ( 1.241 0.349 -5.308) 5.462 ======================= Grid point 29 (21/433) ======================= 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 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 794 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.853 ( 11.722 3.338 6.278) 13.710 3.168 ( 15.335 -1.300 5.360) 16.297 4.181 ( 2.041 -5.756 2.279) 6.518 4.982 ( -2.320 5.883 -5.689) 8.506 6.457 ( -11.415 -1.656 -3.854) 12.161 7.335 ( 2.228 0.847 -7.655) 8.017 7.662 ( -0.180 -5.923 -7.380) 9.465 8.292 ( -7.921 1.989 4.017) 9.101 8.606 ( 10.746 -3.742 8.031) 13.928 8.791 ( -6.883 -0.080 -1.024) 6.960 9.055 ( -2.464 8.382 9.987) 13.268 9.267 ( -0.923 2.053 12.767) 12.964 9.536 ( 1.206 -2.440 -0.395) 2.750 9.819 ( 0.771 -6.786 6.198) 9.223 10.183 ( 1.839 1.768 -1.823) 3.136 10.387 ( -0.373 0.833 -4.304) 4.399 10.851 ( -2.831 -1.490 -4.638) 5.634 10.985 ( -0.101 -1.810 -3.051) 3.549 11.363 ( -3.548 2.980 -1.520) 4.877 11.477 ( 0.926 -0.626 -3.939) 4.095 11.941 ( 9.410 6.456 15.356) 19.132 12.054 ( -5.193 1.258 6.100) 8.109 12.532 ( 5.610 1.900 7.867) 9.848 12.998 ( -0.565 -3.400 -2.761) 4.416 13.174 ( -2.026 -5.079 -10.804) 12.109 13.348 ( -1.240 -6.758 -6.298) 9.321 13.920 ( 2.113 5.114 -0.531) 5.559 14.142 ( 2.763 5.123 0.694) 5.862 14.421 ( -3.825 -3.265 2.083) 5.443 15.988 ( -8.473 1.221 -0.245) 8.564 18.520 ( 8.954 -1.577 -9.744) 13.327 19.006 ( -0.857 -3.513 -11.243) 11.811 19.754 ( -4.671 5.062 9.952) 12.103 20.857 ( 17.494 -2.112 11.031) 20.789 22.299 ( -17.000 1.303 -0.153) 17.050 23.798 ( 0.742 0.543 -2.870) 3.013 ======================= Grid point 30 (22/433) ======================= q-point: (-0.58 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 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.962 ( 5.871 7.365 -3.259) 9.967 3.341 ( 5.377 7.284 1.867) 9.244 4.217 ( -4.874 -7.469 -2.892) 9.376 4.890 ( 1.603 5.477 -1.673) 5.947 6.344 ( -4.067 -6.218 -2.376) 7.800 7.293 ( -1.818 1.322 -6.742) 7.107 7.698 ( 2.303 -8.290 -9.337) 12.696 8.092 ( -14.820 -5.406 0.263) 15.777 8.782 ( 2.263 -3.307 -0.386) 4.026 8.815 ( 6.439 5.220 7.173) 10.962 8.919 ( -4.768 13.400 7.039) 15.869 9.291 ( -3.807 1.808 0.980) 4.327 9.463 ( -8.409 -2.750 7.402) 11.535 9.898 ( -2.154 -4.957 -1.297) 5.558 10.172 ( -1.869 2.522 0.379) 3.162 10.400 ( 4.939 -3.163 -3.930) 7.060 10.827 ( -1.070 -4.403 -3.777) 5.899 10.976 ( 2.007 3.090 -6.402) 7.387 11.283 ( -2.317 1.756 -0.867) 3.033 11.485 ( 2.849 0.538 -3.841) 4.812 12.032 ( -0.486 -0.056 5.809) 5.830 12.097 ( 7.156 7.186 10.857) 14.857 12.556 ( 1.167 6.589 2.875) 7.283 13.054 ( -0.302 -3.146 -1.472) 3.486 13.229 ( 8.415 -9.490 -6.310) 14.166 13.341 ( -3.799 -9.496 -6.114) 11.916 13.814 ( -5.016 9.387 4.551) 11.575 14.235 ( 10.137 2.807 2.954) 10.925 14.439 ( -0.204 -3.186 2.740) 4.207 15.813 ( -11.504 -1.217 -2.164) 11.768 18.585 ( 3.810 1.713 -6.870) 8.040 18.983 ( 1.174 -5.655 -9.344) 10.985 19.735 ( 0.511 3.446 9.318) 9.948 21.130 ( 8.468 7.586 7.792) 13.783 22.062 ( -10.561 -6.262 -1.011) 12.320 23.795 ( 0.373 0.363 0.161) 0.544 ======================= Grid point 31 (23/433) ======================= 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 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 794 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.858 ( 0.833 14.976 -13.097) 19.913 3.219 ( -6.380 14.456 -3.817) 16.256 4.129 ( -7.915 -1.643 -5.876) 9.993 4.924 ( 4.294 0.420 4.327) 6.110 6.402 ( 1.642 -10.582 -1.724) 10.847 7.170 ( -6.383 -1.136 -8.034) 10.324 7.762 ( 1.536 -8.282 -9.038) 12.355 7.973 ( -7.209 -7.224 0.712) 10.230 8.611 ( -8.489 20.896 8.486) 24.098 8.890 ( 0.979 -5.670 -4.537) 7.328 8.955 ( 3.645 0.171 5.970) 6.997 9.098 ( -9.244 -2.271 -3.396) 10.106 9.514 ( 2.620 -0.477 9.041) 9.426 9.768 ( -8.836 3.163 -10.234) 13.885 10.152 ( -0.646 0.273 2.981) 3.063 10.458 ( -1.945 -4.486 -4.502) 6.647 10.815 ( -0.422 -0.009 -5.362) 5.379 10.910 ( -1.418 1.830 -8.217) 8.537 11.234 ( -1.523 1.237 -0.366) 1.996 11.523 ( 4.888 1.211 -2.005) 5.420 12.120 ( 4.727 -0.990 7.806) 9.179 12.159 ( 2.741 2.773 2.105) 4.431 12.565 ( 7.111 7.534 1.681) 10.495 13.065 ( 1.576 -1.120 -2.022) 2.797 13.268 ( -4.733 -6.474 -7.090) 10.705 13.510 ( 7.234 -12.325 2.273) 14.470 13.698 ( -2.697 6.974 6.041) 9.613 14.413 ( 11.890 3.897 3.903) 13.107 14.493 ( 0.520 -3.075 3.365) 4.588 15.615 ( -13.247 -3.963 -2.472) 14.047 18.524 ( -1.574 5.501 -5.397) 7.866 19.053 ( 3.849 -7.202 -3.198) 8.770 19.803 ( 4.472 1.610 5.385) 7.182 21.025 ( -8.051 16.004 0.424) 17.920 22.125 ( 4.505 -12.561 2.355) 13.551 23.804 ( -0.237 0.061 2.655) 2.666 ======================= Grid point 32 (24/433) ======================= 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 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.569 ( -1.297 22.417 -19.506) 29.744 2.833 ( -14.872 18.583 -10.295) 25.932 3.904 ( -11.135 10.055 -4.659) 15.710 5.033 ( 2.544 -2.145 7.139) 7.876 6.500 ( -2.780 -10.110 -4.987) 11.611 7.090 ( -0.377 -7.725 -4.727) 9.065 7.779 ( -1.459 -4.515 -6.246) 7.844 7.957 ( -3.716 -3.154 2.131) 5.319 8.372 ( -5.043 13.092 9.150) 16.749 8.731 ( -11.752 -2.455 -6.767) 13.781 9.057 ( 3.911 -1.030 5.601) 6.908 9.156 ( 1.569 -6.507 -7.251) 9.867 9.523 ( -3.953 1.760 -3.542) 5.592 9.634 ( 3.601 -1.083 5.269) 6.473 10.115 ( -0.907 7.239 -3.984) 8.313 10.370 ( -8.370 -6.073 -6.286) 12.102 10.742 ( -2.843 1.338 -7.752) 8.365 10.803 ( -2.539 2.523 -8.604) 9.319 11.204 ( -1.475 -0.349 0.213) 1.531 11.589 ( 2.943 -1.488 0.797) 3.393 12.156 ( 1.925 1.157 0.133) 2.250 12.342 ( 12.033 -4.339 2.993) 13.137 12.643 ( 10.567 10.371 1.831) 14.919 13.109 ( 1.300 -1.470 3.658) 4.151 13.208 ( -5.652 -7.446 -5.573) 10.884 13.639 ( -1.133 4.669 8.059) 9.383 13.744 ( 5.475 -8.281 0.477) 9.939 14.537 ( 0.836 1.597 5.151) 5.457 14.590 ( 8.987 -0.440 0.272) 9.002 15.434 ( -11.963 -5.585 -1.800) 13.325 18.405 ( -1.680 6.011 -3.662) 7.236 19.188 ( 3.826 -6.241 3.418) 8.079 19.890 ( 5.043 1.026 -0.147) 5.149 20.675 ( -12.348 16.085 -2.894) 20.483 22.378 ( 8.583 -10.992 2.694) 14.204 23.813 ( -1.073 -0.026 3.843) 3.990 ======================= Grid point 33 (25/433) ======================= 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 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 794 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.168 ( -4.815 26.527 -21.323) 34.373 2.293 ( -14.076 23.529 -14.569) 31.049 3.491 ( -15.762 25.553 -1.819) 30.078 5.110 ( -1.391 -2.087 7.243) 7.665 6.423 ( -8.600 -6.286 -8.211) 13.450 7.257 ( 6.517 -13.082 0.342) 14.620 7.733 ( -3.068 5.809 7.312) 9.830 7.912 ( -3.979 -4.023 -3.905) 6.875 8.281 ( -4.187 -0.071 -0.114) 4.190 8.615 ( -2.373 -1.182 0.654) 2.731 8.961 ( -10.867 2.868 -11.001) 15.727 9.171 ( 3.667 -1.455 5.077) 6.430 9.666 ( 10.148 -6.601 2.212) 12.307 9.749 ( 3.501 -2.381 7.296) 8.435 9.932 ( -3.209 8.092 -11.820) 14.679 10.292 ( -5.492 -9.251 -6.140) 12.388 10.576 ( -9.944 0.703 -8.537) 13.125 10.731 ( 4.714 3.307 -8.540) 10.300 11.190 ( -2.122 -1.953 0.509) 2.928 11.648 ( -0.015 -3.905 1.606) 4.222 12.209 ( 5.487 -1.458 -3.050) 6.445 12.613 ( 14.604 -3.032 -1.551) 14.996 12.730 ( 9.758 10.949 4.527) 15.349 13.134 ( -6.984 -5.126 3.809) 9.463 13.190 ( -0.071 -4.459 1.427) 4.682 13.623 ( 1.065 5.950 3.967) 7.230 13.882 ( 1.433 -5.839 3.449) 6.931 14.516 ( -5.177 -0.459 -0.258) 5.204 14.723 ( 6.091 -0.749 0.077) 6.137 15.325 ( -5.537 -4.016 -0.814) 6.888 18.333 ( 1.038 3.962 -1.575) 4.388 19.318 ( 2.440 -2.024 7.559) 8.197 19.928 ( 1.874 1.916 -5.094) 5.755 20.325 ( -9.129 12.560 -3.046) 15.823 22.621 ( 7.403 -8.644 1.628) 11.496 23.813 ( -1.606 0.174 3.662) 4.003 ======================= Grid point 34 (26/433) ======================= 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 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.610 ( -14.347 25.933 -16.675) 34.006 1.835 ( 0.031 32.615 -13.679) 35.368 2.896 ( -15.202 41.472 0.927) 44.181 5.106 ( -4.838 -0.182 5.032) 6.983 6.306 ( -5.803 -4.726 -5.567) 9.327 7.447 ( 0.471 -10.602 0.407) 10.620 7.679 ( -0.739 13.229 15.172) 20.143 7.910 ( 2.251 -10.242 -9.667) 14.263 8.226 ( -4.351 -4.951 -1.701) 6.807 8.445 ( -12.868 3.982 -8.260) 15.801 8.928 ( 8.993 2.447 5.500) 10.822 9.262 ( -0.661 -8.728 3.057) 9.271 9.707 ( 1.684 11.437 -3.417) 12.055 9.867 ( 8.144 0.585 3.795) 9.004 9.970 ( 3.309 -10.408 5.367) 12.169 10.265 ( -5.367 -12.763 -11.636) 18.086 10.324 ( -11.916 1.591 -8.716) 14.849 10.820 ( 12.561 -1.634 -5.826) 13.943 11.161 ( -5.531 -3.425 0.594) 6.533 11.685 ( -0.823 -4.545 0.309) 4.629 12.326 ( 7.473 -3.356 -2.410) 8.539 12.779 ( 2.292 7.475 4.714) 9.130 12.838 ( 13.025 -0.813 -7.035) 14.825 13.092 ( -4.078 -1.981 4.288) 6.240 13.229 ( -3.708 -1.827 6.596) 7.784 13.627 ( 4.325 3.398 1.120) 5.613 13.960 ( -0.085 -2.574 7.556) 7.983 14.365 ( -11.321 -2.237 -6.874) 13.432 14.810 ( 2.895 -2.211 -0.444) 3.670 15.304 ( 0.363 0.042 -1.271) 1.323 18.347 ( 3.234 0.199 -0.042) 3.241 19.388 ( 2.626 5.022 7.360) 9.289 19.782 ( -7.737 10.385 -6.157) 14.340 20.181 ( 0.389 -0.313 -2.224) 2.279 22.801 ( 4.350 -6.814 0.855) 8.129 23.803 ( -1.282 0.483 2.340) 2.712 ======================= Grid point 35 (27/433) ======================= 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 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 433 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.138 ( 0.000 29.331 0.000) 29.331 1.466 ( 0.000 35.898 0.000) 35.898 2.289 ( 0.000 52.529 0.000) 52.529 5.047 ( 0.000 2.850 0.000) 2.850 6.278 ( -0.000 -3.829 -0.000) 3.829 7.517 ( -0.000 -6.846 -0.000) 6.846 7.601 ( 0.000 12.551 0.000) 12.551 8.066 ( -0.000 -12.325 -0.000) 12.325 8.126 ( 0.000 4.999 0.000) 4.999 8.299 ( -0.000 -3.751 -0.000) 3.751 8.995 ( 0.000 5.190 0.000) 5.190 9.410 ( -0.000 -16.398 -0.000) 16.398 9.634 ( 0.000 8.274 0.000) 8.274 10.028 ( 0.000 0.929 0.000) 0.929 10.065 ( 0.000 3.139 0.000) 3.139 10.154 ( -0.000 -4.123 -0.000) 4.123 10.236 ( -0.000 -13.648 -0.000) 13.648 11.049 ( -0.000 -8.349 -0.000) 8.349 11.076 ( -0.000 -2.844 -0.000) 2.844 11.727 ( -0.000 -6.023 -0.000) 6.023 12.447 ( -0.000 -4.721 -0.000) 4.721 12.727 ( 0.000 8.298 0.000) 8.298 12.945 ( -0.000 -1.293 -0.000) 1.293 13.098 ( -0.000 -0.199 -0.000) 0.199 13.173 ( 0.000 3.150 0.000) 3.150 13.694 ( -0.000 -1.904 -0.000) 1.904 14.042 ( -0.000 -1.366 -0.000) 1.366 14.184 ( -0.000 -0.738 -0.000) 0.738 14.856 ( -0.000 -2.532 -0.000) 2.532 15.288 ( 0.000 2.810 0.000) 2.810 18.403 ( -0.000 -3.538 -0.000) 3.538 19.388 ( 0.000 10.402 0.000) 10.402 19.534 ( 0.000 11.783 0.000) 11.783 20.219 ( -0.000 -5.088 -0.000) 5.088 22.902 ( -0.000 -5.733 -0.000) 5.733 23.793 ( 0.000 0.602 0.000) 0.602 ======================= Grid point 40 (28/433) ======================= 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 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 432 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.896 ( 12.080 -0.000 6.091) 13.529 3.146 ( 19.564 -0.000 6.377) 20.577 4.122 ( 1.188 -0.000 2.511) 2.778 5.044 ( -2.117 0.000 -5.577) 5.965 6.439 ( -13.027 0.000 -4.610) 13.819 7.344 ( 3.233 -0.000 -10.245) 10.743 7.603 ( -0.950 0.000 -5.137) 5.224 8.307 ( -16.533 0.000 -0.796) 16.552 8.565 ( 18.563 -0.000 11.336) 21.750 8.789 ( -8.069 0.000 -1.246) 8.165 9.165 ( 1.633 -0.000 14.695) 14.785 9.279 ( -2.817 0.000 18.838) 19.047 9.518 ( 3.297 -0.000 -5.282) 6.227 9.735 ( -1.295 0.000 5.845) 5.986 10.202 ( 1.753 -0.000 -3.207) 3.655 10.397 ( 0.068 -0.000 -4.045) 4.045 10.795 ( -10.890 0.000 -3.777) 11.527 11.007 ( 8.263 -0.000 -2.636) 8.673 11.391 ( -5.834 0.000 -2.651) 6.408 11.471 ( 1.887 -0.000 -4.685) 5.051 12.007 ( 8.036 -0.000 15.800) 17.726 12.070 ( -4.944 0.000 8.230) 9.601 12.546 ( 9.920 -0.000 10.241) 14.258 13.005 ( -5.538 0.000 -1.066) 5.639 13.076 ( -0.491 0.000 -13.732) 13.740 13.285 ( -1.671 0.000 -8.527) 8.689 13.966 ( 5.820 -0.000 -0.692) 5.861 14.217 ( 2.797 -0.000 -2.372) 3.667 14.369 ( -6.899 0.000 4.625) 8.305 16.001 ( -9.789 0.000 -0.233) 9.792 18.503 ( 10.428 -0.000 -11.182) 15.290 18.971 ( -0.617 0.000 -11.737) 11.753 19.805 ( -6.481 0.000 10.216) 12.098 20.834 ( 20.683 -0.000 12.571) 24.204 22.313 ( -19.324 0.000 -0.058) 19.324 23.804 ( 0.792 -0.000 -3.306) 3.400 ======================= Grid point 41 (29/433) ======================= 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 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.066 ( 8.046 3.018 -0.699) 8.622 3.452 ( 13.774 3.572 4.142) 14.820 4.081 ( -7.423 -4.849 -2.920) 9.335 4.987 ( 0.732 3.333 -3.646) 4.994 6.254 ( -6.915 -2.643 -3.477) 8.179 7.321 ( -0.524 1.170 -8.508) 8.604 7.575 ( 0.924 -3.733 -8.617) 9.436 7.994 ( -17.505 -3.410 -3.070) 18.097 8.737 ( -0.187 -1.207 -0.162) 1.232 8.847 ( 9.138 0.847 6.730) 11.380 9.226 ( 1.290 12.428 12.519) 17.687 9.350 ( -5.845 4.011 7.236) 10.129 9.395 ( -9.241 -3.860 7.871) 12.738 9.761 ( -1.598 -7.477 0.216) 7.649 10.232 ( -0.052 3.421 -2.585) 4.288 10.323 ( -1.995 -4.394 -7.613) 9.014 10.718 ( -0.762 -3.276 1.971) 3.899 11.094 ( 6.338 4.965 -6.427) 10.301 11.289 ( -4.230 -0.860 -1.765) 4.663 11.494 ( 6.096 0.307 -7.751) 9.866 12.026 ( -3.623 -0.155 7.699) 8.511 12.207 ( 5.030 3.441 12.559) 13.960 12.707 ( 2.815 7.695 9.158) 12.288 12.985 ( 3.616 -3.066 -0.331) 4.752 13.045 ( 2.401 -8.652 -9.167) 12.832 13.213 ( -1.030 -2.973 -11.744) 12.158 13.976 ( -3.155 6.010 1.942) 7.060 14.248 ( 3.847 -1.219 -0.145) 4.038 14.386 ( 3.119 -1.486 6.067) 6.982 15.801 ( -13.087 -0.164 -1.699) 13.198 18.612 ( 9.406 0.846 -8.953) 13.013 18.902 ( -0.062 -2.384 -11.567) 11.810 19.781 ( -2.900 1.214 10.752) 11.203 21.238 ( 18.533 3.145 12.309) 22.469 21.974 ( -19.951 -2.554 -2.524) 20.271 23.801 ( 0.358 0.179 -0.600) 0.721 ======================= Grid point 42 (30/433) ======================= 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 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.088 ( 3.945 8.313 -7.564) 11.911 3.495 ( -0.886 14.291 -2.155) 14.480 4.012 ( -4.924 -9.725 -4.353) 11.737 4.972 ( 3.168 3.587 0.022) 4.786 6.228 ( -0.224 -6.974 -2.238) 7.328 7.165 ( -9.751 0.423 -9.350) 13.516 7.597 ( 1.360 -7.566 -11.203) 13.586 7.840 ( -4.642 -5.847 -1.008) 7.533 8.771 ( 1.768 -2.715 -1.892) 3.752 8.957 ( -1.615 2.254 2.138) 3.501 9.022 ( -14.758 7.041 6.299) 17.523 9.129 ( -2.760 12.475 3.264) 13.187 9.509 ( 2.163 -0.199 15.587) 15.737 9.775 ( -4.537 -3.298 -6.771) 8.792 10.126 ( -4.027 -2.895 0.005) 4.959 10.344 ( -1.762 -5.583 -5.528) 8.052 10.766 ( 1.129 -1.510 0.027) 1.885 11.027 ( -2.168 6.122 -5.395) 8.443 11.240 ( -3.276 -1.166 -0.046) 3.478 11.576 ( 11.383 3.649 -10.496) 15.908 12.058 ( 1.043 -3.147 7.183) 7.911 12.249 ( -1.265 4.920 5.013) 7.137 12.709 ( 4.063 6.873 6.607) 10.363 13.024 ( 0.924 -4.130 -4.586) 6.240 13.158 ( -0.592 -2.935 -9.895) 10.338 13.279 ( 10.337 -10.943 0.643) 15.067 13.850 ( -3.572 8.086 3.645) 9.562 14.336 ( 1.017 -7.138 -0.271) 7.215 14.529 ( 8.864 2.817 7.502) 11.949 15.571 ( -13.986 -1.033 -0.485) 14.033 18.638 ( 3.321 6.189 -8.287) 10.863 18.916 ( 3.939 -6.884 -7.463) 10.891 19.822 ( 1.450 0.430 8.891) 9.019 21.327 ( -6.980 15.275 1.996) 16.912 21.880 ( 3.604 -13.006 4.471) 14.218 23.805 ( -0.174 0.093 1.923) 1.933 ======================= Grid point 43 (31/433) ======================= 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 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.945 ( 0.396 15.658 -13.250) 20.516 3.176 ( -12.586 16.796 -9.540) 23.055 4.001 ( -1.843 0.182 -2.676) 3.255 5.023 ( 3.456 0.929 4.094) 5.437 6.308 ( 0.031 -9.179 -2.944) 9.639 6.967 ( -7.280 -5.042 -7.805) 11.804 7.612 ( -0.344 -9.223 -13.329) 16.212 7.895 ( 2.930 -4.579 2.467) 5.969 8.607 ( -20.771 5.977 5.121) 22.212 8.746 ( -3.577 5.003 -1.410) 6.310 9.049 ( 2.365 3.320 0.220) 4.082 9.075 ( 5.031 -1.188 3.706) 6.361 9.581 ( -8.609 2.723 -9.021) 12.764 9.635 ( 2.786 1.026 11.091) 11.481 10.162 ( -1.060 -5.076 3.429) 6.216 10.260 ( -7.465 -2.085 -8.631) 11.600 10.752 ( -1.774 1.201 -4.498) 4.983 10.888 ( -3.847 3.600 -5.313) 7.482 11.196 ( -3.494 -0.776 0.940) 3.701 11.629 ( 6.201 5.626 -6.328) 10.495 12.184 ( -0.872 1.146 1.232) 1.895 12.230 ( 8.259 -5.574 2.733) 10.332 12.790 ( 5.254 3.238 6.753) 9.148 13.038 ( -0.760 -5.455 -6.996) 8.904 13.137 ( 2.400 1.322 -3.441) 4.399 13.538 ( 6.484 -9.868 3.186) 12.230 13.777 ( 1.124 6.549 2.570) 7.124 14.404 ( -2.098 -8.957 -0.918) 9.245 14.680 ( 7.507 4.058 5.619) 10.217 15.376 ( -10.482 -1.028 2.764) 10.889 18.542 ( 0.537 7.993 -7.608) 11.047 19.047 ( 5.368 -8.083 -1.066) 9.762 19.907 ( 3.879 0.663 4.438) 5.931 20.966 ( -15.151 13.597 -2.859) 20.557 22.175 ( 10.873 -9.724 6.242) 15.866 23.813 ( -0.816 0.037 3.398) 3.495 ======================= Grid point 44 (32/433) ======================= 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 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.613 ( -12.084 19.476 -14.926) 27.352 2.747 ( -3.912 22.567 -12.983) 26.327 3.874 ( -4.348 14.084 -1.098) 14.781 5.091 ( 1.010 -0.154 5.622) 5.714 6.298 ( -6.573 -6.552 -6.163) 11.141 6.999 ( 3.343 -12.873 -2.253) 13.489 7.612 ( -1.006 -10.306 -12.807) 16.469 7.988 ( 0.617 3.036 9.083) 9.597 8.299 ( -13.250 1.442 2.527) 13.566 8.647 ( -0.308 3.564 2.865) 4.583 8.967 ( -8.168 3.593 -9.304) 12.892 9.211 ( 5.307 0.557 1.942) 5.679 9.473 ( 2.074 -7.950 -1.768) 8.404 9.746 ( 3.426 1.242 11.329) 11.901 10.040 ( -11.259 -3.013 -13.422) 17.777 10.191 ( -0.144 2.426 1.264) 2.739 10.624 ( -5.997 4.080 -8.191) 10.941 10.798 ( 0.572 2.449 -4.058) 4.774 11.152 ( -4.261 -1.977 1.696) 4.993 11.626 ( 1.593 2.197 -1.291) 3.005 12.182 ( 2.341 -1.137 -2.797) 3.820 12.490 ( 11.269 -8.758 -0.825) 14.296 12.861 ( -0.726 -0.848 6.644) 6.738 13.053 ( 5.219 0.715 -5.939) 7.939 13.156 ( 0.745 0.063 2.718) 2.819 13.693 ( 0.932 -3.034 4.216) 5.277 13.796 ( 5.183 1.378 0.447) 5.382 14.406 ( -6.885 -8.320 -3.761) 11.435 14.751 ( 1.907 1.988 3.223) 4.240 15.302 ( -1.613 0.752 5.364) 5.652 18.441 ( 1.089 7.059 -5.157) 8.809 19.219 ( 4.752 -7.825 3.961) 9.975 19.968 ( 3.660 2.714 -1.011) 4.668 20.581 ( -13.206 12.760 -2.924) 18.594 22.458 ( 8.801 -8.022 4.138) 12.607 23.816 ( -1.213 0.183 3.449) 3.660 ======================= Grid point 45 (33/433) ======================= 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 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.091 ( -12.773 23.407 -11.909) 29.203 2.423 ( 1.056 27.989 -9.937) 29.720 3.575 ( -5.898 28.605 0.318) 29.209 5.115 ( -1.289 0.733 4.082) 4.343 6.211 ( -5.147 -5.092 -4.744) 8.656 7.197 ( 2.704 -14.812 -0.425) 15.063 7.650 ( 0.452 -12.662 -7.211) 14.578 7.925 ( -5.750 8.461 9.611) 14.037 8.200 ( 0.136 1.705 2.069) 2.684 8.606 ( -8.235 13.257 -7.577) 17.348 8.805 ( 2.903 -13.066 1.924) 13.522 9.243 ( 0.445 4.153 0.206) 4.182 9.683 ( 3.395 -16.360 2.881) 16.955 9.800 ( -5.597 -3.443 -5.965) 8.875 9.908 ( 7.150 3.163 4.220) 8.885 10.148 ( -1.809 1.803 -2.418) 3.517 10.392 ( -9.501 5.484 -8.545) 13.906 10.824 ( 7.274 1.026 -3.128) 7.984 11.102 ( -6.252 -2.741 1.651) 7.023 11.632 ( 0.047 -0.627 0.718) 0.954 12.247 ( 4.292 -4.581 -3.686) 7.280 12.695 ( 2.013 -9.648 -2.935) 10.284 12.903 ( 4.869 0.623 1.938) 5.278 13.084 ( -0.569 1.733 3.073) 3.573 13.209 ( 3.755 0.199 2.355) 4.437 13.706 ( 1.148 3.157 -0.452) 3.390 13.896 ( 2.979 -2.738 5.310) 6.676 14.285 ( -10.755 -5.161 -6.488) 13.580 14.779 ( 0.570 -1.250 1.732) 2.211 15.334 ( 2.425 2.348 3.528) 4.883 18.389 ( 1.764 4.170 -2.229) 5.047 19.388 ( 3.757 -5.536 6.191) 9.115 19.941 ( 0.028 7.391 -5.389) 9.147 20.280 ( -7.013 9.346 -1.055) 11.732 22.664 ( 4.864 -7.244 1.793) 8.907 23.812 ( -0.953 0.442 2.194) 2.433 ======================= Grid point 46 (34/433) ======================= 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 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 432 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.685 ( 0.000 27.195 0.000) 27.195 2.117 ( 0.000 31.438 0.000) 31.438 3.181 ( 0.000 39.643 0.000) 39.643 5.096 ( 0.000 2.140 0.000) 2.140 6.196 ( -0.000 -4.533 -0.000) 4.533 7.339 ( -0.000 -11.949 -0.000) 11.949 7.781 ( -0.000 -15.655 -0.000) 15.655 7.822 ( 0.000 9.075 0.000) 9.075 8.253 ( -0.000 -0.258 -0.000) 0.258 8.296 ( 0.000 13.411 0.000) 13.411 9.061 ( -0.000 -19.164 -0.000) 19.164 9.149 ( 0.000 9.069 0.000) 9.069 9.728 ( -0.000 -0.585 -0.000) 0.585 9.915 ( -0.000 -17.630 -0.000) 17.630 10.046 ( 0.000 0.323 0.000) 0.323 10.092 ( 0.000 0.439 0.000) 0.439 10.163 ( 0.000 6.416 0.000) 6.416 10.942 ( -0.000 -3.090 -0.000) 3.090 11.030 ( -0.000 -1.813 -0.000) 1.813 11.646 ( -0.000 -2.292 -0.000) 2.292 12.339 ( -0.000 -6.396 -0.000) 6.396 12.748 ( -0.000 -5.694 -0.000) 5.694 12.978 ( 0.000 4.482 0.000) 4.482 13.066 ( -0.000 -3.227 -0.000) 3.227 13.240 ( 0.000 3.198 0.000) 3.198 13.695 ( 0.000 1.751 0.000) 1.751 13.995 ( -0.000 -3.156 -0.000) 3.156 14.155 ( -0.000 -2.026 -0.000) 2.026 14.809 ( -0.000 -2.326 -0.000) 2.326 15.344 ( 0.000 2.899 0.000) 2.899 18.378 ( 0.000 1.010 0.000) 1.010 19.491 ( -0.000 -1.176 -0.000) 1.176 19.783 ( 0.000 13.598 0.000) 13.598 20.179 ( 0.000 2.176 0.000) 2.176 22.778 ( -0.000 -6.937 -0.000) 6.937 23.805 ( 0.000 0.600 0.000) 0.600 ======================= Grid point 53 (35/433) ======================= q-point: (-0.67 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 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 433 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.168 ( 4.664 -0.000 -5.319) 7.074 3.724 ( 12.628 -0.000 2.636) 12.900 3.824 ( -14.985 0.000 -8.066) 17.017 5.015 ( 2.499 -0.000 -1.626) 2.981 6.156 ( -0.955 0.000 -2.532) 2.706 7.173 ( -12.003 0.000 -9.525) 15.323 7.516 ( 1.789 -0.000 -12.097) 12.228 7.779 ( -3.277 0.000 -1.724) 3.703 8.742 ( 1.977 -0.000 -1.252) 2.340 8.968 ( -1.179 0.000 -0.565) 1.307 9.055 ( -16.473 0.000 2.072) 16.603 9.400 ( -6.738 0.000 15.627) 17.018 9.477 ( 3.948 -0.000 14.602) 15.127 9.686 ( 0.738 -0.000 -2.776) 2.873 10.083 ( -8.926 0.000 -8.535) 12.350 10.292 ( 0.350 -0.000 -2.245) 2.272 10.756 ( 3.262 -0.000 0.871) 3.376 11.100 ( -6.010 0.000 -3.434) 6.922 11.211 ( -3.021 0.000 0.276) 3.034 11.620 ( 16.335 -0.000 -15.424) 22.466 12.024 ( -2.139 0.000 9.165) 9.411 12.309 ( -1.616 0.000 6.100) 6.310 12.785 ( -5.700 0.000 8.648) 10.358 12.977 ( 5.059 -0.000 -8.951) 10.282 13.121 ( 8.993 -0.000 0.844) 9.032 13.164 ( 6.720 -0.000 -9.111) 11.321 13.952 ( -3.915 0.000 1.477) 4.185 14.242 ( -0.956 0.000 0.891) 1.307 14.557 ( 9.605 -0.000 7.173) 11.988 15.563 ( -14.051 0.000 0.190) 14.052 18.732 ( 9.234 -0.000 -6.920) 11.539 18.816 ( 0.067 -0.000 -11.673) 11.673 19.825 ( 0.154 -0.000 10.628) 10.629 21.575 ( -21.857 0.000 -4.555) 22.327 21.654 ( 18.541 -0.000 12.189) 22.189 23.806 ( -0.174 0.000 1.668) 1.677 ======================= Grid point 55 (36/433) ======================= 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 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.148 ( 0.511 5.305 -8.888) 10.363 3.444 ( -14.903 9.333 -10.375) 20.417 3.947 ( 7.673 -3.813 0.223) 8.571 5.052 ( 3.051 1.371 1.030) 3.500 6.175 ( 1.232 -3.945 -2.064) 4.619 6.899 ( -12.057 -1.941 -9.008) 15.175 7.482 ( 1.527 -3.665 -15.445) 15.947 7.815 ( 4.664 -2.688 1.004) 5.475 8.649 ( -21.635 0.822 0.727) 21.663 8.775 ( 1.113 -1.083 -2.469) 2.917 9.068 ( 2.677 0.160 3.894) 4.728 9.260 ( -5.566 12.561 7.540) 15.672 9.603 ( -4.737 -0.935 -0.198) 4.833 9.640 ( -2.138 -1.063 3.405) 4.159 10.017 ( 0.256 -5.508 0.908) 5.588 10.257 ( -2.261 -0.168 -2.003) 3.025 10.783 ( 0.573 1.439 -2.818) 3.215 10.917 ( -11.092 -0.019 -2.425) 11.354 11.180 ( -2.411 -0.540 0.901) 2.630 11.764 ( 13.172 6.261 -15.767) 21.478 12.094 ( 2.493 -5.146 7.780) 9.655 12.251 ( -4.188 2.543 0.506) 4.925 12.742 ( -5.421 -4.486 5.313) 8.817 13.032 ( 8.472 2.581 -7.532) 11.626 13.169 ( 3.566 1.097 -3.465) 5.092 13.374 ( 9.756 -5.744 2.611) 11.619 13.895 ( 0.270 4.681 -0.168) 4.692 14.248 ( -3.071 -5.875 1.599) 6.820 14.729 ( 6.277 1.225 5.002) 8.119 15.372 ( -9.501 0.099 4.615) 10.563 18.701 ( 1.855 8.008 -9.455) 12.529 18.888 ( 5.899 -7.958 -5.014) 11.102 19.915 ( 3.474 0.168 8.615) 9.291 21.166 ( -19.037 6.127 -4.538) 20.507 22.028 ( 14.412 -4.682 9.504) 17.888 23.814 ( -0.703 0.023 3.191) 3.268 ======================= Grid point 56 (37/433) ======================= 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 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 794 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.910 ( -13.227 11.082 -11.992) 21.014 3.108 ( -2.774 13.821 -9.742) 17.136 4.045 ( 4.202 4.554 -0.278) 6.203 5.099 ( 2.006 0.823 3.210) 3.874 6.184 ( -4.363 -4.884 -3.854) 7.599 6.789 ( -0.928 -8.241 -4.834) 9.599 7.447 ( 0.075 -6.142 -15.623) 16.787 7.965 ( 6.708 -3.563 4.805) 8.988 8.323 ( -17.005 0.972 3.984) 17.492 8.717 ( -5.304 3.205 -1.724) 6.433 9.139 ( -0.743 11.332 -0.497) 11.367 9.157 ( 4.025 -3.541 3.740) 6.537 9.403 ( -6.384 -0.885 -8.503) 10.669 9.709 ( -4.800 -6.761 7.304) 11.050 10.016 ( -1.135 4.864 -0.720) 5.046 10.256 ( 1.755 1.363 2.155) 3.095 10.695 ( -4.422 2.130 -6.829) 8.409 10.788 ( -5.167 -3.031 0.418) 6.005 11.134 ( -3.721 0.363 0.293) 3.750 11.738 ( 3.541 8.900 -8.664) 12.915 12.174 ( -0.789 0.328 -2.491) 2.633 12.296 ( 5.587 -10.931 2.168) 12.466 12.759 ( -2.180 -6.076 4.779) 8.031 13.120 ( 10.528 3.449 -6.567) 12.879 13.176 ( -0.372 1.522 0.760) 1.741 13.575 ( 5.208 -5.987 2.950) 8.465 13.883 ( 4.130 4.916 -1.382) 6.568 14.250 ( -5.470 -7.130 -0.102) 8.987 14.779 ( -1.229 0.916 2.847) 3.233 15.325 ( -0.235 1.156 7.257) 7.352 18.594 ( 1.279 8.523 -7.240) 11.256 19.044 ( 4.784 -9.624 -1.055) 10.799 20.020 ( 5.133 2.252 4.783) 7.368 20.785 ( -15.431 7.898 -3.887) 17.765 22.327 ( 10.104 -5.204 6.270) 12.980 23.819 ( -0.991 0.122 3.372) 3.517 ======================= Grid point 57 (38/433) ======================= 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 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.483 ( -11.476 16.772 -9.242) 22.325 2.887 ( 0.476 19.657 -6.863) 20.826 3.989 ( 0.532 14.851 -0.077) 14.861 5.130 ( 0.165 0.786 2.942) 3.049 6.115 ( -4.790 -4.651 -3.617) 7.593 6.914 ( 2.912 -13.527 -1.396) 13.907 7.433 ( -0.472 -9.049 -9.890) 13.413 8.031 ( -6.944 3.193 7.134) 10.455 8.233 ( 5.254 -0.916 4.865) 7.219 8.597 ( -6.267 -4.912 -3.201) 8.582 8.918 ( -4.188 17.294 -4.698) 18.403 9.276 ( 2.502 -2.785 1.217) 3.937 9.414 ( 2.448 -10.167 -0.083) 10.458 9.653 ( -10.002 -8.637 -5.055) 14.149 10.011 ( 6.309 8.093 8.370) 13.242 10.241 ( -0.108 5.325 0.028) 5.326 10.515 ( -6.713 6.103 -9.487) 13.127 10.807 ( 1.760 -4.271 1.471) 4.848 11.066 ( -4.604 -0.291 1.024) 4.726 11.671 ( 0.957 4.779 -2.516) 5.485 12.167 ( 0.802 -3.255 -4.009) 5.226 12.478 ( 1.055 -12.272 0.245) 12.320 12.852 ( 4.391 -4.422 2.860) 6.857 13.128 ( -3.348 2.002 1.721) 4.264 13.232 ( 7.911 1.637 -3.150) 8.671 13.691 ( 1.146 -3.784 2.282) 4.565 13.911 ( 4.727 3.528 -0.294) 5.906 14.190 ( -7.437 -4.477 -2.258) 8.970 14.758 ( -1.889 -0.889 2.191) 3.027 15.377 ( 2.567 1.974 4.541) 5.577 18.502 ( 1.016 7.427 -3.682) 8.352 19.213 ( 3.078 -11.254 1.434) 11.755 20.082 ( 4.837 6.666 0.866) 8.282 20.466 ( -10.540 8.723 -2.290) 13.872 22.535 ( 5.226 -5.803 2.880) 8.324 23.819 ( -0.752 0.314 2.150) 2.299 ======================= Grid point 58 (39/433) ======================= 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 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 433 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.162 ( 0.000 21.816 0.000) 21.816 2.658 ( 0.000 24.460 0.000) 24.460 3.796 ( 0.000 24.292 0.000) 24.292 5.128 ( 0.000 1.238 0.000) 1.238 6.106 ( -0.000 -4.753 -0.000) 4.753 7.074 ( -0.000 -14.745 -0.000) 14.745 7.504 ( -0.000 -12.407 -0.000) 12.407 7.944 ( 0.000 4.321 0.000) 4.321 8.307 ( 0.000 5.663 0.000) 5.663 8.555 ( 0.000 1.526 0.000) 1.526 8.766 ( -0.000 -0.357 -0.000) 0.357 9.287 ( 0.000 4.143 0.000) 4.143 9.587 ( -0.000 -15.297 -0.000) 15.297 9.605 ( -0.000 -9.551 -0.000) 9.551 10.082 ( 0.000 3.958 0.000) 3.958 10.178 ( 0.000 6.487 0.000) 6.487 10.312 ( 0.000 8.598 0.000) 8.598 10.890 ( -0.000 -3.731 -0.000) 3.731 11.012 ( 0.000 0.207 0.000) 0.207 11.642 ( 0.000 1.901 0.000) 1.901 12.213 ( -0.000 -6.209 -0.000) 6.209 12.585 ( -0.000 -10.308 -0.000) 10.308 12.978 ( -0.000 -5.551 -0.000) 5.551 13.058 ( 0.000 3.345 0.000) 3.345 13.284 ( 0.000 1.411 0.000) 1.411 13.721 ( -0.000 -0.344 -0.000) 0.344 13.954 ( -0.000 -0.070 -0.000) 0.070 14.116 ( -0.000 -1.801 -0.000) 1.801 14.767 ( -0.000 -2.070 -0.000) 2.070 15.395 ( 0.000 2.392 0.000) 2.392 18.440 ( 0.000 5.341 0.000) 5.341 19.358 ( -0.000 -10.951 -0.000) 10.951 20.035 ( 0.000 11.992 0.000) 11.992 20.286 ( 0.000 7.304 0.000) 7.304 22.646 ( -0.000 -6.491 -0.000) 6.491 23.815 ( 0.000 0.470 0.000) 0.470 ======================= Grid point 67 (40/433) ======================= q-point: (-0.58 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 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 432 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.020 ( -13.098 0.000 -11.206) 17.237 3.245 ( -3.687 0.000 -8.100) 8.900 4.083 ( 7.942 -0.000 0.265) 7.947 5.110 ( 2.112 -0.000 1.843) 2.803 6.133 ( -3.283 0.000 -2.870) 4.361 6.706 ( -2.961 0.000 -5.895) 6.597 7.387 ( 0.642 -0.000 -16.425) 16.437 7.921 ( 7.782 -0.000 3.256) 8.436 8.333 ( -17.756 0.000 4.378) 18.288 8.751 ( -2.398 0.000 -4.045) 4.702 9.124 ( 1.869 -0.000 1.768) 2.573 9.262 ( -4.075 0.000 5.691) 7.000 9.428 ( -9.920 0.000 -9.044) 13.424 9.588 ( -4.171 0.000 1.587) 4.463 10.128 ( 8.166 -0.000 8.353) 11.682 10.231 ( 0.182 -0.000 1.522) 1.533 10.692 ( -12.091 0.000 -1.087) 12.140 10.761 ( -2.337 0.000 -3.881) 4.530 11.143 ( -2.495 0.000 -0.494) 2.544 11.878 ( 7.118 -0.000 -18.929) 20.223 12.140 ( 0.524 -0.000 10.294) 10.307 12.182 ( -3.211 0.000 -2.461) 4.046 12.693 ( 0.147 -0.000 4.762) 4.764 13.157 ( 9.213 -0.000 -6.611) 11.339 13.192 ( -0.519 0.000 -0.153) 0.541 13.511 ( 7.498 -0.000 2.220) 7.820 13.942 ( 3.972 -0.000 -3.960) 5.609 14.168 ( -4.808 0.000 3.623) 6.020 14.787 ( -2.147 0.000 2.655) 3.414 15.337 ( 0.011 -0.000 7.639) 7.639 18.715 ( 1.066 -0.000 -7.978) 8.049 18.912 ( 4.850 -0.000 -3.011) 5.709 20.043 ( 5.813 -0.000 7.112) 9.185 20.864 ( -16.408 0.000 -4.485) 17.010 22.274 ( 10.779 -0.000 7.190) 12.957 23.820 ( -0.921 0.000 3.360) 3.484 ======================= Grid point 69 (41/433) ======================= 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 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.709 ( -10.871 6.192 -8.043) 14.873 3.152 ( -0.184 7.240 -4.830) 8.705 4.167 ( 3.995 4.274 -0.030) 5.850 5.143 ( 0.802 0.504 1.752) 1.992 6.046 ( -4.703 -2.071 -2.758) 5.832 6.720 ( 2.436 -5.694 -2.206) 6.574 7.316 ( -0.588 -3.082 -10.668) 11.119 8.074 ( 1.027 1.682 5.046) 5.417 8.155 ( -1.988 -4.377 3.994) 6.250 8.623 ( -7.119 3.736 -4.286) 9.111 9.167 ( 0.658 -4.758 -0.204) 4.808 9.190 ( -5.119 8.629 -2.174) 10.266 9.286 ( -0.187 -3.963 -0.921) 4.073 9.535 ( -5.059 -3.439 -1.270) 6.247 10.210 ( 5.908 10.901 7.215) 14.346 10.315 ( 2.585 2.104 2.537) 4.189 10.558 ( -5.547 -4.233 -2.933) 7.569 10.683 ( -4.457 -4.118 -1.094) 6.166 11.088 ( -2.533 1.394 -0.956) 3.045 11.798 ( 0.672 6.700 -9.219) 11.417 12.127 ( -1.833 -1.346 -2.212) 3.173 12.259 ( 1.334 -8.552 3.962) 9.519 12.778 ( 4.180 -2.458 3.643) 6.065 13.153 ( -3.196 0.654 0.110) 3.265 13.256 ( 6.982 0.678 -4.746) 8.470 13.626 ( 3.518 -2.034 1.406) 4.300 13.976 ( 3.881 2.347 -2.839) 5.351 14.122 ( -4.587 -2.237 2.017) 5.488 14.746 ( -3.340 -0.339 2.253) 4.043 15.404 ( 2.443 0.728 4.736) 5.379 18.654 ( 0.808 7.001 -4.230) 8.219 19.005 ( 2.435 -8.638 -1.158) 9.049 20.175 ( 6.767 2.614 4.337) 8.452 20.587 ( -11.825 3.378 -3.391) 12.757 22.454 ( 5.495 -2.285 3.598) 6.954 23.823 ( -0.667 0.115 2.152) 2.256 ======================= Grid point 70 (42/433) ======================= 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 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 432 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.497 ( 0.000 12.429 0.000) 12.429 3.034 ( 0.000 13.930 0.000) 13.930 4.126 ( 0.000 10.631 0.000) 10.631 5.148 ( 0.000 0.880 0.000) 0.880 6.022 ( -0.000 -3.603 -0.000) 3.603 6.818 ( -0.000 -10.565 -0.000) 10.565 7.321 ( -0.000 -6.410 -0.000) 6.410 8.013 ( 0.000 3.328 0.000) 3.328 8.334 ( -0.000 -12.391 -0.000) 12.391 8.449 ( 0.000 8.164 0.000) 8.164 9.026 ( 0.000 13.934 0.000) 13.934 9.245 ( -0.000 -8.195 -0.000) 8.195 9.354 ( -0.000 -8.487 -0.000) 8.487 9.490 ( -0.000 -1.132 -0.000) 1.132 10.218 ( 0.000 10.492 0.000) 10.492 10.286 ( 0.000 4.183 0.000) 4.183 10.454 ( 0.000 5.175 0.000) 5.175 10.755 ( -0.000 -10.807 -0.000) 10.807 11.040 ( 0.000 2.315 0.000) 2.315 11.717 ( 0.000 5.558 0.000) 5.558 12.123 ( -0.000 -2.842 -0.000) 2.842 12.374 ( -0.000 -10.832 -0.000) 10.832 12.873 ( -0.000 -4.714 -0.000) 4.714 13.105 ( 0.000 1.625 0.000) 1.625 13.300 ( 0.000 0.423 0.000) 0.423 13.681 ( -0.000 -2.655 -0.000) 2.655 13.986 ( 0.000 2.226 0.000) 2.226 14.090 ( -0.000 -0.848 -0.000) 0.848 14.733 ( -0.000 -1.318 -0.000) 1.318 15.432 ( 0.000 1.342 0.000) 1.342 18.574 ( 0.000 8.035 0.000) 8.035 19.126 ( -0.000 -12.005 -0.000) 12.005 20.223 ( 0.000 7.139 0.000) 7.139 20.410 ( 0.000 4.926 0.000) 4.926 22.541 ( -0.000 -4.068 -0.000) 4.068 23.822 ( 0.000 0.259 0.000) 0.259 ======================= Grid point 82 (43/433) ======================= 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 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 235 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.619 ( 0.000 0.000 0.000) 0.000 3.171 ( 0.000 0.000 0.000) 0.000 4.225 ( 0.000 0.000 0.000) 0.000 5.158 ( 0.000 0.000 0.000) 0.000 5.985 ( 0.000 0.000 0.000) 0.000 6.710 ( 0.000 0.000 0.000) 0.000 7.260 ( 0.000 0.000 0.000) 0.000 8.064 ( -0.000 -0.000 -0.000) 0.000 8.192 ( 0.000 0.000 0.000) 0.000 8.551 ( 0.000 0.000 0.000) 0.000 9.131 ( 0.000 0.000 0.000) 0.000 9.166 ( 0.000 0.000 0.000) 0.000 9.274 ( 0.000 0.000 0.000) 0.000 9.489 ( 0.000 0.000 0.000) 0.000 10.328 ( 0.000 0.000 0.000) 0.000 10.435 ( 0.000 0.000 0.000) 0.000 10.502 ( 0.000 0.000 0.000) 0.000 10.533 ( -0.000 -0.000 -0.000) 0.000 11.070 ( 0.000 0.000 0.000) 0.000 11.797 ( -0.000 -0.000 -0.000) 0.000 12.099 ( 0.000 0.000 0.000) 0.000 12.242 ( 0.000 0.000 0.000) 0.000 12.823 ( 0.000 0.000 0.000) 0.000 13.121 ( 0.000 0.000 0.000) 0.000 13.304 ( 0.000 0.000 0.000) 0.000 13.652 ( 0.000 0.000 0.000) 0.000 14.010 ( 0.000 0.000 0.000) 0.000 14.083 ( 0.000 0.000 0.000) 0.000 14.720 ( 0.000 0.000 0.000) 0.000 15.445 ( 0.000 0.000 0.000) 0.000 18.687 ( -0.000 -0.000 -0.000) 0.000 18.973 ( 0.000 0.000 0.000) 0.000 20.294 ( 0.000 0.000 0.000) 0.000 20.459 ( 0.000 0.000 0.000) 0.000 22.501 ( 0.000 0.000 0.000) 0.000 23.825 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 151 (44/433) ======================= q-point: ( 0.00 0.00 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 433 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.643 ( -8.234 0.000 32.592) 33.616 0.693 ( 18.651 -0.000 35.000) 39.660 1.270 ( 2.411 -0.000 63.065) 63.111 5.007 ( -13.665 0.000 0.324) 13.669 6.384 ( 8.574 -0.000 0.931) 8.624 7.163 ( -5.407 0.000 -13.335) 14.390 8.064 ( -7.014 0.000 0.584) 7.038 8.250 ( 10.072 -0.000 10.750) 14.731 8.449 ( -0.472 0.000 -4.737) 4.761 8.540 ( -41.681 0.000 -5.205) 42.004 8.926 ( -6.659 0.000 -4.306) 7.930 9.224 ( 3.340 -0.000 4.184) 5.354 9.381 ( 8.374 -0.000 2.854) 8.847 9.860 ( -11.909 0.000 8.283) 14.506 10.027 ( 12.957 -0.000 2.706) 13.236 10.092 ( -4.484 0.000 6.074) 7.550 11.008 ( 25.649 -0.000 0.600) 25.656 11.217 ( 2.298 -0.000 -0.621) 2.381 11.663 ( -0.117 0.000 0.283) 0.306 11.819 ( 31.215 -0.000 -1.564) 31.254 12.312 ( -2.232 0.000 -6.603) 6.970 12.468 ( -4.604 0.000 -6.285) 7.791 12.767 ( 13.454 -0.000 -11.412) 17.642 12.807 ( -40.698 0.000 4.703) 40.969 13.243 ( -14.537 0.000 8.008) 16.597 13.547 ( 2.873 -0.000 -1.114) 3.082 13.828 ( -3.283 0.000 2.859) 4.354 14.156 ( -2.392 0.000 -2.062) 3.158 14.816 ( 3.457 -0.000 -10.890) 11.426 17.589 ( 20.413 -0.000 5.970) 21.268 18.557 ( -10.656 0.000 0.321) 10.661 18.614 ( 38.872 -0.000 0.158) 38.872 19.030 ( 7.439 -0.000 0.417) 7.451 19.284 ( -3.384 0.000 0.030) 3.384 23.115 ( -9.735 0.000 0.025) 9.735 23.789 ( -2.594 0.000 0.997) 2.779 ======================= Grid point 152 (45/433) ======================= q-point: ( 0.08 0.00 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.052 ( 11.954 -24.590 23.402) 35.990 1.452 ( 27.413 -11.663 31.030) 43.016 1.849 ( 24.561 -6.941 48.290) 54.620 5.055 ( 11.497 1.844 -9.443) 14.992 6.591 ( 13.241 2.070 7.596) 15.405 7.014 ( -3.737 -4.030 -14.565) 15.567 7.845 ( -10.455 8.076 5.518) 14.317 8.170 ( 1.599 7.940 6.110) 10.145 8.458 ( -3.399 -6.054 -1.016) 7.017 8.540 ( 5.530 -6.431 8.893) 12.290 8.744 ( -11.260 -8.407 -5.006) 14.917 9.272 ( 5.330 5.558 9.717) 12.398 9.549 ( 5.232 7.948 5.487) 10.984 9.809 ( 1.608 -2.424 -2.298) 3.707 9.994 ( -6.373 -3.941 6.823) 10.134 10.401 ( 17.283 -3.388 8.819) 19.697 11.074 ( -7.380 10.447 0.393) 12.797 11.191 ( -1.884 -2.234 1.459) 3.267 11.536 ( -4.039 17.990 8.034) 20.112 11.876 ( -10.306 -3.598 2.407) 11.179 12.145 ( -4.773 3.890 -8.127) 10.196 12.496 ( -7.672 -4.292 -2.215) 9.066 12.690 ( 11.299 -12.832 -4.019) 17.564 12.901 ( 6.189 -3.687 -9.401) 11.844 13.039 ( -13.393 -1.348 3.926) 14.021 13.597 ( 3.410 2.165 -5.842) 7.102 13.834 ( 2.152 -0.702 0.628) 2.349 14.084 ( -6.497 -5.773 -4.741) 9.900 14.814 ( 3.099 0.200 -9.790) 10.271 16.728 ( -32.860 34.498 36.522) 60.032 18.360 ( -9.427 1.312 -4.192) 10.400 19.180 ( 3.679 0.735 -0.561) 3.794 19.309 ( 4.979 -13.042 0.121) 13.960 19.823 ( 38.322 -12.795 -28.222) 49.282 23.008 ( -2.936 2.452 4.846) 6.174 23.767 ( -0.919 0.346 -0.489) 1.097 ======================= Grid point 153 (46/433) ======================= q-point: ( 0.17 0.00 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 794 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.645 ( 16.659 -20.700 18.765) 32.529 2.067 ( 12.176 -11.746 34.879) 38.765 2.726 ( 36.840 -13.643 24.865) 46.493 5.110 ( 5.761 4.348 -9.751) 12.132 6.804 ( 7.096 3.962 3.564) 8.875 7.022 ( 8.691 -9.062 -3.378) 13.002 7.695 ( -3.873 8.251 1.167) 9.189 8.165 ( -4.794 1.833 -6.783) 8.506 8.278 ( -5.829 3.978 0.093) 7.057 8.658 ( 2.732 -10.432 0.534) 10.797 8.930 ( 8.680 -6.610 13.646) 17.471 9.368 ( -3.823 -6.661 10.121) 12.705 9.570 ( 13.199 17.480 4.670) 22.395 9.770 ( -5.548 0.791 -3.158) 6.432 10.078 ( 3.742 -4.862 6.117) 8.664 10.707 ( -0.001 7.114 -1.156) 7.207 10.783 ( -1.983 4.651 9.775) 11.006 11.170 ( -5.816 -0.551 9.329) 11.007 11.378 ( -1.035 12.948 6.157) 14.375 11.790 ( -6.269 -3.134 0.173) 7.011 12.003 ( -6.515 -3.091 -9.192) 11.683 12.344 ( -7.507 4.065 -0.708) 8.567 12.794 ( -14.528 -1.013 5.778) 15.668 12.951 ( 10.972 -5.521 -6.216) 13.766 13.027 ( 4.134 -8.352 -10.908) 14.346 13.558 ( -0.810 2.938 -3.407) 4.571 13.876 ( 1.814 0.018 -4.219) 4.593 14.021 ( -5.158 -9.751 -5.317) 12.245 14.786 ( 0.289 1.181 -7.041) 7.145 16.309 ( -11.460 22.984 25.277) 36.035 18.213 ( -4.027 -0.712 -4.887) 6.373 19.176 ( -1.824 -3.755 -4.802) 6.363 19.592 ( 11.798 -9.216 1.833) 15.082 20.113 ( 8.967 -4.236 -9.107) 13.464 22.956 ( -2.316 6.562 2.823) 7.510 23.744 ( -0.407 0.088 -2.462) 2.497 ======================= Grid point 154 (47/433) ======================= q-point: ( 0.25 0.00 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.197 ( 15.572 -15.105 16.326) 27.151 2.545 ( 9.797 -11.465 26.659) 30.629 3.520 ( 27.605 -12.906 14.776) 33.866 5.061 ( 0.079 5.193 -6.280) 8.150 6.826 ( 0.599 -0.463 -4.379) 4.444 7.371 ( 13.730 -2.576 10.864) 17.697 7.514 ( -1.512 6.481 -4.771) 8.189 7.944 ( -10.307 -5.106 -9.094) 14.663 8.285 ( 6.356 7.427 1.320) 9.865 8.866 ( 9.282 -8.016 3.394) 12.726 9.105 ( 0.442 1.405 7.517) 7.660 9.423 ( -2.057 -2.841 4.754) 5.908 9.626 ( -6.401 -1.790 -0.092) 6.647 9.704 ( 9.784 10.397 6.646) 15.748 10.156 ( -4.076 1.726 7.217) 8.466 10.437 ( -4.339 1.703 -4.981) 6.822 10.919 ( 0.921 4.130 6.617) 7.854 11.179 ( 2.311 4.422 13.185) 14.097 11.332 ( 2.133 4.082 2.593) 5.286 11.676 ( -9.097 0.431 -4.563) 10.186 11.853 ( -8.663 -3.463 -6.070) 11.130 12.250 ( 0.055 1.687 2.923) 3.375 12.601 ( -13.247 -0.914 4.518) 14.026 13.020 ( 2.647 -3.474 -13.774) 14.450 13.176 ( 7.264 -3.671 0.734) 8.172 13.497 ( -3.526 -1.588 -0.943) 3.980 13.821 ( -2.650 -1.903 -10.991) 11.465 14.044 ( -0.057 -5.367 -1.226) 5.506 14.714 ( -3.174 1.979 -3.786) 5.322 16.125 ( -3.033 16.961 13.920) 22.151 18.189 ( 1.642 -4.257 -4.398) 6.337 19.146 ( -2.618 -4.663 -6.143) 8.145 19.807 ( 5.455 -0.633 -0.094) 5.492 20.272 ( 7.952 -8.788 3.869) 12.467 22.820 ( -5.706 10.500 1.325) 12.023 23.724 ( 0.401 -0.349 -4.297) 4.330 ======================= Grid point 155 (48/433) ======================= q-point: ( 0.33 0.00 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 794 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.616 ( 9.663 -8.988 12.180) 17.959 2.926 ( 8.101 -9.302 16.528) 20.624 4.053 ( 15.598 -9.490 8.468) 20.126 4.949 ( -3.631 5.190 -3.024) 7.019 6.762 ( -6.150 2.891 -1.053) 6.877 7.260 ( -3.178 2.066 -6.637) 7.644 7.816 ( -5.391 -5.689 -9.867) 12.601 7.901 ( 21.882 -5.098 12.217) 25.574 8.333 ( 7.867 8.488 1.130) 11.628 9.047 ( 2.353 5.737 -2.220) 6.586 9.152 ( 5.587 -5.638 6.970) 10.563 9.253 ( -12.863 3.849 -6.273) 14.820 9.555 ( -7.194 4.771 7.532) 11.457 9.824 ( 9.880 2.073 4.633) 11.108 10.123 ( -2.380 -3.288 3.737) 5.517 10.430 ( 1.275 -2.256 -6.390) 6.895 10.863 ( -6.143 2.840 6.641) 9.482 11.243 ( 3.818 5.463 3.483) 7.520 11.347 ( -5.053 -2.603 -4.413) 7.196 11.496 ( -1.085 2.848 0.913) 3.182 11.754 ( -3.908 1.056 2.637) 4.831 12.264 ( -3.355 2.750 3.640) 5.663 12.469 ( -4.435 -1.701 3.718) 6.032 13.018 ( 1.795 -7.682 -11.867) 14.251 13.265 ( 0.836 4.164 2.816) 5.096 13.497 ( -1.005 -7.927 1.027) 8.057 13.732 ( -0.411 0.091 -10.807) 10.815 14.075 ( -0.657 -1.742 1.118) 2.171 14.605 ( -5.138 2.281 -1.334) 5.778 16.025 ( 0.017 11.300 5.241) 12.456 18.285 ( 5.690 -7.069 -3.618) 9.769 19.109 ( -2.907 -5.057 -6.092) 8.434 19.806 ( -2.137 5.079 3.711) 6.644 20.578 ( 11.592 -10.308 6.624) 16.867 22.591 ( -8.302 12.071 -1.106) 14.692 23.717 ( 1.326 -0.755 -4.444) 4.699 ======================= Grid point 156 (49/433) ======================= q-point: ( 0.42 0.00 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.804 ( 0.308 -2.216 3.192) 3.898 3.171 ( 3.790 -3.909 8.945) 10.472 4.333 ( 5.465 -4.992 2.337) 7.762 4.839 ( -3.270 2.099 2.314) 4.523 6.596 ( -7.548 3.135 1.089) 8.245 7.236 ( 1.971 -2.831 -6.180) 7.078 7.758 ( -1.160 -7.684 -11.440) 13.830 8.271 ( 7.374 1.836 10.406) 12.886 8.432 ( 12.973 5.706 2.440) 14.381 8.944 ( -7.394 2.210 -6.096) 9.834 8.990 ( -4.217 7.646 -2.019) 8.962 9.218 ( -4.479 0.199 -2.952) 5.368 9.554 ( 7.902 2.494 6.103) 10.291 9.977 ( 3.812 -0.346 1.115) 3.986 10.119 ( -0.406 -0.396 -3.409) 3.456 10.387 ( -3.687 -2.254 -3.552) 5.594 10.755 ( -8.358 -0.528 1.603) 8.527 11.231 ( -2.469 -3.807 -7.207) 8.517 11.264 ( 0.578 1.754 -0.636) 1.953 11.540 ( 0.374 -2.620 0.189) 2.653 11.734 ( 2.461 9.220 12.471) 15.703 12.128 ( -7.856 3.704 2.071) 8.929 12.475 ( 0.297 1.883 0.371) 1.942 13.119 ( 4.783 -8.987 -10.381) 14.540 13.217 ( -1.735 -2.236 3.819) 4.754 13.562 ( -2.479 -4.586 1.323) 5.378 13.704 ( 4.611 3.679 -0.816) 5.955 14.067 ( -2.023 0.229 2.323) 3.088 14.511 ( -2.789 1.449 0.150) 3.147 15.961 ( -0.080 5.358 -0.783) 5.415 18.446 ( 6.285 -7.785 -2.259) 10.257 19.076 ( -2.920 -6.002 -6.148) 9.075 19.735 ( -3.062 6.968 9.232) 11.965 20.865 ( 8.056 -4.797 5.014) 10.633 22.334 ( -6.955 9.001 -3.974) 12.049 23.734 ( 2.280 -1.251 -2.599) 3.677 ======================= Grid point 157 (50/433) ======================= q-point: (-0.50 0.00 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 794 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.707 ( -8.900 4.223 -6.904) 12.030 3.209 ( -4.599 3.261 3.553) 6.664 4.338 ( -5.015 1.707 -3.960) 6.614 4.885 ( 2.822 -4.335 8.632) 10.063 6.527 ( -0.551 -2.029 2.180) 3.028 7.246 ( -0.496 -3.100 -5.770) 6.569 7.791 ( 2.280 -9.711 -10.579) 14.540 8.296 ( -1.563 7.722 6.039) 9.927 8.508 ( -1.951 6.302 0.510) 6.617 8.820 ( -0.980 1.280 -3.110) 3.503 8.907 ( 2.089 0.128 -5.901) 6.262 9.140 ( 3.569 4.510 -6.082) 8.371 9.627 ( -4.517 2.767 0.801) 5.357 9.886 ( -3.505 4.173 -9.098) 10.605 10.148 ( 3.187 0.336 0.088) 3.206 10.390 ( 0.522 -3.231 2.412) 4.066 10.639 ( -5.548 -2.987 -4.671) 7.844 11.194 ( -3.379 -5.915 -9.228) 11.470 11.250 ( -0.805 0.436 -0.379) 0.991 11.529 ( -3.701 -3.466 -0.287) 5.079 11.799 ( 7.907 13.265 13.858) 20.749 12.027 ( -0.766 2.724 1.585) 3.243 12.424 ( -2.095 2.584 -4.992) 5.999 13.099 ( -0.117 0.309 -3.369) 3.385 13.403 ( 3.407 -10.971 2.897) 11.848 13.537 ( -0.570 -3.059 -1.124) 3.309 13.771 ( 2.738 3.671 9.873) 10.884 14.060 ( 1.514 1.284 1.691) 2.608 14.495 ( 1.096 0.683 1.916) 2.310 15.902 ( -2.104 -0.131 -4.915) 5.348 18.576 ( 0.709 -5.641 0.557) 5.713 19.071 ( 0.081 -7.513 -6.106) 9.682 19.704 ( -0.410 6.789 12.426) 14.166 20.931 ( -2.428 6.633 1.022) 7.137 22.204 ( 1.113 -0.312 -5.335) 5.459 23.784 ( 2.645 -1.681 0.243) 3.143 ======================= Grid point 158 (51/433) ======================= q-point: (-0.42 0.00 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.379 ( -15.506 7.876 -12.329) 21.319 2.995 ( -14.388 9.569 -0.986) 17.308 4.134 ( -11.562 6.338 -4.685) 13.993 5.056 ( 4.668 -5.660 8.479) 11.212 6.638 ( 5.502 -7.505 2.525) 9.642 7.213 ( -2.915 -4.886 -7.161) 9.146 7.840 ( -0.937 -6.034 -7.330) 9.540 8.197 ( -2.371 11.716 7.334) 14.024 8.328 ( -8.915 1.596 -3.497) 9.709 8.835 ( 2.564 1.702 -9.441) 9.930 8.970 ( 10.043 -3.469 -3.340) 11.138 9.159 ( 5.625 3.852 -5.988) 9.074 9.415 ( -6.594 5.230 -6.840) 10.845 9.732 ( -7.596 3.425 -4.965) 9.700 10.138 ( -6.976 0.396 1.850) 7.228 10.438 ( 4.400 0.402 -4.152) 6.063 10.595 ( -2.005 -4.224 -3.324) 5.737 11.080 ( -8.844 -4.600 -11.841) 15.479 11.234 ( -0.965 -1.606 -1.400) 2.339 11.546 ( 2.235 -2.526 3.565) 4.907 11.885 ( 8.706 11.134 7.296) 15.906 12.068 ( 5.969 2.490 3.312) 7.266 12.306 ( -2.504 4.185 -8.364) 9.682 13.132 ( 3.031 -2.954 1.927) 4.650 13.424 ( -4.045 -0.198 5.346) 6.707 13.659 ( 3.637 -4.010 -0.516) 5.438 13.854 ( 0.996 -4.786 9.844) 10.991 14.120 ( 6.810 4.831 3.859) 9.198 14.543 ( 3.254 0.531 2.923) 4.406 15.827 ( -4.978 -4.369 -8.279) 10.602 18.565 ( -7.242 -3.113 3.021) 8.442 19.174 ( 5.574 -8.152 -2.255) 10.130 19.731 ( 1.906 5.236 10.440) 11.834 20.694 ( -10.836 14.767 -3.359) 18.621 22.298 ( 8.160 -6.874 -5.419) 11.966 23.848 ( 1.788 -1.763 2.688) 3.679 ======================= Grid point 159 (52/433) ======================= q-point: (-0.33 0.00 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 794 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.930 ( -19.532 8.626 -11.234) 24.127 2.555 ( -22.729 13.350 -4.213) 26.694 3.755 ( -20.259 13.806 -4.168) 24.868 5.238 ( 4.489 -6.549 7.223) 10.734 6.778 ( -2.965 -9.240 -3.712) 10.390 7.211 ( 3.236 -5.570 -3.007) 7.109 7.765 ( -4.435 3.766 1.769) 6.081 8.160 ( 4.490 7.974 8.278) 12.340 8.216 ( -5.088 -7.189 -6.823) 11.141 8.708 ( -3.110 5.807 -13.762) 15.257 9.115 ( -3.233 -1.602 1.315) 3.840 9.120 ( 4.885 8.470 -7.577) 12.370 9.471 ( 15.454 -1.578 -3.444) 15.911 9.527 ( -2.456 2.026 -7.489) 8.137 9.962 ( -13.437 -3.911 -2.874) 14.287 10.473 ( 2.516 1.560 -2.162) 3.666 10.563 ( -3.801 -4.237 -5.429) 7.866 10.874 ( -10.107 -1.475 -11.889) 15.673 11.235 ( -0.581 -3.156 -1.407) 3.504 11.663 ( 4.380 -1.936 2.301) 5.313 11.966 ( 8.993 6.165 0.199) 10.905 12.183 ( 8.167 1.606 -1.602) 8.476 12.216 ( 4.150 7.838 0.446) 8.880 13.261 ( 4.060 -5.853 5.034) 8.722 13.399 ( -2.654 1.023 5.703) 6.373 13.684 ( -1.149 2.494 4.499) 5.271 13.986 ( -0.018 -9.308 3.260) 9.862 14.222 ( 8.217 8.092 7.829) 13.939 14.619 ( 4.329 0.135 2.244) 4.878 15.717 ( -7.680 -6.819 -11.697) 15.566 18.483 ( -8.415 -3.635 5.308) 10.592 19.335 ( 4.248 -4.666 3.429) 7.182 19.781 ( 3.225 2.302 3.908) 5.565 20.315 ( -11.974 16.390 -5.494) 21.028 22.492 ( 9.922 -7.588 -5.818) 13.779 23.900 ( -0.108 -1.469 4.094) 4.351 ======================= Grid point 160 (53/433) ======================= q-point: (-0.25 0.00 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.457 ( -22.052 8.059 -2.536) 23.615 1.962 ( -28.678 14.067 -4.718) 32.289 3.129 ( -31.110 23.739 -2.190) 39.194 5.416 ( 2.529 -9.767 5.385) 11.437 6.649 ( -12.745 -6.559 -10.884) 17.997 7.347 ( 6.798 4.935 6.920) 10.883 7.769 ( 1.237 -5.864 9.237) 11.011 8.169 ( -4.855 -8.503 -7.623) 12.409 8.246 ( 4.654 1.316 1.354) 5.023 8.573 ( 4.929 6.063 -6.299) 10.036 8.903 ( -11.842 9.265 -2.761) 15.287 9.111 ( 4.677 8.284 0.216) 9.515 9.405 ( 3.199 4.930 -7.610) 9.615 9.786 ( -8.801 -5.855 -1.228) 10.642 9.911 ( 18.015 -12.462 -4.683) 22.400 10.445 ( -0.960 2.545 -1.951) 3.347 10.522 ( -0.770 -5.865 -10.271) 11.852 10.654 ( -9.568 -0.909 -7.821) 12.391 11.255 ( -0.565 -4.079 -0.881) 4.211 11.691 ( 1.115 2.854 -3.803) 4.883 12.109 ( 11.726 -1.571 -2.517) 12.096 12.260 ( 9.618 3.763 -2.819) 10.706 12.320 ( 9.556 7.465 5.672) 13.387 13.344 ( -3.828 2.354 6.921) 8.252 13.440 ( 2.877 -5.001 6.522) 8.708 13.662 ( -1.312 1.775 4.451) 4.969 14.044 ( -3.277 -5.505 1.169) 6.512 14.315 ( 6.037 8.776 9.312) 14.148 14.711 ( 4.986 -0.756 1.990) 5.421 15.561 ( -9.320 -6.970 -15.284) 19.211 18.444 ( -5.872 -5.859 7.176) 10.968 19.395 ( -2.753 1.334 4.870) 5.751 19.797 ( -3.855 6.210 0.202) 7.312 20.002 ( -0.241 7.651 -8.965) 11.788 22.688 ( 9.682 -6.408 -5.388) 12.800 23.919 ( -2.243 -1.023 4.644) 5.258 ======================= Grid point 161 (54/433) ======================= q-point: (-0.17 0.00 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 794 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.049 ( -22.626 5.675 16.136) 28.364 1.313 ( -31.906 11.614 1.123) 33.973 2.261 ( -39.262 33.832 3.307) 51.934 5.546 ( -3.747 -14.543 -1.764) 15.121 6.442 ( -9.044 -3.259 -9.435) 13.469 7.390 ( 2.487 9.266 6.070) 11.353 7.995 ( 0.451 -18.374 21.172) 28.037 8.098 ( -4.304 -5.191 -8.085) 10.528 8.306 ( 3.204 -2.713 -4.982) 6.515 8.480 ( -9.482 9.597 0.748) 13.512 8.860 ( 11.008 -5.085 3.672) 12.669 9.111 ( 10.240 16.822 5.635) 20.483 9.401 ( 7.097 4.616 -7.402) 11.246 9.737 ( -0.854 -4.727 -4.491) 6.576 10.089 ( -1.666 3.306 1.406) 3.961 10.380 ( -7.628 0.251 -3.802) 8.527 10.474 ( -5.830 -5.812 -11.982) 14.538 10.677 ( 15.608 -9.329 -2.976) 18.425 11.286 ( 0.350 -3.921 -0.063) 3.937 11.665 ( 2.937 2.653 -4.306) 5.849 12.311 ( 9.350 -4.042 -3.145) 10.661 12.389 ( 13.063 3.725 -5.404) 14.619 12.420 ( 8.500 9.006 4.590) 13.207 13.269 ( -4.967 4.906 7.092) 9.952 13.501 ( -6.183 -0.393 10.099) 11.848 13.723 ( 5.368 -4.518 1.404) 7.155 14.003 ( -5.278 -0.805 -0.120) 5.340 14.344 ( 0.292 6.088 4.536) 7.598 14.831 ( 5.432 -1.052 6.337) 8.412 15.371 ( -7.684 -4.021 -13.289) 15.869 18.489 ( -2.571 -8.269 7.857) 11.693 19.283 ( -8.358 3.916 -1.331) 9.325 19.562 ( -7.805 12.924 2.696) 15.337 19.993 ( 4.966 0.879 -18.144) 18.832 22.877 ( 9.447 -5.690 -2.919) 11.408 23.903 ( -3.906 -0.724 4.540) 6.033 ======================= Grid point 162 (55/433) ======================= q-point: (-0.08 0.00 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.690 ( -32.933 -4.921 12.835) 35.686 0.922 ( -14.244 9.859 42.379) 45.783 1.307 ( -35.353 38.612 22.799) 57.101 5.451 ( -20.523 -12.438 -18.013) 30.006 6.329 ( -1.300 -1.173 -4.801) 5.110 7.321 ( -2.955 4.589 -5.701) 7.892 8.084 ( 2.999 -1.603 0.901) 3.518 8.198 ( -9.432 2.549 2.346) 10.048 8.395 ( -2.712 -20.952 0.846) 21.144 8.504 ( 4.249 -29.941 26.186) 40.002 8.984 ( 0.581 -4.872 -3.758) 6.181 9.327 ( 11.940 8.143 5.844) 15.589 9.411 ( 13.576 19.112 -21.074) 31.523 9.793 ( 7.817 -1.621 -2.794) 8.458 10.070 ( 5.362 13.065 9.784) 17.181 10.228 ( -6.117 2.797 5.986) 9.004 10.302 ( -2.850 -1.787 8.796) 9.417 11.035 ( 14.266 -8.832 -1.981) 16.895 11.371 ( 4.053 -6.864 4.697) 9.252 11.684 ( 5.204 4.407 -2.466) 7.252 12.381 ( 2.195 4.698 -3.371) 6.185 12.486 ( 7.477 4.652 -2.917) 9.277 12.583 ( 15.127 0.734 -7.429) 16.869 13.207 ( -3.845 0.977 5.617) 6.877 13.408 ( -11.268 0.302 9.184) 14.540 13.814 ( -2.823 2.293 -14.575) 15.022 13.886 ( -8.541 -1.975 1.143) 8.841 14.233 ( -7.480 2.036 -3.472) 8.494 14.877 ( -1.684 1.288 -10.014) 10.236 15.603 ( 37.260 -12.794 52.877) 65.939 18.590 ( -2.174 -8.844 6.876) 11.411 19.073 ( -6.228 6.271 -4.861) 10.087 19.375 ( -6.281 5.416 1.891) 8.506 19.693 ( -17.689 21.595 -40.467) 49.161 23.083 ( 8.633 -6.893 -1.509) 11.150 23.857 ( -5.259 -0.557 2.794) 5.981 ======================= Grid point 164 (56/433) ======================= q-point: ( 0.08 0.08 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 432 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.417 ( 25.345 -0.000 18.728) 31.514 1.944 ( 14.176 -0.000 37.187) 39.798 2.599 ( 37.413 -0.000 29.830) 47.850 5.162 ( 7.307 -0.000 -13.368) 15.234 6.862 ( -1.544 0.000 -13.063) 13.154 6.914 ( 16.925 -0.000 13.141) 21.428 7.788 ( -3.726 0.000 1.999) 4.228 8.183 ( -17.940 0.000 -9.736) 20.412 8.376 ( 10.473 -0.000 5.783) 11.963 8.470 ( -2.584 0.000 -2.387) 3.518 8.845 ( 11.411 -0.000 18.160) 21.447 9.316 ( -3.988 0.000 9.245) 10.069 9.757 ( -1.404 0.000 -5.269) 5.453 9.857 ( 8.018 -0.000 -1.480) 8.153 9.945 ( 2.422 -0.000 14.722) 14.920 10.735 ( 15.249 -0.000 6.935) 16.751 10.891 ( -17.653 0.000 4.124) 18.129 11.127 ( -5.350 0.000 4.566) 7.034 11.620 ( -11.193 0.000 8.872) 14.283 11.631 ( -1.663 0.000 1.298) 2.109 12.030 ( -9.240 0.000 -7.510) 11.907 12.394 ( -3.956 0.000 -1.873) 4.377 12.778 ( -16.000 0.000 6.693) 17.344 12.839 ( 14.401 -0.000 -1.306) 14.460 12.961 ( 6.824 -0.000 -15.431) 16.872 13.594 ( -1.239 0.000 -7.173) 7.280 13.897 ( -6.966 0.000 -7.278) 10.074 13.897 ( 4.946 -0.000 0.655) 4.989 14.798 ( 0.580 -0.000 -7.067) 7.091 16.567 ( -21.905 0.000 26.255) 34.193 18.214 ( -4.350 0.000 -7.798) 8.929 19.111 ( -2.946 0.000 -6.406) 7.051 19.507 ( 16.643 -0.000 5.793) 17.623 20.065 ( 12.075 -0.000 -13.076) 17.798 23.022 ( -1.477 0.000 3.535) 3.831 23.746 ( -0.757 0.000 -2.327) 2.447 ======================= Grid point 165 (57/433) ======================= q-point: ( 0.17 0.08 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.985 ( 24.975 -6.048 15.611) 30.067 2.376 ( 10.307 -5.062 31.165) 33.213 3.348 ( 30.832 -4.507 18.444) 36.209 5.146 ( 1.123 2.835 -8.871) 9.381 6.794 ( 0.691 -1.585 -9.849) 10.000 7.329 ( 21.208 -0.884 15.995) 26.578 7.679 ( -8.974 8.727 -5.543) 13.690 7.833 ( -13.137 -6.690 -8.386) 16.961 8.426 ( 4.418 6.542 1.146) 7.977 8.680 ( 12.526 -8.931 3.422) 15.760 9.133 ( 7.951 0.997 14.723) 16.763 9.324 ( -2.210 -4.258 10.167) 11.242 9.593 ( -11.511 -0.687 -5.580) 12.810 9.932 ( 9.225 10.572 1.852) 14.153 10.129 ( 1.607 -4.823 7.644) 9.180 10.503 ( -16.977 3.444 -3.532) 17.679 11.007 ( 1.877 5.497 6.939) 9.049 11.134 ( 2.656 -6.657 9.240) 11.694 11.483 ( -3.013 8.165 3.662) 9.443 11.629 ( -4.969 -3.371 -0.213) 6.008 11.839 ( -7.935 0.001 -1.301) 8.041 12.311 ( -2.151 3.246 1.078) 4.040 12.571 ( -14.043 -1.713 5.884) 15.322 12.968 ( 4.073 -1.163 -15.600) 16.165 13.079 ( 10.869 -4.914 0.441) 11.936 13.487 ( -6.409 0.235 -3.567) 7.339 13.768 ( -2.925 -2.013 -11.382) 11.923 13.994 ( 5.008 -0.845 0.513) 5.104 14.743 ( -2.867 0.833 -3.856) 4.877 16.380 ( -11.277 7.804 15.398) 20.620 18.140 ( 1.097 -1.074 -8.257) 8.399 19.044 ( -2.723 -4.055 -7.692) 9.112 19.832 ( 16.521 2.021 5.827) 17.635 20.135 ( 2.338 -4.706 -0.722) 5.304 22.964 ( -5.794 4.047 2.413) 7.468 23.720 ( 0.260 -0.119 -4.568) 4.577 ======================= Grid point 166 (58/433) ======================= q-point: ( 0.25 0.08 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.494 ( 18.590 -3.493 13.968) 23.514 2.758 ( 9.618 -7.732 20.629) 24.038 3.896 ( 18.414 -5.984 10.282) 21.923 5.053 ( -2.722 4.754 -4.847) 7.315 6.764 ( -2.667 -1.622 -5.118) 5.995 7.324 ( -11.391 3.933 -9.612) 15.415 7.694 ( -3.203 -5.500 -3.424) 7.227 7.877 ( 23.095 0.506 11.125) 25.640 8.463 ( 5.376 4.431 1.359) 7.098 9.003 ( 14.028 -6.311 3.180) 15.707 9.179 ( -1.926 6.191 3.699) 7.464 9.281 ( -13.293 0.155 -7.110) 15.076 9.541 ( -0.505 -6.026 15.990) 17.095 9.927 ( -2.597 7.780 4.498) 9.355 10.108 ( -2.186 1.043 -0.252) 2.436 10.372 ( 1.030 -3.345 -4.770) 5.916 10.945 ( -5.442 4.542 5.481) 8.960 11.223 ( -6.621 -7.506 -4.217) 10.861 11.379 ( -0.600 7.502 1.215) 7.624 11.547 ( -3.660 1.937 -0.924) 4.243 11.813 ( 2.363 3.027 11.327) 11.960 12.313 ( -0.202 2.315 6.095) 6.523 12.425 ( -6.447 -2.623 3.823) 7.941 12.927 ( 0.994 -1.467 -14.784) 14.890 13.284 ( 5.089 -8.169 1.798) 9.791 13.355 ( -7.539 0.308 -0.975) 7.608 13.708 ( 2.653 -1.607 -11.775) 12.177 14.073 ( 3.362 0.639 1.627) 3.789 14.643 ( -5.647 1.560 -1.037) 5.950 16.219 ( -7.009 7.949 6.118) 12.237 18.177 ( 5.800 -4.029 -7.206) 10.090 18.997 ( -2.890 -5.437 -8.139) 10.206 19.946 ( 1.687 8.869 5.164) 10.401 20.378 ( 13.426 -10.410 8.093) 18.817 22.778 ( -10.823 7.027 0.139) 12.905 23.707 ( 1.586 -0.293 -5.326) 5.565 ======================= Grid point 167 (59/433) ======================= q-point: ( 0.33 0.08 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.793 ( 7.396 1.143 8.415) 11.262 3.086 ( 9.754 -5.181 11.574) 15.998 4.207 ( 7.084 -6.667 4.002) 10.519 4.922 ( -3.855 5.544 -1.487) 6.914 6.627 ( -11.099 0.145 -0.933) 11.139 7.185 ( 1.643 -2.365 -9.978) 10.386 7.629 ( -3.241 -5.184 -9.857) 11.599 8.301 ( 14.235 2.514 12.839) 19.334 8.545 ( 9.132 2.854 1.949) 9.764 8.929 ( -15.662 -2.420 -9.982) 18.729 9.135 ( -2.903 7.861 2.864) 8.856 9.239 ( 6.094 1.809 1.298) 6.488 9.598 ( 0.113 1.653 10.123) 10.258 9.935 ( 1.564 -4.607 4.394) 6.556 10.100 ( 1.911 0.394 -3.750) 4.228 10.357 ( -2.730 -1.221 -6.457) 7.116 10.813 ( -6.378 5.108 0.227) 8.174 11.108 ( -7.712 -7.361 -5.755) 12.115 11.336 ( 0.327 4.627 0.057) 4.638 11.482 ( -2.989 -2.067 -1.791) 4.051 11.929 ( 7.179 9.009 15.597) 19.390 12.205 ( -7.988 4.228 4.766) 10.218 12.510 ( 4.357 1.047 3.990) 6.000 12.912 ( 4.141 -8.375 -11.280) 14.646 13.215 ( -7.927 -1.132 -2.324) 8.338 13.414 ( -1.074 -9.296 0.865) 9.398 13.758 ( 8.851 1.974 -4.163) 9.978 14.104 ( 0.436 2.937 3.502) 4.592 14.536 ( -4.774 0.984 0.883) 4.954 16.065 ( -6.020 5.071 -0.656) 7.899 18.308 ( 8.087 -6.199 -5.633) 11.643 18.953 ( -3.064 -6.008 -8.016) 10.476 19.892 ( -2.219 8.579 9.932) 13.310 20.757 ( 14.760 -6.133 8.461) 18.085 22.492 ( -13.476 6.952 -3.216) 15.501 23.717 ( 2.687 -0.510 -3.934) 4.791 ======================= Grid point 168 (60/433) ======================= q-point: ( 0.42 0.08 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.819 ( -1.498 6.939 -2.463) 7.514 3.269 ( 3.099 2.565 6.130) 7.332 4.305 ( -2.836 -4.923 -2.753) 6.314 4.855 ( 0.464 1.563 4.829) 5.097 6.474 ( -7.133 -3.327 0.520) 7.888 7.199 ( 1.272 -2.082 -7.981) 8.346 7.607 ( 1.334 -8.545 -11.686) 14.538 8.349 ( -9.206 -0.651 2.500) 9.562 8.686 ( 6.399 6.996 -0.687) 9.506 8.794 ( 2.103 -3.309 0.859) 4.014 8.968 ( -7.136 9.047 -0.535) 11.535 9.241 ( 3.360 6.266 -1.506) 7.268 9.661 ( -3.219 0.498 4.683) 5.705 9.941 ( -4.947 0.713 -5.481) 7.418 10.145 ( 6.218 -0.532 -1.931) 6.533 10.314 ( 0.956 -4.049 -0.535) 4.195 10.668 ( -2.591 5.107 -6.223) 8.457 11.050 ( -5.984 -8.273 -5.351) 11.528 11.289 ( -1.547 2.986 -0.163) 3.367 11.464 ( -1.288 -3.066 -0.973) 3.465 12.026 ( 4.622 8.536 7.561) 12.304 12.110 ( -0.026 6.832 10.159) 12.243 12.494 ( -1.057 5.050 -3.386) 6.171 13.071 ( 1.965 -4.560 -6.492) 8.174 13.152 ( 3.134 -11.258 1.165) 11.744 13.448 ( -4.018 -7.872 -1.089) 8.905 13.856 ( 3.622 4.902 6.156) 8.663 14.106 ( 3.685 3.376 2.963) 5.810 14.502 ( -0.269 -0.238 2.694) 2.718 15.913 ( -6.733 1.148 -4.848) 8.376 18.464 ( 5.534 -5.689 -3.359) 8.618 18.926 ( -1.298 -7.049 -7.450) 10.338 19.849 ( -1.551 7.669 13.016) 15.187 21.027 ( 8.400 3.168 6.220) 10.922 22.213 ( -9.703 1.182 -5.696) 11.313 23.758 ( 3.177 -0.919 -1.202) 3.520 ======================= Grid point 169 (61/433) ======================= q-point: (-0.50 0.08 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.595 ( -7.620 13.685 -11.532) 19.451 3.191 ( -7.611 10.423 0.642) 12.922 4.199 ( -8.541 0.084 -5.045) 9.921 4.961 ( 4.359 -3.854 8.511) 10.310 6.481 ( 0.016 -8.500 1.320) 8.601 7.145 ( -3.429 -2.270 -9.079) 9.967 7.683 ( 3.516 -9.723 -9.818) 14.258 8.192 ( -11.121 -5.591 -1.298) 12.514 8.617 ( -3.946 20.425 5.073) 21.412 8.805 ( 3.833 -4.179 -5.814) 8.121 8.928 ( 4.678 -0.124 -0.824) 4.752 9.219 ( -1.770 3.151 -1.839) 4.055 9.521 ( -4.925 4.771 -3.491) 7.694 9.775 ( -8.039 1.935 -6.250) 10.365 10.197 ( -2.337 3.522 3.564) 5.528 10.434 ( 7.760 -2.900 -2.679) 8.707 10.560 ( -0.296 2.970 -9.182) 9.655 10.966 ( -8.088 -6.912 -8.604) 13.682 11.236 ( -1.434 1.769 -0.175) 2.284 11.493 ( 1.657 -2.925 1.515) 3.687 12.044 ( 4.992 4.594 -1.409) 6.929 12.160 ( 2.927 6.919 11.451) 13.696 12.406 ( 1.764 6.747 -4.067) 8.073 13.066 ( -0.335 -3.440 0.211) 3.463 13.350 ( -0.763 -8.674 0.135) 8.709 13.495 ( 4.990 -9.728 -2.020) 11.118 13.847 ( -4.352 2.676 10.736) 11.890 14.225 ( 11.390 5.037 3.926) 13.058 14.544 ( 1.836 -0.471 4.140) 4.553 15.759 ( -8.212 -2.447 -7.151) 11.161 18.511 ( -3.031 -2.350 -1.359) 4.069 19.000 ( 5.355 -9.392 -4.351) 11.654 19.848 ( -0.057 6.251 12.222) 13.728 20.982 ( -5.388 14.837 0.307) 15.788 22.156 ( 2.668 -7.746 -4.308) 9.256 23.819 ( 2.507 -1.225 1.507) 3.171 ======================= Grid point 170 (62/433) ======================= q-point: (-0.42 0.08 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.204 ( -10.126 18.698 -14.662) 25.828 2.837 ( -17.655 15.630 -4.559) 24.016 3.968 ( -12.683 7.678 -2.941) 15.115 5.129 ( 3.888 -4.923 8.289) 10.395 6.590 ( -1.518 -10.326 -2.064) 10.639 7.083 ( 0.095 -6.554 -6.388) 9.153 7.756 ( 1.306 -6.287 -5.934) 8.744 8.091 ( -7.130 -5.576 -2.071) 9.285 8.401 ( -2.102 17.219 7.836) 19.035 8.787 ( -4.698 1.427 -11.611) 12.606 9.065 ( 6.758 -4.505 1.221) 8.213 9.130 ( -1.792 -2.107 0.331) 2.786 9.485 ( 7.115 1.990 -10.277) 12.657 9.586 ( -5.999 3.885 -0.341) 7.155 10.034 ( -8.417 9.488 -3.300) 13.106 10.472 ( -5.516 -3.989 -6.128) 9.159 10.521 ( 4.814 2.787 -4.901) 7.413 10.821 ( -8.506 -3.774 -10.157) 13.775 11.212 ( -0.292 0.386 -0.165) 0.511 11.597 ( 4.093 -4.100 3.328) 6.681 12.070 ( 4.304 4.707 -3.562) 7.305 12.194 ( 4.654 0.082 -4.288) 6.329 12.422 ( 9.215 11.584 7.493) 16.591 13.142 ( 2.332 -6.005 3.437) 7.302 13.360 ( -4.569 -5.623 2.508) 7.667 13.665 ( 4.273 -5.115 -2.984) 7.303 13.841 ( -2.832 -3.623 9.449) 10.509 14.394 ( 12.110 8.197 6.694) 16.083 14.606 ( 1.465 -1.374 3.779) 4.280 15.601 ( -9.401 -4.718 -8.400) 13.461 18.435 ( -6.383 -1.148 0.688) 6.522 19.196 ( 7.534 -9.170 0.415) 11.875 19.857 ( 0.171 4.956 7.242) 8.777 20.651 ( -11.422 18.093 -3.997) 21.767 22.329 ( 8.955 -9.123 -3.129) 13.160 23.874 ( 0.711 -1.185 3.264) 3.545 ======================= Grid point 171 (63/433) ======================= q-point: (-0.33 0.08 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.761 ( -9.423 22.200 -10.623) 26.353 2.283 ( -24.086 18.608 -6.937) 31.217 3.564 ( -19.712 19.974 0.307) 28.064 5.268 ( 0.939 -5.554 7.135) 9.090 6.524 ( -9.900 -6.432 -8.863) 14.763 7.263 ( 9.659 -11.666 2.450) 15.342 7.783 ( 0.252 -0.243 1.645) 1.682 8.004 ( -6.913 -3.523 -3.327) 8.442 8.313 ( -0.912 6.608 2.071) 6.985 8.645 ( 0.815 0.411 -5.274) 5.352 9.003 ( -13.064 4.639 -0.187) 13.865 9.218 ( 4.313 -2.946 0.338) 5.234 9.526 ( 6.525 5.477 -1.017) 8.579 9.675 ( 13.279 -6.715 -11.537) 18.829 9.778 ( -5.046 4.983 -1.233) 7.199 10.375 ( -6.878 -6.480 -8.099) 12.446 10.514 ( 1.824 3.013 -3.531) 4.987 10.637 ( -9.267 -0.985 -8.739) 12.775 11.212 ( 0.169 -0.741 -0.042) 0.761 11.690 ( 0.788 -2.402 -0.127) 2.532 12.092 ( 5.752 0.333 -2.616) 6.328 12.295 ( 12.259 0.636 -9.906) 15.774 12.537 ( 10.868 12.329 10.706) 19.614 13.285 ( 2.900 -8.284 5.688) 10.459 13.345 ( -5.647 -4.631 3.449) 8.077 13.683 ( -2.581 1.132 3.342) 4.372 13.923 ( 0.892 -6.720 0.594) 6.805 14.516 ( 6.726 10.409 7.109) 14.287 14.675 ( 2.574 -3.236 3.561) 5.457 15.442 ( -8.664 -4.585 -8.664) 13.083 18.364 ( -4.785 -2.183 3.024) 6.067 19.381 ( 3.633 -3.907 4.216) 6.800 19.841 ( -0.021 2.220 -0.892) 2.393 20.271 ( -9.414 16.848 -4.848) 19.899 22.550 ( 9.654 -7.725 -3.161) 12.762 23.900 ( -1.472 -0.890 3.958) 4.315 ======================= Grid point 172 (64/433) ======================= q-point: (-0.25 0.08 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.367 ( -6.067 25.301 0.048) 26.018 1.643 ( -24.943 20.951 -1.699) 32.619 2.935 ( -26.056 33.974 5.093) 43.117 5.334 ( -5.303 -6.951 4.628) 9.892 6.367 ( -7.504 -4.228 -7.943) 11.717 7.522 ( 4.958 -4.759 3.941) 7.923 7.790 ( -1.975 4.148 10.937) 11.862 7.927 ( -3.864 -11.327 -6.176) 13.467 8.258 ( 0.042 -1.789 -4.671) 5.003 8.650 ( -19.916 2.123 0.082) 20.029 8.780 ( 11.926 3.221 2.711) 12.648 9.337 ( 5.914 -0.688 2.493) 6.455 9.483 ( 3.992 9.307 -6.159) 11.853 9.690 ( 6.766 1.083 -3.973) 7.921 10.038 ( 10.034 -9.619 1.700) 14.003 10.289 ( -5.055 -9.315 -10.199) 14.708 10.401 ( -10.573 0.181 -7.558) 12.998 10.572 ( 7.873 -0.710 -0.699) 7.936 11.228 ( -0.056 -2.179 0.128) 2.184 11.682 ( 0.019 -0.432 -4.526) 4.547 12.235 ( 9.157 -3.555 0.835) 9.859 12.442 ( 13.888 1.964 -10.588) 17.574 12.646 ( 9.242 12.487 7.300) 17.165 13.291 ( -7.841 -3.816 2.527) 9.079 13.440 ( -0.318 -6.271 9.124) 11.076 13.644 ( -2.612 -0.807 4.121) 4.946 13.974 ( 0.725 -2.924 -4.289) 5.241 14.476 ( -4.866 5.568 0.882) 7.447 14.802 ( 4.775 -1.653 7.638) 9.158 15.316 ( -3.652 -0.943 -4.629) 5.971 18.365 ( -1.404 -4.125 4.338) 6.149 19.395 ( -2.657 6.159 2.498) 7.158 19.755 ( -7.166 5.412 -4.620) 10.098 20.044 ( 2.607 6.656 -7.316) 10.229 22.753 ( 8.486 -6.812 -2.470) 11.158 23.890 ( -3.282 -0.563 3.774) 5.033 ======================= Grid point 173 (65/433) ======================= q-point: (-0.17 0.08 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.018 ( -3.655 30.486 0.096) 30.704 1.219 ( -7.719 20.473 32.928) 39.535 2.154 ( -26.284 45.514 12.606) 54.049 5.250 ( -14.799 -5.728 0.589) 15.880 6.290 ( -0.993 -2.690 -3.669) 4.656 7.460 ( -5.288 7.123 -8.378) 12.202 7.829 ( -7.905 -13.459 11.645) 19.474 8.066 ( 5.976 -6.278 9.504) 12.862 8.276 ( -2.454 1.809 -1.401) 3.356 8.366 ( -7.502 -3.789 6.094) 10.381 8.913 ( 4.190 0.385 -2.603) 4.948 9.404 ( 0.416 -3.325 -10.012) 10.558 9.543 ( 9.293 3.678 -3.228) 10.503 9.802 ( 11.054 3.033 -2.946) 11.836 10.147 ( -11.067 -1.925 -10.382) 15.296 10.239 ( 0.338 -4.084 8.531) 9.464 10.301 ( 8.136 -1.855 8.600) 11.983 10.840 ( 15.947 -8.526 -1.047) 18.114 11.254 ( -1.491 -5.336 1.623) 5.774 11.688 ( 3.237 -2.217 -5.167) 6.487 12.431 ( 9.122 -1.431 1.133) 9.303 12.581 ( 13.454 3.390 -11.456) 17.993 12.673 ( 3.633 9.465 2.508) 10.444 13.196 ( -8.191 -2.498 0.824) 8.603 13.415 ( -10.760 0.162 8.090) 13.463 13.729 ( 1.970 -6.606 4.615) 8.295 13.928 ( -2.987 1.971 -13.771) 14.228 14.296 ( -8.351 3.606 0.144) 9.098 14.892 ( 0.324 -0.525 -2.269) 2.352 15.400 ( 9.339 -5.664 24.759) 27.061 18.441 ( 1.297 -5.822 3.742) 7.041 19.263 ( -1.195 11.945 -2.041) 12.177 19.498 ( -10.360 7.516 -4.110) 13.442 20.012 ( 5.718 8.482 -16.676) 19.564 22.931 ( 5.232 -7.632 -0.635) 9.275 23.849 ( -4.364 -0.227 2.529) 5.049 ======================= Grid point 174 (66/433) ======================= q-point: (-0.08 0.08 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.968 ( 25.943 27.170 21.420) 43.244 1.216 ( -1.110 28.647 31.460) 42.563 1.515 ( -7.383 33.849 40.093) 52.988 5.021 ( -9.267 1.736 1.152) 9.498 6.360 ( 7.474 -2.125 2.190) 8.073 7.228 ( -5.549 6.095 -13.959) 16.211 7.878 ( -12.800 -17.925 8.905) 23.758 8.117 ( -5.735 -1.835 6.211) 8.651 8.323 ( 9.691 4.432 10.036) 14.638 8.533 ( 2.689 -7.852 12.254) 14.800 8.965 ( 2.322 -10.128 -0.734) 10.416 9.190 ( -10.163 9.982 -22.868) 26.942 9.547 ( -0.256 5.833 -1.072) 5.936 9.860 ( -3.132 0.366 -4.603) 5.580 10.030 ( 2.699 -0.945 0.949) 3.013 10.213 ( 0.664 6.358 9.775) 11.680 10.837 ( 19.530 -16.934 11.438) 28.267 11.126 ( 8.535 -5.058 -0.224) 9.923 11.335 ( -1.701 -14.512 8.391) 16.849 11.782 ( 7.916 -5.959 -5.740) 11.451 12.433 ( -4.735 10.945 -8.032) 14.378 12.633 ( -3.502 -0.609 7.559) 8.353 12.702 ( 9.560 2.473 -17.069) 19.719 13.028 ( -8.599 10.202 -7.370) 15.243 13.241 ( -14.240 -0.195 7.372) 16.037 13.632 ( -6.403 5.749 -9.124) 12.542 13.817 ( 0.117 -0.727 1.271) 1.469 14.220 ( 0.228 5.519 -1.420) 5.703 14.836 ( 1.468 1.698 -10.374) 10.614 16.164 ( 11.537 -54.618 53.138) 77.071 18.505 ( -5.400 -5.445 0.200) 7.671 19.136 ( 1.259 8.630 -2.444) 9.057 19.328 ( 6.713 9.482 -3.057) 12.013 19.789 ( 12.266 34.583 -29.732) 47.228 23.025 ( -3.906 -6.697 1.614) 7.919 23.791 ( -2.960 0.193 0.804) 3.073 ======================= Grid point 177 (67/433) ======================= q-point: ( 0.17 0.17 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 433 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.469 ( 24.664 -0.000 12.697) 27.740 2.670 ( 7.893 -0.000 23.657) 24.939 3.838 ( 19.294 -0.000 11.186) 22.302 5.103 ( -2.371 0.000 -5.604) 6.085 6.742 ( -1.101 0.000 -6.565) 6.657 7.372 ( -16.494 0.000 -12.075) 20.442 7.633 ( -0.820 0.000 -0.210) 0.846 7.886 ( 24.182 -0.000 10.961) 26.550 8.500 ( 1.296 -0.000 2.116) 2.481 8.939 ( 18.689 -0.000 2.860) 18.907 9.249 ( -12.903 0.000 -8.496) 15.449 9.306 ( -1.840 0.000 7.711) 7.928 9.434 ( 1.862 -0.000 16.046) 16.154 10.034 ( -15.231 0.000 7.629) 17.035 10.110 ( 5.792 -0.000 -3.354) 6.693 10.332 ( -0.160 0.000 -4.721) 4.724 11.005 ( -5.072 0.000 5.955) 7.823 11.128 ( -6.216 0.000 -4.708) 7.797 11.474 ( -3.345 0.000 -0.311) 3.360 11.559 ( -4.346 0.000 -0.679) 4.399 11.841 ( 5.252 -0.000 14.613) 15.528 12.341 ( 3.242 -0.000 2.958) 4.389 12.392 ( -10.852 0.000 6.605) 12.704 12.932 ( 2.944 -0.000 -15.457) 15.735 13.164 ( 0.753 -0.000 -0.583) 0.952 13.373 ( -5.517 0.000 0.966) 5.601 13.692 ( 4.335 -0.000 -11.616) 12.399 14.081 ( 4.770 -0.000 1.019) 4.877 14.659 ( -5.919 0.000 -0.821) 5.976 16.300 ( -10.123 0.000 6.440) 11.998 18.137 ( 5.595 -0.000 -8.811) 10.437 18.939 ( -1.993 0.000 -8.298) 8.533 20.087 ( -3.827 0.000 4.792) 6.133 20.223 ( 20.737 -0.000 9.131) 22.658 22.848 ( -11.834 0.000 0.515) 11.845 23.704 ( 1.764 -0.000 -5.649) 5.918 ======================= Grid point 178 (68/433) ======================= q-point: ( 0.25 0.17 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.851 ( 10.993 4.826 12.082) 17.033 2.970 ( 14.141 -6.592 12.176) 19.791 4.115 ( 7.116 -2.500 4.588) 8.828 5.012 ( -3.400 2.873 -3.097) 5.423 6.617 ( -11.732 -0.584 -2.312) 11.972 7.152 ( -0.337 -0.949 -12.449) 12.490 7.564 ( -3.405 -1.592 -7.628) 8.504 8.363 ( 19.590 3.309 12.466) 23.454 8.517 ( -0.977 -3.786 1.526) 4.197 8.906 ( -15.432 -0.075 -11.004) 18.954 9.264 ( 15.458 0.941 4.999) 16.274 9.295 ( 0.475 7.045 4.720) 8.493 9.585 ( -2.624 -3.053 16.087) 16.583 9.851 ( -6.151 -2.436 0.723) 6.655 10.132 ( 1.450 1.695 -4.506) 5.028 10.334 ( 0.329 -0.984 -5.326) 5.426 10.903 ( -7.665 3.645 -2.325) 8.800 10.988 ( -6.803 -4.518 -1.376) 8.282 11.410 ( -1.307 2.213 -1.888) 3.189 11.461 ( -5.521 -0.252 -2.236) 5.962 12.060 ( 8.717 4.151 16.575) 19.182 12.270 ( -7.728 1.970 7.001) 10.612 12.487 ( 9.238 -2.551 5.289) 10.947 12.863 ( 1.027 2.279 -13.771) 13.996 13.136 ( -6.158 -6.062 -0.785) 8.676 13.286 ( -5.176 -2.752 -3.254) 6.705 13.784 ( 11.257 0.739 -3.632) 11.851 14.152 ( 3.169 1.543 2.324) 4.222 14.547 ( -7.032 0.244 1.663) 7.230 16.138 ( -9.828 2.150 -0.612) 10.079 18.222 ( 8.856 -2.472 -7.471) 11.847 18.869 ( -2.079 -2.398 -8.240) 8.830 20.029 ( -4.630 4.560 9.655) 11.639 20.654 ( 20.576 -3.567 10.082) 23.189 22.586 ( -16.781 2.578 -2.721) 17.195 23.713 ( 2.974 -0.073 -4.694) 5.558 ======================= Grid point 179 (69/433) ======================= q-point: ( 0.33 0.17 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 794 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.953 ( 2.923 6.383 3.391) 7.797 3.292 ( 11.197 -0.346 7.205) 13.319 4.191 ( -3.004 -5.457 -1.507) 6.409 4.922 ( -1.190 4.171 0.229) 4.343 6.410 ( -11.533 -2.908 -0.751) 11.917 7.159 ( 4.326 -1.919 -9.947) 11.015 7.487 ( -1.362 -3.776 -10.708) 11.435 8.290 ( -17.725 -4.419 -4.206) 18.745 8.726 ( -0.462 -0.015 -4.001) 4.028 8.767 ( 11.980 -0.274 6.354) 13.564 9.216 ( -1.882 13.827 4.639) 14.706 9.386 ( 2.103 8.746 3.263) 9.569 9.639 ( -2.284 -2.761 7.589) 8.393 9.879 ( -2.575 -7.083 1.960) 7.788 10.139 ( 6.175 -0.149 -4.329) 7.542 10.267 ( -2.436 -0.585 -7.179) 7.603 10.761 ( -2.269 2.357 -5.285) 6.216 10.925 ( -4.789 -3.042 -2.508) 6.203 11.337 ( -3.605 1.597 -1.020) 4.073 11.416 ( 0.043 -1.761 -1.927) 2.610 12.147 ( -2.176 5.028 4.962) 7.392 12.248 ( 3.724 5.937 13.788) 15.467 12.624 ( 2.539 7.725 -0.052) 8.132 12.880 ( 9.275 -9.745 -6.595) 14.982 13.063 ( -5.480 -2.389 -1.444) 6.150 13.255 ( -4.848 -10.829 -2.834) 12.198 13.938 ( 7.316 3.197 2.412) 8.340 14.181 ( 2.758 3.943 3.666) 6.049 14.482 ( -2.575 -1.689 3.544) 4.695 15.939 ( -9.979 1.263 -4.755) 11.126 18.371 ( 9.283 -3.645 -5.431) 11.356 18.816 ( -1.826 -4.060 -7.809) 8.988 19.976 ( -3.997 5.059 12.632) 14.182 21.059 ( 17.932 0.562 9.505) 20.303 22.241 ( -17.891 1.358 -5.855) 18.874 23.747 ( 3.472 -0.286 -2.256) 4.150 ======================= Grid point 180 (70/433) ======================= q-point: (-0.58 0.17 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.862 ( -1.507 12.963 -6.503) 14.581 3.381 ( -0.021 9.055 2.041) 9.282 4.133 ( -7.281 -6.571 -5.110) 11.058 4.928 ( 3.075 0.631 5.062) 5.956 6.325 ( -4.296 -7.311 0.533) 8.497 7.124 ( -3.116 0.016 -10.253) 10.716 7.498 ( 3.003 -8.716 -10.950) 14.314 8.043 ( -14.224 -9.017 -4.804) 17.513 8.732 ( 2.055 -2.594 -4.453) 5.548 8.933 ( 5.205 0.666 2.472) 5.800 9.026 ( -2.806 20.218 3.369) 20.688 9.302 ( -7.188 5.824 3.518) 9.897 9.588 ( -3.679 2.344 0.657) 4.412 9.810 ( -7.258 1.112 -4.165) 8.442 10.222 ( 0.049 -1.419 4.531) 4.748 10.326 ( 6.779 -6.657 -3.201) 10.026 10.685 ( 3.644 6.991 -12.135) 14.472 10.847 ( -5.498 -3.912 -5.856) 8.934 11.274 ( -2.161 1.250 -0.016) 2.497 11.440 ( 1.306 -2.395 -0.338) 2.748 12.114 ( 1.449 3.293 2.590) 4.433 12.278 ( -1.625 5.513 4.692) 7.419 12.569 ( 5.054 9.790 0.917) 11.056 13.012 ( -0.267 -2.046 -2.217) 3.029 13.129 ( 4.059 -12.581 -3.482) 13.670 13.297 ( 0.555 -11.172 1.100) 11.240 13.932 ( -4.183 5.524 7.134) 9.945 14.291 ( 9.998 1.534 3.478) 10.696 14.525 ( 1.829 -1.304 5.298) 5.755 15.734 ( -10.097 -0.380 -6.005) 11.754 18.482 ( 3.035 -0.629 -3.754) 4.868 18.831 ( 3.300 -7.813 -5.756) 10.250 19.955 ( -2.334 4.612 12.893) 13.891 21.249 ( 3.163 12.600 4.006) 13.594 22.006 ( -5.379 -7.651 -4.494) 10.376 23.802 ( 2.974 -0.602 0.540) 3.082 ======================= Grid point 181 (71/433) ======================= q-point: (-0.50 0.17 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 794 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.595 ( -3.321 20.570 -12.688) 24.396 3.138 ( -13.049 15.331 -4.488) 20.626 4.035 ( -6.459 -0.843 -3.030) 7.184 5.050 ( 4.413 -3.020 7.587) 9.282 6.389 ( -0.546 -10.210 0.215) 10.226 6.985 ( -5.078 -3.292 -10.183) 11.845 7.570 ( 0.508 -11.378 -10.361) 15.397 7.962 ( -3.564 -8.116 -1.121) 8.934 8.723 ( -2.942 3.086 -4.089) 5.907 8.830 ( -3.457 16.244 3.525) 16.978 8.972 ( 0.421 -3.611 -4.505) 5.789 9.149 ( -4.888 2.557 9.614) 11.084 9.512 ( -1.809 1.505 -12.454) 12.674 9.680 ( -0.879 5.362 4.299) 6.929 10.209 ( -3.303 6.379 1.995) 7.455 10.374 ( -7.618 -6.769 -3.246) 10.695 10.614 ( 6.356 6.786 -13.664) 16.528 10.753 ( -4.531 -2.260 -8.125) 9.574 11.235 ( -1.201 1.399 0.366) 1.880 11.519 ( 3.963 -3.871 1.874) 5.848 12.152 ( 3.996 3.785 -1.670) 5.751 12.192 ( -1.096 0.379 -2.863) 3.090 12.626 ( 9.242 9.417 6.246) 14.599 13.049 ( 2.471 -3.383 -1.402) 4.418 13.188 ( -5.630 -11.426 -0.074) 12.738 13.507 ( 8.724 -9.662 -1.725) 13.132 13.855 ( -5.039 3.419 8.980) 10.850 14.467 ( 7.246 -1.978 4.011) 8.515 14.605 ( 3.873 2.464 6.007) 7.560 15.545 ( -9.289 -1.166 -5.131) 10.675 18.443 ( -2.775 2.028 -2.676) 4.356 19.004 ( 8.130 -10.415 -1.566) 13.305 19.953 ( -1.333 4.644 9.752) 10.883 20.992 ( -11.850 16.989 -3.877) 21.073 22.146 ( 9.049 -9.777 -0.178) 13.323 23.856 ( 1.383 -0.694 2.602) 3.027 ======================= Grid point 182 (72/433) ======================= q-point: (-0.42 0.17 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.243 ( -1.628 26.376 -12.413) 29.196 2.650 ( -20.022 18.967 -7.609) 28.610 3.860 ( -9.137 10.498 0.173) 13.919 5.187 ( 2.009 -3.307 7.869) 8.769 6.401 ( -7.102 -6.441 -5.154) 10.885 7.014 ( 5.197 -12.658 -2.894) 13.985 7.607 ( -2.217 -13.054 -9.703) 16.416 8.022 ( 2.534 -0.753 3.917) 4.726 8.545 ( -12.779 13.095 2.881) 18.522 8.628 ( 0.089 3.050 -0.575) 3.105 8.990 ( -7.157 -7.275 -7.186) 12.481 9.184 ( 3.623 3.034 6.951) 8.405 9.454 ( 4.616 -6.411 -4.053) 8.879 9.714 ( 7.155 5.790 1.631) 9.348 9.978 ( -8.390 11.208 -11.074) 17.851 10.275 ( -7.366 -3.822 -2.073) 8.553 10.564 ( -1.298 1.399 -8.804) 9.008 10.640 ( -1.975 2.545 -7.810) 8.448 11.211 ( -0.994 0.274 0.451) 1.125 11.630 ( 2.088 -3.299 2.912) 4.871 12.109 ( 1.189 1.132 -3.511) 3.876 12.291 ( 11.359 -1.049 -7.561) 13.686 12.747 ( 10.356 9.051 7.804) 15.814 13.110 ( -2.311 -9.322 -2.081) 9.827 13.225 ( -1.601 -7.095 4.815) 8.723 13.684 ( 5.757 -2.911 -4.425) 7.823 13.822 ( -3.061 -1.889 8.062) 8.828 14.573 ( -3.634 -6.157 3.571) 7.992 14.686 ( 7.532 6.025 5.527) 11.117 15.399 ( -5.669 -0.015 -2.677) 6.269 18.363 ( -2.474 2.044 -0.480) 3.244 19.241 ( 7.701 -9.869 1.697) 12.633 19.922 ( -1.677 5.579 3.823) 6.968 20.592 ( -12.278 15.998 -5.523) 20.909 22.399 ( 10.413 -7.831 -0.585) 13.042 23.886 ( -0.729 -0.514 3.471) 3.584 ======================= Grid point 183 (73/433) ======================= q-point: (-0.33 0.17 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 794 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.919 ( 2.317 30.098 -4.906) 30.583 2.072 ( -19.185 22.848 -4.591) 30.185 3.509 ( -14.089 24.858 3.429) 28.778 5.254 ( -2.922 -2.281 6.755) 7.705 6.287 ( -6.628 -4.061 -5.485) 9.514 7.267 ( 5.669 -16.417 -0.691) 17.382 7.660 ( -0.193 -14.036 -6.413) 15.433 8.049 ( 0.570 12.595 11.375) 16.981 8.265 ( -8.113 3.717 -2.997) 9.413 8.623 ( -8.677 0.444 -0.633) 8.711 8.855 ( 0.749 -2.319 1.609) 2.920 9.257 ( -0.131 -1.317 3.562) 3.800 9.667 ( 1.897 1.900 -14.155) 14.407 9.712 ( 9.133 -1.276 -0.479) 9.234 9.829 ( 6.991 -2.870 -0.207) 7.560 10.178 ( -5.580 -1.926 -2.462) 6.396 10.405 ( -9.204 0.382 -8.144) 12.295 10.607 ( 5.875 3.401 -3.831) 7.795 11.196 ( -1.876 -1.296 0.164) 2.286 11.665 ( -0.765 -0.972 -0.569) 1.362 12.172 ( 6.499 -3.064 0.667) 7.216 12.458 ( 13.838 -0.517 -10.994) 17.681 12.858 ( 7.272 8.962 5.338) 12.716 13.126 ( -6.177 -10.906 0.479) 12.543 13.325 ( 1.415 -5.792 6.508) 8.826 13.680 ( -1.982 3.482 0.394) 4.026 13.894 ( 2.715 -5.101 -1.479) 5.965 14.505 ( -10.813 -2.537 2.050) 11.294 14.788 ( 3.831 0.397 5.193) 6.465 15.337 ( 0.273 2.622 1.020) 2.827 18.333 ( 0.152 0.676 1.601) 1.744 19.431 ( 4.012 -4.260 2.605) 6.406 19.833 ( -2.686 6.037 -3.217) 7.349 20.251 ( -7.124 12.911 -4.127) 15.313 22.621 ( 8.503 -6.900 -1.699) 11.081 23.882 ( -2.548 -0.238 3.222) 4.115 ======================= Grid point 184 (74/433) ======================= q-point: (-0.25 0.17 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.603 ( -6.614 26.585 7.433) 28.386 1.706 ( 6.458 30.885 9.154) 32.854 2.977 ( -15.840 38.740 7.106) 42.452 5.206 ( -8.245 -0.102 4.385) 9.339 6.233 ( -0.948 -3.182 -1.551) 3.665 7.408 ( -1.947 -10.842 -7.610) 13.388 7.762 ( -4.324 -5.618 0.519) 7.108 7.992 ( 5.290 5.548 12.059) 14.289 8.238 ( 3.742 -1.774 1.764) 4.501 8.351 ( -16.762 0.915 1.390) 16.845 9.017 ( 8.022 6.898 2.527) 10.877 9.219 ( -5.495 -11.340 -7.853) 14.848 9.621 ( 6.171 2.041 -5.344) 8.414 9.889 ( 11.145 5.020 -2.104) 12.404 10.018 ( -1.181 -12.054 -7.302) 14.143 10.160 ( 3.069 -4.685 8.684) 10.334 10.212 ( -7.026 -1.457 -1.166) 7.270 10.744 ( 13.737 -2.072 -1.969) 14.031 11.168 ( -4.576 -3.530 0.372) 5.791 11.651 ( 0.246 -1.077 -3.036) 3.231 12.364 ( 8.572 -4.943 4.756) 10.979 12.614 ( 13.083 -0.052 -12.726) 18.252 12.846 ( -2.187 6.245 0.615) 6.646 13.126 ( -3.103 -3.679 0.691) 4.863 13.398 ( -6.251 -2.437 7.125) 9.787 13.646 ( 2.211 -1.130 1.044) 2.694 13.931 ( -0.130 -1.136 -8.960) 9.032 14.338 ( -9.836 0.394 4.576) 10.855 14.857 ( 0.151 -2.522 2.487) 3.545 15.367 ( 2.411 1.038 8.615) 9.006 18.371 ( 2.074 -1.398 2.597) 3.606 19.456 ( -0.579 5.182 -2.529) 5.795 19.662 ( -4.434 10.435 -4.168) 12.080 20.109 ( 2.348 4.487 -3.991) 6.448 22.790 ( 4.981 -7.153 -1.966) 8.936 23.847 ( -3.509 0.065 2.015) 4.047 ======================= Grid point 185 (75/433) ======================= q-point: (-0.17 0.17 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 794 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.506 ( 13.817 25.608 21.492) 36.175 1.664 ( 8.589 25.955 26.876) 38.338 2.397 ( -7.036 47.770 11.405) 49.614 5.069 ( -6.585 2.913 1.597) 7.375 6.310 ( 6.047 -3.002 3.759) 7.727 7.342 ( -1.928 3.251 -14.465) 14.951 7.671 ( -8.185 -4.442 4.802) 10.478 8.126 ( -6.053 1.790 2.283) 6.712 8.305 ( 7.413 -13.724 17.901) 23.744 8.373 ( 7.994 0.334 7.516) 10.977 8.926 ( -5.094 5.278 -6.346) 9.700 9.221 ( -0.674 -5.198 -14.363) 15.289 9.673 ( 2.570 6.564 2.850) 7.604 9.855 ( -6.652 -1.050 -10.695) 12.639 10.016 ( 3.772 -0.174 -0.906) 3.883 10.236 ( 4.623 -2.988 8.226) 9.897 10.499 ( 9.661 -16.606 13.561) 23.516 11.023 ( 13.140 -6.827 -1.492) 14.882 11.127 ( -7.052 -6.738 3.837) 10.481 11.678 ( 2.599 -4.134 -3.548) 6.036 12.533 ( 0.522 -4.285 2.921) 5.212 12.668 ( -8.261 8.009 -5.116) 12.592 12.750 ( 11.796 1.875 -11.260) 16.415 13.110 ( 0.022 -0.854 -1.566) 1.784 13.254 ( -12.662 2.391 4.409) 13.620 13.698 ( -6.544 1.313 -0.908) 6.735 13.809 ( 1.333 0.114 -7.930) 8.042 14.310 ( 3.149 2.877 2.558) 4.973 14.856 ( -0.920 -0.367 -5.736) 5.821 15.553 ( 0.603 -15.961 26.982) 31.355 18.421 ( -1.949 -2.658 1.908) 3.808 19.290 ( -5.081 6.671 -7.686) 11.375 19.561 ( 8.230 14.374 0.922) 16.589 20.100 ( 5.191 5.306 -10.065) 12.506 22.891 ( -0.469 -7.338 -0.992) 7.420 23.796 ( -2.848 0.367 0.362) 2.894 ======================= Grid point 186 (76/433) ======================= q-point: (-0.08 0.17 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.609 ( 6.406 27.595 22.196) 35.989 1.806 ( 11.834 19.706 33.721) 40.810 2.213 ( 27.256 33.410 23.202) 48.964 5.026 ( 4.219 -0.456 -4.011) 5.839 6.530 ( 11.261 -3.884 8.679) 14.738 7.153 ( -0.788 9.859 -14.973) 17.945 7.663 ( -5.078 -9.206 4.236) 11.335 8.093 ( 0.643 -1.870 2.862) 3.479 8.447 ( -4.964 -4.285 1.420) 6.709 8.706 ( 8.037 9.813 12.076) 17.513 8.780 ( -1.302 -9.343 0.930) 9.479 9.193 ( 8.679 -1.451 -6.210) 10.770 9.532 ( -9.014 7.887 5.866) 13.337 9.811 ( 1.391 -1.638 -5.104) 5.538 10.047 ( -0.231 0.733 4.298) 4.366 10.455 ( 13.152 -0.184 7.030) 14.914 10.797 ( -4.120 -16.266 5.006) 17.510 11.148 ( -5.900 -10.492 12.430) 17.303 11.232 ( 4.342 -7.126 0.645) 8.370 11.773 ( 3.364 -7.801 -3.232) 9.089 12.317 ( -13.493 13.957 -6.568) 20.494 12.481 ( -9.058 -2.099 -2.176) 9.550 12.855 ( 10.527 2.747 -10.955) 15.439 13.026 ( -14.194 2.031 5.551) 15.376 13.109 ( 3.783 7.742 -6.797) 10.974 13.554 ( -2.540 -0.643 -1.565) 3.052 13.848 ( 3.248 0.083 -2.653) 4.195 14.255 ( -3.161 10.128 -5.420) 11.914 14.807 ( 1.346 -0.483 -9.331) 9.440 15.984 ( -4.910 -33.935 34.293) 48.494 18.343 ( -8.120 0.016 -0.862) 8.166 19.194 ( 2.413 1.889 -3.443) 4.609 19.582 ( 7.399 14.687 1.007) 16.477 20.068 ( 10.890 8.721 -15.930) 21.175 22.919 ( -3.034 -6.513 1.532) 7.347 23.762 ( -0.922 -0.024 -0.876) 1.272 ======================= Grid point 190 (77/433) ======================= q-point: ( 0.25 0.25 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 432 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.027 ( 2.862 -0.000 6.620) 7.212 3.277 ( 16.550 -0.000 6.819) 17.900 4.135 ( -4.169 0.000 -1.424) 4.406 4.970 ( -1.408 0.000 -1.365) 1.961 6.379 ( -13.107 0.000 -1.275) 13.169 7.138 ( 5.730 -0.000 -10.798) 12.224 7.454 ( -2.573 0.000 -10.018) 10.343 8.237 ( -20.565 0.000 -6.482) 21.562 8.732 ( -2.038 0.000 -4.124) 4.600 8.759 ( 13.788 -0.000 7.622) 15.755 9.381 ( 1.227 -0.000 1.893) 2.256 9.530 ( 6.170 -0.000 12.340) 13.797 9.585 ( -3.241 0.000 8.950) 9.518 9.752 ( -3.984 0.000 0.363) 4.001 10.138 ( 4.591 -0.000 -4.992) 6.782 10.268 ( -3.885 0.000 -9.176) 9.965 10.761 ( -5.146 0.000 -1.647) 5.403 10.920 ( -0.594 0.000 -4.726) 4.763 11.350 ( -5.567 0.000 -1.360) 5.731 11.399 ( 0.750 -0.000 -2.486) 2.597 12.200 ( -4.789 0.000 6.459) 8.040 12.316 ( 5.049 -0.000 13.828) 14.721 12.690 ( 13.017 -0.000 3.153) 13.393 12.820 ( 1.071 -0.000 -11.298) 11.349 13.016 ( -5.195 0.000 3.151) 6.076 13.127 ( -6.237 0.000 -7.332) 9.626 13.970 ( 9.256 -0.000 1.249) 9.340 14.227 ( 2.444 -0.000 3.458) 4.235 14.458 ( -4.310 0.000 4.103) 5.951 15.952 ( -11.141 0.000 -4.711) 12.096 18.334 ( 10.761 -0.000 -6.028) 12.334 18.777 ( -1.969 0.000 -7.896) 8.138 20.027 ( -5.411 0.000 12.396) 13.526 21.062 ( 21.792 -0.000 10.577) 24.223 22.255 ( -20.760 0.000 -5.850) 21.568 23.745 ( 3.539 -0.000 -2.637) 4.414 ======================= Grid point 191 (78/433) ======================= q-point: ( 0.33 0.25 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.050 ( 0.918 5.536 -0.989) 5.698 3.525 ( 9.984 5.107 3.174) 11.654 3.993 ( -11.066 -5.885 -6.012) 13.901 4.961 ( 1.751 1.619 1.163) 2.653 6.219 ( -6.750 -3.151 0.012) 7.449 7.136 ( -0.801 0.755 -10.283) 10.342 7.373 ( -0.441 -3.727 -11.813) 12.395 7.899 ( -14.885 -4.540 -6.314) 16.794 8.701 ( 0.048 -0.696 -3.416) 3.487 8.935 ( 4.784 -0.081 1.299) 4.958 9.302 ( -6.978 5.467 -0.092) 8.865 9.495 ( -3.736 14.737 6.106) 16.384 9.619 ( -0.819 1.325 5.167) 5.397 9.768 ( -4.189 -7.261 6.894) 10.854 10.132 ( -5.630 -4.794 -6.274) 9.697 10.253 ( 7.441 -1.305 -0.293) 7.560 10.723 ( 0.137 -0.875 -3.259) 3.377 10.877 ( 4.231 3.679 -14.140) 15.211 11.274 ( -3.314 -0.673 0.217) 3.388 11.407 ( 0.647 -0.967 -1.109) 1.607 12.162 ( -2.512 1.331 5.314) 6.027 12.387 ( -1.370 4.940 4.843) 7.052 12.756 ( 4.208 8.403 -1.886) 9.585 12.911 ( 5.349 -7.743 -9.757) 13.556 12.991 ( -0.263 -1.004 -0.018) 1.038 13.088 ( 1.413 -8.882 5.200) 10.389 14.030 ( -2.368 3.576 3.533) 5.557 14.287 ( 2.717 -1.128 4.389) 5.284 14.506 ( 5.510 -0.507 5.625) 7.890 15.735 ( -10.809 0.175 -5.255) 12.020 18.483 ( 9.564 0.462 -4.251) 10.477 18.716 ( -0.663 -3.508 -7.063) 7.914 20.017 ( -3.911 1.674 13.282) 13.947 21.443 ( 16.391 6.485 8.359) 19.508 21.878 ( -18.065 -4.701 -7.106) 19.973 23.795 ( 3.156 -0.163 0.017) 3.160 ======================= Grid point 192 (79/433) ======================= q-point: (-0.58 0.25 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.937 ( -0.185 13.557 -7.396) 15.445 3.421 ( -9.733 14.259 -5.342) 18.072 3.938 ( -1.390 -8.869 -2.796) 9.402 5.020 ( 4.102 -0.214 4.456) 6.060 6.217 ( -0.739 -7.082 1.107) 7.206 6.957 ( -9.288 0.191 -11.417) 14.719 7.363 ( -0.877 -9.191 -12.123) 15.238 7.807 ( -0.453 -6.862 -2.079) 7.185 8.694 ( 0.225 -1.564 -6.139) 6.339 8.924 ( -6.739 -1.562 -4.381) 8.188 9.157 ( -2.920 4.919 5.283) 7.787 9.279 ( -7.532 17.883 11.390) 22.501 9.548 ( -4.117 2.599 -11.984) 12.936 9.776 ( 0.797 3.689 8.771) 9.549 10.154 ( -3.579 -12.098 1.846) 12.751 10.302 ( -3.591 0.496 1.835) 4.063 10.700 ( 0.169 0.945 -7.737) 7.797 10.806 ( 4.508 7.252 -16.704) 18.760 11.243 ( -2.321 -0.741 0.424) 2.473 11.452 ( 4.443 -2.876 -0.871) 5.364 12.168 ( 0.855 -0.528 1.862) 2.116 12.276 ( -3.858 6.725 -1.114) 7.833 12.784 ( 7.160 6.986 2.507) 10.312 12.931 ( -4.482 -11.560 -8.049) 14.782 13.034 ( 4.086 -1.225 -0.327) 4.278 13.327 ( 9.604 -8.380 4.183) 13.415 13.936 ( -5.454 4.434 5.140) 8.707 14.378 ( 0.280 -5.455 4.675) 7.189 14.657 ( 8.179 2.087 5.404) 10.022 15.543 ( -8.593 0.469 -2.787) 9.046 18.512 ( 1.120 5.158 -4.385) 6.862 18.808 ( 7.014 -9.716 -3.279) 12.424 20.025 ( -1.885 2.695 11.720) 12.173 21.288 ( -14.922 13.152 -5.811) 20.722 21.961 ( 11.784 -9.132 3.478) 15.309 23.846 ( 1.784 -0.283 2.233) 2.872 ======================= Grid point 193 (80/433) ======================= q-point: (-0.50 0.25 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.716 ( 0.671 21.248 -9.465) 23.270 2.990 ( -17.252 16.038 -8.624) 25.085 3.968 ( -0.145 1.128 -0.555) 1.265 5.135 ( 3.339 -2.118 6.692) 7.773 6.275 ( -3.345 -6.502 -0.554) 7.333 6.812 ( -2.081 -7.860 -7.676) 11.182 7.365 ( -1.868 -11.216 -11.167) 15.937 7.939 ( 7.033 -6.588 2.213) 9.888 8.584 ( -9.713 1.081 -6.554) 11.767 8.802 ( -8.684 -3.852 1.699) 9.650 9.025 ( -1.751 18.934 2.498) 19.178 9.220 ( 1.599 0.303 9.296) 9.437 9.379 ( -3.598 -1.239 -9.750) 10.466 9.834 ( 5.266 5.804 6.684) 10.301 10.073 ( -14.545 -2.666 -7.610) 16.631 10.254 ( -0.574 2.040 2.945) 3.629 10.598 ( -2.744 2.986 -11.373) 12.074 10.720 ( 2.457 4.492 -10.569) 11.744 11.209 ( -2.834 -0.771 0.486) 2.977 11.573 ( 5.028 -2.416 1.689) 5.828 12.135 ( -1.831 1.527 -4.948) 5.493 12.266 ( 6.828 -0.735 -0.919) 6.928 12.876 ( 8.482 3.745 1.804) 9.445 12.919 ( -5.230 -9.939 -3.228) 11.685 13.125 ( 4.139 -2.531 0.127) 4.853 13.574 ( 9.342 -6.755 0.468) 11.538 13.849 ( -4.576 2.989 5.183) 7.532 14.439 ( -4.189 -7.033 4.858) 9.519 14.770 ( 4.611 2.846 3.476) 6.438 15.422 ( -3.652 1.811 1.167) 4.240 18.438 ( -0.119 5.597 -2.821) 6.269 19.030 ( 7.890 -11.441 -0.358) 13.903 20.029 ( -0.775 4.952 7.770) 9.246 20.866 ( -15.104 12.028 -7.304) 20.644 22.258 ( 11.816 -6.577 2.082) 13.683 23.879 ( -0.205 -0.185 3.255) 3.266 ======================= Grid point 194 (81/433) ======================= q-point: (-0.42 0.25 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.446 ( -8.153 21.966 -0.981) 23.450 2.515 ( -3.684 24.275 -10.233) 26.600 3.874 ( -3.680 13.103 1.038) 13.650 5.221 ( -0.703 -1.530 6.998) 7.198 6.213 ( -6.322 -3.610 -2.323) 7.642 6.951 ( 5.549 -15.658 -3.043) 16.889 7.402 ( 0.280 -12.162 -7.492) 14.287 8.145 ( 8.188 -1.483 6.302) 10.438 8.346 ( -13.757 2.001 0.705) 13.920 8.718 ( -8.159 -7.924 -3.131) 11.797 8.801 ( -2.940 18.055 2.919) 18.525 9.284 ( 1.833 1.243 3.196) 3.888 9.456 ( 6.616 -11.927 0.527) 13.649 9.762 ( -12.150 0.405 -14.188) 18.684 9.919 ( 7.519 7.137 4.313) 11.229 10.209 ( -2.192 4.218 0.765) 4.815 10.433 ( -6.045 2.815 -9.882) 11.921 10.680 ( 4.347 3.522 -7.499) 9.356 11.170 ( -3.621 -1.593 0.363) 3.972 11.653 ( 0.902 -0.206 3.362) 3.487 12.119 ( 2.794 -2.273 -1.833) 4.041 12.417 ( 10.743 -3.552 -7.381) 13.509 12.900 ( -5.255 -8.105 -2.371) 9.946 13.012 ( 8.804 2.886 2.918) 9.713 13.213 ( 1.942 -5.248 0.996) 5.683 13.751 ( 5.423 2.272 -4.870) 7.634 13.794 ( -1.520 -3.629 6.387) 7.502 14.416 ( -9.608 -5.588 5.052) 12.209 14.804 ( 0.379 0.867 2.028) 2.238 15.397 ( 0.970 3.164 3.638) 4.918 18.387 ( 1.317 4.804 -0.264) 4.989 19.263 ( 5.913 -11.580 0.473) 13.011 19.988 ( -0.207 8.644 2.965) 9.141 20.492 ( -11.093 11.431 -5.971) 17.011 22.493 ( 8.608 -6.175 -0.567) 10.609 23.880 ( -2.018 0.023 2.958) 3.581 ======================= Grid point 195 (82/433) ======================= q-point: (-0.33 0.25 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.071 ( -7.324 22.537 8.907) 25.315 2.303 ( 8.821 29.352 -0.940) 30.663 3.606 ( -6.625 26.249 2.772) 27.214 5.214 ( -5.159 0.476 5.379) 7.468 6.170 ( -1.592 -3.372 0.891) 3.834 7.155 ( 2.823 -14.698 -4.885) 15.744 7.538 ( 3.930 -13.230 -1.482) 13.881 8.122 ( -11.262 3.288 5.322) 12.883 8.267 ( 1.896 2.548 5.515) 6.364 8.478 ( -5.895 12.999 -1.427) 14.344 8.870 ( 2.386 -12.991 2.269) 13.402 9.263 ( -2.137 7.770 1.898) 8.279 9.584 ( 0.632 -5.014 -12.296) 13.294 9.716 ( 5.320 -15.838 0.804) 16.727 10.002 ( 6.384 4.495 -0.927) 7.862 10.151 ( 0.274 3.895 4.074) 5.643 10.242 ( -5.921 4.252 -5.041) 8.863 10.729 ( 8.877 -0.227 -5.758) 10.583 11.116 ( -5.462 -2.130 0.306) 5.871 11.654 ( -0.733 1.413 0.581) 1.694 12.253 ( 6.298 -6.300 4.697) 10.070 12.569 ( 8.436 -4.765 -10.256) 14.109 12.873 ( -2.019 -2.652 -2.994) 4.481 13.095 ( 0.902 0.137 -0.449) 1.017 13.321 ( 2.071 -4.930 4.867) 7.231 13.682 ( -1.474 3.884 -2.024) 4.621 13.899 ( 3.214 -1.845 -2.707) 4.589 14.313 ( -9.948 -2.621 7.430) 12.690 14.811 ( -1.220 -2.087 1.322) 2.755 15.407 ( 0.182 2.607 4.082) 4.847 18.388 ( 2.448 3.079 2.183) 4.499 19.416 ( 0.800 -7.849 -3.532) 8.644 19.900 ( 1.507 13.037 1.064) 13.167 20.233 ( -4.435 8.038 -3.176) 9.714 22.655 ( 4.513 -6.832 -2.626) 8.599 23.850 ( -2.966 0.227 1.644) 3.399 ======================= Grid point 196 (83/433) ======================= q-point: (-0.25 0.25 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.951 ( 7.185 21.880 22.811) 32.414 2.211 ( 9.868 28.550 10.559) 32.000 3.225 ( -3.104 37.168 4.402) 37.556 5.123 ( -5.855 2.530 2.302) 6.781 6.246 ( 4.422 -3.693 5.375) 7.879 7.280 ( 3.515 -9.032 -7.000) 11.955 7.636 ( -4.220 -2.805 -4.544) 6.806 8.064 ( -4.338 -7.895 14.538) 17.103 8.175 ( -2.982 1.639 -1.074) 3.568 8.455 ( 8.997 10.680 8.539) 16.369 8.939 ( -6.725 -10.540 -8.559) 15.152 9.190 ( 2.419 7.466 1.519) 7.994 9.666 ( 5.672 -7.611 -7.610) 12.166 9.854 ( -1.978 -2.709 -0.982) 3.495 9.993 ( -3.297 -1.878 -0.596) 3.841 10.170 ( 3.966 -2.954 0.675) 4.991 10.284 ( 9.457 -1.448 11.285) 14.795 10.893 ( 7.843 -6.020 -3.543) 10.503 11.052 ( -3.526 -2.155 1.862) 4.532 11.636 ( -0.077 -0.112 -0.835) 0.846 12.422 ( -0.630 -6.737 4.629) 8.198 12.677 ( 6.544 -4.796 -6.663) 10.498 12.853 ( 3.998 5.366 -7.386) 9.966 13.043 ( -6.945 -4.616 -3.279) 8.960 13.325 ( -6.311 3.940 4.673) 8.785 13.690 ( 3.511 -1.546 -0.097) 3.838 13.839 ( -4.563 3.112 -6.598) 8.605 14.319 ( 2.893 -1.807 7.379) 8.129 14.816 ( -1.856 -3.297 -0.936) 3.897 15.402 ( -3.820 -2.196 7.827) 8.983 18.413 ( 0.298 1.864 3.632) 4.094 19.364 ( -5.050 0.311 -9.727) 10.964 19.847 ( 7.233 14.592 3.304) 16.618 20.154 ( 1.538 2.550 -2.136) 3.665 22.743 ( -0.231 -7.898 -3.355) 8.584 23.804 ( -2.567 0.404 -0.065) 2.599 ======================= Grid point 197 (84/433) ======================= q-point: (-0.17 0.25 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.086 ( 12.100 21.328 23.325) 33.843 2.198 ( 6.188 23.351 26.167) 35.613 2.954 ( 14.476 38.506 7.478) 41.811 5.039 ( -1.274 1.463 -1.671) 2.560 6.447 ( 9.183 -4.733 9.194) 13.830 7.345 ( 6.736 5.983 -13.177) 15.963 7.494 ( -8.780 -5.818 -0.714) 10.557 8.059 ( -3.351 -2.378 5.128) 6.571 8.346 ( 0.453 -6.942 7.597) 10.301 8.568 ( 7.083 -4.944 4.091) 9.558 8.898 ( 4.903 4.696 3.943) 7.852 9.153 ( -0.507 0.754 -5.134) 5.213 9.685 ( -4.510 -0.499 -9.274) 10.324 9.800 ( -0.460 3.796 4.384) 5.817 10.019 ( 1.157 -2.922 6.114) 6.874 10.338 ( 6.873 -9.882 -1.884) 12.183 10.568 ( 7.132 -6.733 13.688) 16.839 10.946 ( -5.283 -7.296 6.010) 10.829 11.148 ( 6.241 -4.158 -0.262) 7.504 11.656 ( 1.355 -3.868 -1.674) 4.427 12.389 ( -8.947 -3.995 0.433) 9.808 12.616 ( -8.255 12.382 -10.718) 18.339 12.868 ( 6.623 -1.247 -6.057) 9.061 12.976 ( -6.540 -5.411 -1.975) 8.716 13.221 ( -0.441 3.678 2.143) 4.279 13.609 ( -6.672 5.757 -0.134) 8.813 13.824 ( 3.802 -2.521 -4.086) 6.124 14.410 ( 2.784 4.905 -2.113) 6.023 14.790 ( -1.054 -1.676 -6.466) 6.762 15.502 ( -2.473 -16.595 19.836) 25.980 18.373 ( -4.628 3.334 2.674) 6.300 19.233 ( -1.001 1.551 -7.651) 7.871 19.865 ( 7.530 14.009 2.293) 16.069 20.162 ( 4.429 2.770 -4.278) 6.752 22.768 ( -3.790 -8.897 -2.143) 9.905 23.765 ( -1.006 0.300 -1.431) 1.775 ======================= Grid point 198 (85/433) ======================= q-point: (-0.08 0.25 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.100 ( 7.633 24.931 17.698) 31.512 2.341 ( 9.561 15.789 30.749) 35.864 3.111 ( 29.929 24.680 14.641) 41.463 5.035 ( 1.877 -2.841 -5.334) 6.328 6.715 ( 8.703 -5.340 8.309) 13.165 7.243 ( 6.638 13.375 -7.342) 16.639 7.506 ( -3.652 -11.029 -1.224) 11.682 8.109 ( 2.686 -3.903 -0.220) 4.743 8.240 ( -11.049 0.021 -4.571) 11.957 8.768 ( 5.341 -0.751 4.852) 7.254 9.051 ( 4.823 7.898 11.775) 14.977 9.245 ( 12.500 -14.414 1.737) 19.158 9.541 ( -2.584 6.805 -0.696) 7.313 9.762 ( -5.555 -0.120 2.535) 6.108 10.111 ( 2.323 -0.174 7.093) 7.466 10.483 ( -2.837 -11.753 -4.139) 12.780 10.761 ( 6.791 -0.294 9.206) 11.444 11.038 ( -2.850 -10.687 13.787) 17.675 11.249 ( 2.161 -2.829 1.521) 3.871 11.718 ( -0.045 -6.433 -2.046) 6.751 12.214 ( -13.756 13.093 -12.916) 22.967 12.277 ( -6.424 -1.448 0.637) 6.616 12.796 ( -12.802 -1.052 3.887) 13.420 12.993 ( 7.923 0.080 -8.569) 11.671 13.201 ( 1.856 7.151 -4.797) 8.809 13.518 ( -1.378 -0.360 1.844) 2.330 13.864 ( 1.615 -1.697 -4.560) 5.127 14.243 ( -6.128 12.117 -7.678) 15.599 14.757 ( -0.578 -1.760 -6.413) 6.675 15.835 ( 0.364 -23.799 21.132) 31.829 18.262 ( -3.470 4.576 -0.482) 5.763 19.207 ( 0.999 -0.153 -4.341) 4.457 19.818 ( 3.151 12.260 -1.789) 12.784 20.206 ( 7.589 5.529 -1.677) 9.538 22.787 ( -4.170 -10.518 0.285) 11.318 23.745 ( 0.003 0.140 -2.698) 2.701 ======================= Grid point 203 (86/433) ======================= q-point: (-0.67 0.33 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 433 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.072 ( 0.221 -0.000 -4.197) 4.203 3.649 ( -18.037 0.000 -9.608) 20.436 3.759 ( 10.733 -0.000 0.866) 10.768 5.023 ( 3.607 -0.000 2.390) 4.327 6.144 ( -0.999 0.000 1.240) 1.593 6.968 ( -11.815 0.000 -11.018) 16.156 7.263 ( -0.503 0.000 -13.101) 13.110 7.736 ( 0.718 -0.000 -2.526) 2.626 8.679 ( 0.958 -0.000 -5.307) 5.393 8.909 ( -8.141 0.000 -4.276) 9.196 9.185 ( -6.743 0.000 7.854) 10.351 9.488 ( -4.970 0.000 -10.289) 11.426 9.696 ( -4.603 0.000 7.726) 8.993 9.730 ( -1.629 0.000 12.491) 12.597 9.985 ( -1.114 0.000 -1.516) 1.881 10.304 ( -1.833 0.000 3.532) 3.979 10.709 ( 1.441 -0.000 -5.943) 6.116 10.893 ( 4.215 -0.000 -19.217) 19.674 11.226 ( -2.508 0.000 1.127) 2.749 11.422 ( 4.679 -0.000 -2.489) 5.300 12.162 ( -0.970 0.000 2.706) 2.875 12.370 ( -5.439 0.000 2.103) 5.831 12.784 ( -3.648 0.000 -9.509) 10.184 12.866 ( 5.488 -0.000 -1.629) 5.725 13.029 ( 5.575 -0.000 -2.786) 6.232 13.230 ( 10.506 -0.000 8.668) 13.620 13.990 ( -5.913 0.000 2.709) 6.504 14.313 ( -1.103 0.000 6.079) 6.178 14.677 ( 8.767 -0.000 4.979) 10.082 15.549 ( -8.330 0.000 -1.990) 8.564 18.636 ( -0.756 0.000 -6.327) 6.372 18.641 ( 9.877 -0.000 -2.538) 10.198 20.051 ( -2.020 0.000 12.499) 12.661 21.439 ( -21.062 0.000 -9.392) 23.062 21.848 ( 17.781 -0.000 7.586) 19.331 23.844 ( 1.913 -0.000 2.125) 2.859 ======================= Grid point 205 (87/433) ======================= q-point: (-0.58 0.33 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.002 ( -1.132 7.585 -5.468) 9.419 3.243 ( -16.330 8.601 -9.822) 20.907 3.939 ( 7.784 -2.503 -1.048) 8.244 5.109 ( 3.711 -0.563 4.484) 5.848 6.173 ( -0.434 -3.258 1.867) 3.780 6.717 ( -8.635 -2.274 -9.280) 12.879 7.207 ( 0.086 -4.526 -11.933) 12.763 7.829 ( 7.814 -3.515 0.632) 8.591 8.629 ( -6.093 3.260 -6.100) 9.218 8.709 ( -9.211 -4.402 -1.942) 10.392 9.184 ( -0.662 -0.380 6.389) 6.434 9.335 ( -4.264 2.112 -5.834) 7.529 9.474 ( -8.830 16.004 3.450) 18.601 9.807 ( -7.280 -10.409 6.549) 14.291 10.051 ( 4.597 2.690 2.264) 5.787 10.275 ( -1.818 -0.288 2.128) 2.814 10.668 ( -0.671 3.385 -9.548) 10.153 10.770 ( -2.910 0.303 -13.755) 14.062 11.192 ( -3.093 -0.542 0.752) 3.229 11.541 ( 9.498 -0.846 -3.278) 10.083 12.148 ( -1.109 -0.188 -4.826) 4.955 12.293 ( -2.039 2.738 5.357) 6.352 12.722 ( -2.509 -7.168 -6.548) 10.027 12.944 ( 6.808 1.881 -1.332) 7.187 13.109 ( 5.386 0.018 -3.616) 6.487 13.467 ( 9.826 -3.448 6.322) 12.182 13.902 ( -4.384 1.862 1.686) 5.053 14.331 ( -3.686 -3.398 6.525) 8.229 14.804 ( 3.578 0.823 2.615) 4.507 15.451 ( -3.125 0.873 2.766) 4.264 18.564 ( 1.236 6.511 -4.117) 7.802 18.827 ( 7.433 -8.616 -1.340) 11.458 20.097 ( 0.185 1.902 9.886) 10.069 21.033 ( -17.595 4.727 -9.100) 20.365 22.162 ( 13.475 -2.823 4.227) 14.402 23.878 ( 0.055 -0.031 3.210) 3.211 ======================= Grid point 206 (88/433) ======================= q-point: (-0.50 0.33 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 794 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.762 ( -13.685 11.454 -2.575) 18.031 2.935 ( 1.883 16.976 -7.405) 18.617 4.030 ( 4.379 3.994 -1.162) 6.040 5.193 ( 0.968 -1.194 5.929) 6.125 6.150 ( -6.050 -2.710 0.586) 6.655 6.698 ( 3.495 -9.864 -4.486) 11.386 7.214 ( 1.702 -6.900 -7.754) 10.518 8.045 ( 10.228 -6.442 3.624) 12.619 8.397 ( -12.590 3.381 1.398) 13.111 8.612 ( -7.432 -3.340 -7.306) 10.944 9.162 ( -4.465 13.272 3.417) 14.414 9.279 ( 1.161 -3.850 -4.622) 6.127 9.289 ( -1.255 0.868 8.726) 8.859 9.719 ( -13.221 -4.774 -1.863) 14.180 10.079 ( 6.100 9.584 2.726) 11.683 10.282 ( 0.764 2.076 0.303) 2.233 10.506 ( -4.032 4.324 -11.547) 12.973 10.702 ( 0.661 -2.292 -9.648) 9.939 11.143 ( -3.995 -0.688 0.972) 4.169 11.661 ( 4.667 1.056 2.885) 5.587 12.093 ( -0.245 -0.476 -4.870) 4.899 12.340 ( 3.769 -3.696 0.034) 5.279 12.740 ( 0.021 -7.304 -5.223) 8.979 13.053 ( 8.411 0.866 -0.558) 8.474 13.147 ( 1.455 -1.563 -4.223) 4.732 13.684 ( 6.725 -4.056 6.785) 10.378 13.838 ( -0.599 3.067 -1.464) 3.451 14.319 ( -7.063 -4.011 6.510) 10.410 14.817 ( -1.723 0.457 0.922) 2.008 15.447 ( 0.513 1.880 4.700) 5.088 18.508 ( 2.248 7.399 -1.385) 7.856 19.031 ( 5.609 -11.624 -0.075) 12.907 20.128 ( 1.846 5.415 6.002) 8.292 20.670 ( -13.142 6.698 -7.786) 16.679 22.394 ( 8.777 -3.882 0.540) 9.613 23.882 ( -1.741 0.096 2.894) 3.378 ======================= Grid point 207 (89/433) ======================= q-point: (-0.42 0.33 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.451 ( -6.488 16.301 5.774) 18.470 2.798 ( 6.501 21.383 -1.750) 22.418 3.983 ( 0.499 13.323 -0.525) 13.343 5.217 ( -3.160 -0.082 5.522) 6.362 6.104 ( -2.873 -3.409 2.639) 5.181 6.875 ( 4.723 -13.427 -2.847) 14.515 7.318 ( 5.185 -8.972 -1.441) 10.462 8.164 ( -11.295 1.203 5.181) 12.484 8.308 ( 7.141 1.297 0.918) 7.316 8.472 ( -6.296 -9.308 -4.863) 12.244 8.964 ( -3.333 17.603 7.451) 19.404 9.318 ( 0.952 -2.292 0.848) 2.622 9.434 ( 4.185 -13.094 2.471) 13.967 9.526 ( -6.840 0.583 -5.306) 8.676 10.084 ( 1.394 5.327 -4.833) 7.327 10.256 ( 0.201 5.341 1.583) 5.574 10.360 ( 0.713 6.749 -3.667) 7.714 10.705 ( 3.570 -3.479 -10.357) 11.495 11.086 ( -4.447 -0.633 1.290) 4.673 11.704 ( 0.601 3.769 4.257) 5.718 12.139 ( 3.847 -5.143 2.226) 6.797 12.441 ( 2.734 -7.847 -5.247) 9.828 12.791 ( 3.141 -5.134 -6.675) 8.987 13.097 ( -1.586 -0.153 -4.049) 4.351 13.237 ( 7.655 -3.309 1.345) 8.447 13.750 ( -3.991 2.022 2.785) 5.270 13.878 ( 7.766 0.243 -1.043) 7.840 14.256 ( -8.729 -2.912 7.441) 11.833 14.779 ( -2.917 -1.223 -0.050) 3.163 15.454 ( -0.912 2.087 3.215) 3.940 18.485 ( 2.888 6.740 1.911) 7.577 19.215 ( 2.472 -11.883 -0.975) 12.177 20.126 ( 3.449 9.801 3.219) 10.877 20.385 ( -7.903 6.938 -5.771) 11.996 22.536 ( 3.937 -5.282 -2.770) 7.147 23.855 ( -2.702 0.243 1.458) 3.080 ======================= Grid point 208 (90/433) ======================= q-point: (-0.33 0.33 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 794 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.344 ( 5.758 18.472 17.026) 25.773 2.714 ( 7.441 23.079 5.808) 24.935 3.800 ( -0.566 22.624 0.419) 22.635 5.163 ( -5.162 1.673 3.274) 6.338 6.167 ( 2.713 -4.423 6.332) 8.187 7.050 ( 2.744 -13.461 -2.469) 13.958 7.516 ( 6.791 -7.937 1.061) 10.499 8.009 ( -8.369 0.866 5.729) 10.179 8.219 ( -4.396 3.000 -3.528) 6.385 8.644 ( 6.176 -10.964 2.549) 12.840 8.792 ( -2.216 16.094 4.013) 16.735 9.331 ( -1.344 3.250 3.450) 4.927 9.486 ( 2.236 -7.606 -6.597) 10.313 9.666 ( 4.776 -13.350 1.805) 14.293 9.973 ( -3.887 0.316 -3.576) 5.291 10.199 ( -0.915 5.018 0.704) 5.149 10.390 ( 9.636 8.711 3.143) 13.364 10.775 ( 4.960 -7.119 -7.759) 11.640 11.034 ( -2.186 0.323 1.796) 2.847 11.676 ( -0.767 4.298 1.802) 4.723 12.287 ( 0.649 -6.816 5.087) 8.530 12.537 ( 4.542 -9.330 -3.809) 11.054 12.851 ( 2.782 -5.538 -9.207) 11.098 13.014 ( -3.675 2.004 -5.090) 6.590 13.366 ( -0.006 -0.117 5.567) 5.568 13.678 ( -0.082 0.970 -2.825) 2.988 13.913 ( -1.883 4.129 -1.201) 4.694 14.255 ( 0.639 -4.434 9.324) 10.344 14.752 ( -2.204 -2.954 -1.605) 4.020 15.403 ( -4.888 1.298 1.414) 5.252 18.489 ( 1.895 5.843 5.003) 7.922 19.294 ( -2.281 -7.136 -5.686) 9.405 20.093 ( 1.354 10.170 4.966) 11.398 20.240 ( 2.746 6.519 -4.495) 8.381 22.596 ( -0.925 -7.112 -5.025) 8.758 23.811 ( -2.400 0.349 -0.371) 2.453 ======================= Grid point 209 (91/433) ======================= q-point: (-0.25 0.33 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.458 ( 12.706 18.055 22.708) 31.671 2.661 ( 5.069 23.035 14.357) 27.612 3.595 ( 6.088 27.076 2.304) 27.848 5.074 ( -3.893 2.130 0.026) 4.437 6.347 ( 7.122 -5.604 9.295) 12.982 7.189 ( -0.748 -13.764 -1.379) 13.853 7.595 ( 4.624 7.292 -9.401) 12.765 7.979 ( -5.550 -5.451 10.968) 13.447 8.222 ( 5.133 -3.722 5.225) 8.216 8.613 ( -3.959 4.604 -4.536) 7.580 8.867 ( 9.915 -1.052 3.086) 10.437 9.268 ( -2.409 6.852 4.561) 8.577 9.563 ( 0.731 -9.119 -9.625) 13.279 9.736 ( -6.596 -8.472 -1.646) 10.862 10.059 ( 7.225 2.791 11.216) 13.630 10.182 ( 2.208 -4.695 -1.212) 5.327 10.525 ( 10.559 2.770 5.803) 12.363 10.851 ( -0.810 -4.376 0.334) 4.463 11.075 ( 5.098 -2.802 -0.195) 5.820 11.637 ( -0.696 2.097 0.758) 2.336 12.298 ( -5.920 -5.102 -1.687) 7.995 12.727 ( 6.788 -5.421 -1.159) 8.765 12.783 ( -13.240 -5.344 -6.189) 15.561 12.947 ( 5.887 4.759 -7.874) 10.922 13.286 ( -6.860 3.564 5.803) 9.666 13.701 ( -1.878 0.000 -0.518) 1.948 13.793 ( -1.373 2.842 -3.266) 4.542 14.427 ( 6.742 -3.144 4.658) 8.777 14.738 ( -1.388 -3.142 -3.480) 4.890 15.320 ( -5.827 -3.594 4.490) 8.187 18.471 ( -1.414 6.779 6.207) 9.300 19.233 ( -3.029 -1.924 -8.543) 9.267 20.056 ( -1.456 4.342 5.180) 6.915 20.266 ( 11.022 9.772 -2.506) 14.942 22.590 ( -4.954 -9.265 -5.464) 11.842 23.772 ( -1.047 0.330 -1.817) 2.123 ======================= Grid point 210 (92/433) ======================= q-point: (-0.17 0.33 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 794 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.569 ( 5.901 23.348 13.958) 27.835 2.656 ( 7.829 16.768 25.457) 31.472 3.583 ( 17.983 22.212 7.411) 29.524 5.007 ( -1.901 -0.072 -2.694) 3.298 6.596 ( 7.376 -7.103 9.413) 13.909 7.259 ( -5.242 -12.223 -0.017) 13.300 7.535 ( 10.405 14.217 -9.341) 19.941 8.020 ( -0.865 -5.424 4.576) 7.149 8.268 ( -6.480 2.170 -3.095) 7.502 8.678 ( 10.517 -5.370 8.142) 14.344 9.025 ( 3.895 -7.074 -6.124) 10.135 9.244 ( 5.227 8.274 13.704) 16.840 9.549 ( -2.498 -3.741 -8.940) 10.008 9.690 ( -7.944 -7.790 1.391) 11.213 10.150 ( 1.547 2.843 10.032) 10.541 10.327 ( 7.234 -3.728 -2.725) 8.582 10.742 ( 8.208 -2.231 8.981) 12.370 10.887 ( 0.001 -3.987 6.264) 7.425 11.188 ( 3.402 -3.524 0.743) 4.955 11.628 ( -0.742 -1.852 -0.382) 2.032 12.209 ( -6.989 -2.957 -5.008) 9.092 12.465 ( -13.332 7.515 -10.218) 18.402 12.763 ( -8.359 -1.163 3.020) 8.963 12.988 ( 7.015 0.348 -7.007) 9.921 13.267 ( 1.445 0.033 3.920) 4.179 13.565 ( -5.116 4.714 -0.683) 6.990 13.808 ( 0.249 -3.786 -3.226) 4.980 14.441 ( -3.204 7.400 -6.518) 10.369 14.717 ( -1.888 -2.424 -3.911) 4.973 15.448 ( 4.050 -15.658 12.815) 20.635 18.388 ( -2.534 8.451 3.930) 9.658 19.183 ( 0.059 -2.197 -5.630) 6.044 19.989 ( -4.198 4.508 0.733) 6.204 20.360 ( 12.539 11.082 0.498) 16.742 22.567 ( -6.174 -12.007 -3.580) 13.969 23.749 ( 0.188 0.274 -2.812) 2.832 ======================= Grid point 211 (93/433) ======================= q-point: (-0.08 0.33 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.533 ( 6.636 19.080 14.278) 24.737 2.789 ( 8.272 13.591 20.864) 26.238 3.800 ( 20.739 14.659 10.450) 27.463 4.975 ( -2.011 -3.278 -3.683) 5.325 6.773 ( -0.024 -6.271 3.026) 6.963 7.286 ( -3.089 -7.697 0.142) 8.295 7.599 ( 16.956 11.362 -0.053) 20.411 8.037 ( -5.800 4.189 -8.636) 11.215 8.151 ( 2.511 -5.709 1.795) 6.490 8.927 ( 9.006 -1.168 3.549) 9.751 9.073 ( -0.823 -3.900 4.294) 5.859 9.381 ( -4.295 -6.217 -0.698) 7.588 9.560 ( 11.369 -0.215 4.666) 12.291 9.632 ( -7.952 -4.897 1.982) 9.547 10.168 ( -3.105 2.741 8.788) 9.715 10.424 ( 5.284 0.238 -5.435) 7.584 10.863 ( -0.424 -0.712 7.166) 7.213 11.053 ( 6.049 -6.751 9.556) 13.172 11.274 ( 2.340 -3.480 4.447) 6.113 11.607 ( -5.602 -4.050 -3.146) 7.595 11.971 ( -12.313 6.148 -11.985) 18.250 12.256 ( -1.305 1.590 0.256) 2.073 12.610 ( -11.417 0.581 4.022) 12.119 13.061 ( 5.745 0.626 -5.489) 7.970 13.244 ( -0.500 4.241 -3.877) 5.768 13.525 ( 0.317 0.536 3.606) 3.660 13.803 ( -1.905 -3.444 -6.437) 7.545 14.206 ( -5.920 10.227 -6.632) 13.551 14.672 ( -3.947 -2.444 -2.796) 5.419 15.787 ( 5.620 -17.016 10.974) 21.013 18.307 ( 1.394 7.966 0.096) 8.087 19.182 ( -0.182 -0.885 -3.379) 3.498 19.857 ( -4.838 3.607 -1.755) 6.285 20.464 ( 11.409 11.260 3.880) 16.493 22.581 ( -5.899 -13.907 -1.253) 15.158 23.733 ( 0.643 0.528 -3.791) 3.881 ======================= Grid point 217 (94/433) ======================= q-point: (-0.58 0.42 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 432 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.875 ( -13.518 0.000 -3.100) 13.869 3.107 ( 0.566 -0.000 -5.623) 5.651 4.062 ( 8.055 -0.000 -2.329) 8.385 5.181 ( 1.599 -0.000 5.093) 5.338 6.121 ( -5.669 0.000 1.790) 5.945 6.599 ( 1.987 -0.000 -4.900) 5.287 7.147 ( 2.539 -0.000 -7.826) 8.228 7.974 ( 10.124 -0.000 2.310) 10.384 8.439 ( -15.280 0.000 6.238) 16.504 8.579 ( -2.182 0.000 -13.071) 13.252 9.192 ( -1.762 0.000 3.727) 4.122 9.238 ( -1.638 0.000 -6.355) 6.563 9.448 ( -10.641 0.000 8.943) 13.900 9.622 ( -7.917 0.000 4.724) 9.219 10.242 ( 10.185 -0.000 2.527) 10.493 10.257 ( 0.144 -0.000 -0.449) 0.472 10.581 ( -6.705 0.000 -11.559) 13.363 10.624 ( -1.955 0.000 -10.399) 10.581 11.143 ( -3.261 0.000 1.271) 3.500 11.678 ( 7.735 -0.000 0.294) 7.741 12.089 ( -1.158 0.000 -6.564) 6.665 12.303 ( -2.112 0.000 5.732) 6.109 12.660 ( 3.581 -0.000 -7.323) 8.152 13.059 ( 8.326 -0.000 -2.935) 8.828 13.136 ( 0.991 -0.000 -5.515) 5.603 13.642 ( 6.689 -0.000 9.452) 11.579 13.870 ( 0.308 -0.000 -2.438) 2.457 14.278 ( -5.906 0.000 7.093) 9.230 14.821 ( -2.371 0.000 0.674) 2.465 15.465 ( 0.263 -0.000 4.995) 5.002 18.613 ( 2.579 -0.000 -2.068) 3.306 18.884 ( 5.388 -0.000 0.110) 5.389 20.182 ( 2.595 -0.000 6.944) 7.414 20.736 ( -13.886 0.000 -8.547) 16.305 22.355 ( 8.893 -0.000 1.033) 8.953 23.883 ( -1.661 0.000 2.894) 3.337 ======================= Grid point 219 (95/433) ======================= q-point: (-0.50 0.42 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.671 ( -6.125 6.042 4.134) 9.545 3.091 ( 4.060 8.176 -1.135) 9.199 4.141 ( 4.667 3.723 -2.607) 6.514 5.214 ( -1.647 -0.140 5.175) 5.433 6.051 ( -3.993 -1.665 3.286) 5.433 6.682 ( 5.119 -5.599 -1.648) 7.763 7.203 ( 5.838 -2.966 -0.728) 6.589 8.153 ( 3.046 -1.962 1.985) 4.132 8.262 ( -7.832 -2.264 7.449) 11.043 8.442 ( -2.705 2.381 -11.962) 12.493 9.174 ( -1.573 1.366 1.203) 2.406 9.237 ( 0.846 -6.111 0.808) 6.222 9.328 ( -5.160 5.166 8.309) 11.061 9.546 ( -5.391 0.403 3.416) 6.395 10.230 ( 2.651 8.192 -6.354) 10.701 10.344 ( -0.619 5.245 -2.527) 5.855 10.449 ( 3.474 1.451 -2.519) 4.530 10.561 ( -2.489 -10.408 -12.236) 16.255 11.099 ( -2.547 1.223 2.157) 3.554 11.790 ( 4.375 4.129 7.838) 9.880 12.060 ( 1.339 -3.016 -3.918) 5.122 12.308 ( -1.953 -4.548 0.139) 4.952 12.705 ( 4.925 -2.867 -9.559) 11.129 13.094 ( -1.081 -0.109 -5.794) 5.895 13.197 ( 9.001 -0.966 -1.109) 9.121 13.756 ( -2.200 -0.419 10.530) 10.765 13.903 ( 7.514 1.297 -4.267) 8.738 14.213 ( -7.439 -1.258 6.480) 9.946 14.764 ( -4.069 -0.402 -0.513) 4.121 15.482 ( -1.402 0.768 3.132) 3.516 18.625 ( 3.250 6.419 1.349) 7.320 19.003 ( 2.961 -8.426 0.994) 8.986 20.258 ( 4.410 3.631 4.093) 7.027 20.480 ( -9.364 2.637 -7.453) 12.255 22.463 ( 3.569 -2.046 -2.721) 4.932 23.859 ( -2.617 0.104 1.399) 2.969 ======================= Grid point 220 (96/433) ======================= q-point: (-0.42 0.42 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.633 ( 5.183 10.858 13.060) 17.757 3.071 ( 5.075 13.368 3.800) 14.796 4.105 ( 0.772 9.686 -2.083) 9.938 5.189 ( -4.054 1.013 3.924) 5.733 6.085 ( 1.521 -3.676 6.378) 7.517 6.815 ( 2.239 -9.698 -0.303) 9.958 7.389 ( 9.467 -4.681 6.661) 12.486 8.049 ( -7.464 2.807 1.494) 8.113 8.234 ( -7.269 -4.109 -5.118) 9.794 8.471 ( 9.080 -1.602 1.346) 9.318 9.130 ( 0.138 12.598 7.515) 14.670 9.270 ( -2.073 -2.433 0.864) 3.311 9.375 ( 0.527 -10.835 3.907) 11.530 9.506 ( 2.090 0.303 0.547) 2.181 10.052 ( -3.720 8.534 -10.560) 14.078 10.291 ( -0.416 3.735 0.246) 3.766 10.535 ( 8.173 4.638 3.512) 10.032 10.591 ( 1.949 -11.937 -12.846) 17.644 11.065 ( -0.600 2.621 2.128) 3.429 11.801 ( 0.808 8.801 4.154) 9.765 12.172 ( 3.202 -5.558 5.979) 8.769 12.337 ( -0.127 -10.412 -3.082) 10.859 12.730 ( 0.439 -5.642 -12.282) 13.522 13.055 ( 1.594 1.667 -5.095) 5.593 13.339 ( 4.432 -1.808 3.108) 5.708 13.716 ( -4.641 2.224 2.287) 5.632 13.983 ( 2.188 2.874 0.712) 3.681 14.170 ( -2.624 -3.809 7.023) 8.409 14.708 ( -2.232 -1.585 -2.647) 3.809 15.429 ( -5.096 1.145 0.006) 5.223 18.625 ( 2.773 7.814 5.258) 9.818 19.124 ( -0.038 -9.452 -0.108) 9.453 20.228 ( -6.741 4.345 -0.098) 8.021 20.375 ( 8.053 6.122 -2.970) 10.543 22.482 ( -1.668 -4.384 -6.044) 7.651 23.817 ( -2.348 0.208 -0.532) 2.416 ======================= Grid point 221 (97/433) ======================= q-point: (-0.33 0.42 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.768 ( 12.495 13.561 18.471) 26.100 3.045 ( 4.186 16.315 9.047) 19.119 3.982 ( 0.433 13.587 -0.840) 13.619 5.117 ( -4.381 2.251 1.706) 5.213 6.237 ( 5.307 -5.598 8.738) 11.656 6.932 ( -0.752 -11.963 0.414) 11.994 7.645 ( 9.878 -1.841 8.250) 13.001 7.928 ( -4.814 0.889 -0.016) 4.895 8.178 ( 0.640 -2.553 -0.215) 2.641 8.604 ( 3.361 -1.387 -0.655) 3.695 9.042 ( 2.661 14.820 3.048) 15.362 9.272 ( -4.114 -6.068 -0.879) 7.384 9.457 ( 1.589 -1.582 5.499) 5.938 9.587 ( -0.111 -6.797 -9.277) 11.501 9.993 ( 5.822 -2.723 5.918) 8.737 10.231 ( -1.321 4.432 -0.757) 4.687 10.622 ( 8.565 4.844 -1.662) 9.979 10.723 ( 4.473 -8.802 -1.129) 9.938 11.065 ( 2.457 1.696 0.759) 3.080 11.736 ( -0.372 8.016 1.846) 8.234 12.212 ( -3.032 -3.338 -2.521) 5.166 12.519 ( 1.401 -12.965 7.141) 14.867 12.681 ( -2.142 -5.894 -12.621) 14.093 13.050 ( 4.720 4.340 -5.503) 8.450 13.349 ( -7.416 2.256 6.696) 10.243 13.653 ( -1.749 -1.985 -1.474) 3.028 13.902 ( -4.455 6.192 -0.412) 7.640 14.310 ( 4.647 -7.994 7.855) 12.133 14.694 ( 1.237 -1.375 -4.509) 4.873 15.304 ( -7.155 0.677 -1.879) 7.428 18.623 ( 0.860 8.562 8.588) 12.157 19.160 ( -2.761 -5.426 -3.894) 7.227 20.089 ( -6.394 0.553 1.229) 6.535 20.474 ( 13.686 10.032 -1.240) 17.014 22.427 ( -6.232 -7.305 -8.081) 12.550 23.777 ( -1.076 0.240 -2.036) 2.315 ======================= Grid point 222 (98/433) ======================= q-point: (-0.25 0.42 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.951 ( 11.662 15.256 17.381) 25.901 2.994 ( 1.510 18.422 12.715) 22.435 3.912 ( 6.744 11.551 2.589) 13.624 5.030 ( -3.833 2.294 -0.230) 4.473 6.444 ( 4.076 -8.440 8.758) 12.828 7.035 ( 0.320 -10.357 1.147) 10.425 7.766 ( 7.977 8.058 -4.792) 12.310 7.906 ( -3.930 -5.865 8.334) 10.923 8.291 ( 5.112 0.054 1.401) 5.301 8.644 ( 6.689 2.067 2.747) 7.521 8.980 ( 1.242 3.161 -6.858) 7.652 9.244 ( -6.416 -7.454 1.144) 9.902 9.538 ( 2.302 -1.368 -4.536) 5.267 9.560 ( 0.016 -0.581 5.090) 5.123 10.139 ( -0.308 -3.204 -4.903) 5.865 10.291 ( 9.520 -1.966 12.395) 15.753 10.726 ( 7.086 1.801 2.961) 7.888 10.842 ( 3.418 -2.879 0.983) 4.575 11.130 ( 4.442 -1.878 -0.037) 4.823 11.668 ( -1.106 5.878 1.654) 6.206 12.157 ( -3.218 -2.069 -6.028) 7.140 12.461 ( -13.963 -5.547 -5.403) 15.967 12.748 ( 0.984 -3.107 -1.700) 3.676 13.048 ( 4.182 5.886 -3.135) 7.871 13.251 ( -3.582 -0.527 7.875) 8.667 13.617 ( -5.462 -2.023 -3.434) 6.762 13.776 ( -3.134 3.048 -0.735) 4.433 14.474 ( 1.148 -5.035 0.703) 5.212 14.687 ( -1.742 0.385 -3.505) 3.933 15.250 ( 2.224 -5.229 2.136) 6.071 18.577 ( -1.504 10.708 8.490) 13.748 19.128 ( -1.592 -3.401 -4.831) 6.118 20.008 ( -6.459 -1.622 2.456) 7.098 20.602 ( 15.152 12.946 -0.640) 19.940 22.341 ( -8.282 -11.157 -7.657) 15.865 23.754 ( 0.290 0.265 -2.800) 2.827 ======================= Grid point 223 (99/433) ======================= q-point: (-0.17 0.42 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.900 ( 0.383 18.245 11.601) 21.624 3.055 ( 7.055 13.987 13.992) 21.005 4.022 ( 12.605 7.236 6.616) 15.969 4.948 ( -3.763 0.758 -0.800) 3.921 6.600 ( -2.395 -10.946 5.463) 12.465 7.164 ( 4.438 -4.925 1.693) 6.843 7.801 ( 9.389 6.915 -3.185) 12.088 7.978 ( 0.356 -7.288 4.626) 8.640 8.232 ( 0.709 12.487 -5.980) 13.863 8.881 ( 8.969 -2.587 4.927) 10.555 8.961 ( 3.314 -5.367 -0.670) 6.343 9.207 ( -8.815 -10.470 -2.332) 13.884 9.506 ( -5.247 -6.386 -3.979) 9.173 9.671 ( 10.644 8.150 8.474) 15.860 10.145 ( -0.714 -4.504 -2.183) 5.055 10.473 ( 4.784 2.784 4.006) 6.832 10.862 ( 3.812 -2.757 5.842) 7.501 10.938 ( 5.233 -2.641 4.733) 7.534 11.216 ( 2.546 -2.096 1.841) 3.777 11.592 ( -4.303 3.271 0.416) 5.421 12.045 ( -6.330 1.889 -11.214) 13.015 12.259 ( -7.609 -2.205 -3.683) 8.737 12.647 ( -9.331 2.887 1.167) 9.837 13.080 ( 4.929 2.068 0.996) 5.437 13.306 ( 1.083 0.757 0.380) 1.375 13.519 ( -1.779 -0.898 -0.539) 2.065 13.721 ( -4.008 -3.471 -2.004) 5.668 14.387 ( -5.985 7.613 -7.973) 12.544 14.614 ( -5.571 -3.672 -0.137) 6.674 15.506 ( 11.467 -11.636 6.172) 17.463 18.491 ( 0.043 10.997 4.653) 11.940 19.134 ( 0.275 -3.526 -1.474) 3.832 19.903 ( -8.305 0.433 0.653) 8.342 20.705 ( 12.683 13.667 0.419) 18.650 22.302 ( -6.516 -14.754 -4.880) 16.851 23.744 ( 0.962 0.577 -3.163) 3.356 ======================= Grid point 224 (100/433) ======================= q-point: (-0.08 0.42 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.823 ( 1.158 11.968 8.119) 14.508 3.109 ( 4.498 9.730 11.493) 15.716 4.210 ( 11.352 5.488 6.241) 14.069 4.882 ( -4.218 -1.188 0.075) 4.383 6.643 ( -6.250 -8.819 2.400) 11.072 7.248 ( 2.664 0.449 -2.413) 3.622 7.877 ( 2.516 1.778 -5.529) 6.329 8.088 ( 7.533 5.200 4.926) 10.395 8.184 ( 10.294 0.762 -1.119) 10.382 8.925 ( -0.454 -6.334 -3.670) 7.334 9.112 ( -11.495 -9.568 -2.938) 15.242 9.214 ( 9.702 0.086 7.256) 12.116 9.445 ( -4.856 -5.686 -3.155) 8.116 9.843 ( 10.654 3.888 5.931) 12.799 10.151 ( -1.878 -2.588 -1.394) 3.488 10.473 ( -0.527 2.925 -2.990) 4.216 10.879 ( -4.638 4.195 6.974) 9.368 11.150 ( 6.699 -5.968 4.725) 10.140 11.292 ( 1.031 -5.377 3.099) 6.291 11.469 ( -4.047 1.100 -2.398) 4.831 11.817 ( -6.817 5.929 -7.682) 11.859 12.202 ( -5.000 -3.750 0.745) 6.295 12.495 ( -5.529 1.278 1.656) 5.912 13.168 ( 4.438 1.202 5.269) 6.993 13.220 ( -0.363 5.756 -9.804) 11.375 13.577 ( 1.874 0.302 4.958) 5.309 13.677 ( -3.224 -5.223 -5.018) 7.928 14.162 ( -5.729 6.733 -3.703) 9.585 14.559 ( -4.656 -2.659 -0.794) 5.420 15.814 ( 7.484 -10.126 3.767) 13.143 18.443 ( 4.057 9.242 0.599) 10.111 19.156 ( -0.332 -0.336 -1.115) 1.211 19.759 ( -7.803 -0.293 1.598) 7.971 20.776 ( 9.271 10.469 2.747) 14.251 22.333 ( -4.877 -14.304 -3.068) 15.420 23.735 ( 1.340 1.121 -3.236) 3.678 ======================= Grid point 231 (101/433) ======================= q-point: ( 0.50 -0.50 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 433 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.740 ( 5.013 0.000 11.728) 12.755 3.203 ( 3.994 0.000 3.250) 5.149 4.195 ( 1.164 0.000 -3.010) 3.227 5.199 ( -3.391 0.000 4.063) 5.292 6.046 ( 1.141 0.000 6.214) 6.318 6.716 ( 2.172 0.000 0.595) 2.252 7.344 ( 9.784 -0.000 8.452) 12.929 8.114 ( -5.334 -0.000 -8.258) 9.831 8.131 ( -7.436 0.000 6.855) 10.114 8.493 ( 9.537 0.000 -3.138) 10.040 9.190 ( -0.192 -0.000 5.674) 5.677 9.231 ( 2.571 0.000 -1.878) 3.184 9.332 ( -3.256 0.000 11.729) 12.172 9.515 ( -1.847 0.000 1.471) 2.361 10.278 ( -2.665 -0.000 -9.963) 10.313 10.302 ( -6.731 0.000 -14.501) 15.987 10.350 ( 6.256 0.000 -0.477) 6.275 10.586 ( 8.276 0.000 0.969) 8.332 11.099 ( -0.129 0.000 2.226) 2.230 11.990 ( 5.962 -0.000 17.500) 18.488 12.021 ( 1.473 0.000 -7.208) 7.357 12.229 ( -3.326 0.000 -2.017) 3.890 12.670 ( 0.453 0.000 -13.542) 13.550 13.072 ( 2.705 0.000 -5.042) 5.722 13.319 ( 5.200 0.000 1.906) 5.539 13.741 ( -5.318 0.000 5.731) 7.818 14.014 ( 4.949 0.000 1.665) 5.222 14.129 ( -5.392 0.000 4.301) 6.897 14.692 ( -2.237 0.000 -2.892) 3.656 15.441 ( -5.134 0.000 -0.212) 5.138 18.731 ( 3.096 -0.000 4.400) 5.380 19.001 ( 0.689 0.000 2.940) 3.020 20.269 ( -8.617 0.000 -2.938) 9.103 20.438 ( 9.092 0.000 -1.613) 9.234 22.438 ( -1.985 0.000 -6.390) 6.691 23.819 ( -2.342 0.000 -0.579) 2.413 ======================= Grid point 233 (102/433) ======================= q-point: (-0.42 0.50 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.954 ( 12.504 5.162 16.043) 20.985 3.264 ( 3.377 5.953 6.377) 9.355 4.141 ( -2.880 3.694 -2.576) 5.346 5.153 ( -3.852 1.160 2.661) 4.823 6.152 ( 4.208 -2.581 7.975) 9.380 6.764 ( 0.366 -4.797 2.204) 5.292 7.598 ( 8.509 -1.693 17.709) 19.720 7.958 ( -5.014 1.105 -7.118) 8.777 8.117 ( 1.495 -2.506 0.716) 3.005 8.630 ( 9.008 2.404 -1.390) 9.426 9.181 ( -2.968 0.398 0.082) 2.995 9.243 ( -4.809 -1.414 1.751) 5.309 9.412 ( 6.532 2.171 9.993) 12.135 9.517 ( 1.748 -1.991 -4.638) 5.342 10.050 ( -1.911 7.774 -6.741) 10.466 10.254 ( -2.484 -3.713 -3.177) 5.482 10.524 ( 9.992 -6.799 -2.484) 12.338 10.706 ( 6.597 1.722 1.025) 6.895 11.109 ( 1.303 1.862 0.610) 2.353 11.925 ( 0.704 10.208 -3.635) 10.858 12.177 ( -1.121 -0.527 -2.313) 2.624 12.267 ( 2.173 -11.823 15.008) 19.229 12.584 ( -1.056 -3.246 -14.095) 14.502 13.103 ( 4.835 1.329 -4.637) 6.829 13.363 ( -3.735 -0.228 5.746) 6.857 13.649 ( -7.239 0.691 1.231) 7.375 14.016 ( -2.669 5.870 1.971) 6.743 14.155 ( 1.117 -7.427 4.784) 8.905 14.679 ( 3.289 -0.332 -4.596) 5.661 15.319 ( -7.311 0.529 -3.260) 8.023 18.777 ( 2.016 6.338 8.030) 10.427 19.046 ( -1.677 -5.252 2.967) 6.261 20.095 ( -8.741 0.102 -3.749) 9.511 20.614 ( 14.384 3.943 -0.384) 14.919 22.326 ( -7.198 -2.866 -9.581) 12.322 23.781 ( -1.096 0.088 -2.131) 2.397 ======================= Grid point 234 (103/433) ======================= q-point: (-0.33 0.50 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 794 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.185 ( 8.617 8.822 15.269) 19.628 3.290 ( 5.791 11.445 8.586) 15.435 4.038 ( -2.693 2.490 -1.060) 3.818 5.084 ( -3.677 2.834 1.730) 4.954 6.294 ( 1.114 -6.382 7.437) 9.863 6.875 ( 5.348 -6.026 3.662) 8.850 7.786 ( -2.648 -3.338 17.932) 18.432 7.855 ( -1.962 -0.584 -6.312) 6.636 8.291 ( 16.834 0.259 1.719) 16.924 8.720 ( 6.619 4.346 -0.198) 7.920 9.087 ( -5.788 1.977 -4.508) 7.598 9.144 ( -4.832 1.890 -1.783) 5.487 9.457 ( -1.409 -2.361 -13.179) 13.463 9.607 ( 8.049 1.076 9.618) 12.588 10.045 ( 1.575 -5.455 -1.956) 6.006 10.273 ( 3.390 -0.160 6.825) 7.622 10.751 ( 11.272 -4.432 -1.344) 12.186 10.778 ( 2.709 1.581 1.420) 3.443 11.124 ( 2.675 0.747 -0.698) 2.864 11.819 ( -0.127 8.357 -2.639) 8.765 12.144 ( -0.141 1.003 -4.735) 4.842 12.338 ( -10.847 -6.179 1.897) 12.626 12.633 ( 5.128 -7.368 -2.304) 9.268 13.147 ( 5.300 3.180 -1.760) 6.426 13.269 ( -9.180 2.085 7.507) 12.040 13.537 ( -7.534 -4.059 -1.961) 8.779 13.892 ( -4.550 7.430 0.031) 8.712 14.304 ( 1.937 -10.570 3.901) 11.432 14.711 ( 1.144 1.204 -4.125) 4.447 15.208 ( -0.210 -0.368 -3.323) 3.350 18.777 ( -0.289 9.414 11.353) 14.751 19.059 ( -2.642 -3.664 -0.012) 4.517 19.956 ( -7.587 -3.063 -1.478) 8.315 20.820 ( 17.307 8.829 -0.241) 19.430 22.157 ( -10.713 -7.383 -11.042) 17.065 23.758 ( 0.355 0.159 -2.744) 2.771 ======================= Grid point 235 (104/433) ======================= q-point: (-0.25 0.50 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.187 ( -3.091 10.786 10.599) 15.435 3.339 ( 6.407 15.625 7.348) 18.417 4.060 ( 4.637 -3.077 3.012) 6.328 5.000 ( -3.632 4.093 1.984) 5.821 6.391 ( -3.207 -9.870 5.568) 11.777 7.089 ( 10.700 -3.055 4.125) 11.868 7.827 ( 0.522 -3.616 -3.068) 4.771 7.850 ( -2.861 -4.662 8.828) 10.385 8.527 ( 13.587 15.020 -1.383) 20.301 8.834 ( 9.436 -2.367 6.801) 11.870 8.934 ( -3.406 2.583 -8.248) 9.290 9.051 ( -4.867 -3.550 -3.466) 6.950 9.385 ( -3.258 -5.869 -10.011) 12.053 9.780 ( 7.292 0.973 7.057) 10.194 10.076 ( 1.225 -1.451 -4.010) 4.437 10.447 ( 4.795 -5.037 9.288) 11.603 10.792 ( 0.027 -1.871 0.498) 1.936 10.936 ( 8.152 0.227 0.707) 8.186 11.188 ( 4.195 -1.227 0.623) 4.415 11.719 ( -2.720 8.407 1.093) 8.904 12.070 ( -3.906 1.218 -9.176) 10.047 12.199 ( -7.388 -2.652 -2.037) 8.110 12.673 ( -5.111 -1.047 -3.400) 6.227 13.140 ( -1.120 3.455 4.850) 6.059 13.275 ( 3.562 -2.288 7.622) 8.719 13.449 ( -6.256 -6.502 -4.954) 10.294 13.749 ( -3.946 6.194 -0.806) 7.388 14.422 ( 0.223 -5.848 -0.834) 5.912 14.580 ( -10.058 1.974 -3.485) 10.826 15.352 ( 13.538 -4.592 1.080) 14.337 18.715 ( -1.992 11.682 9.384) 15.116 19.064 ( -0.404 -3.453 0.804) 3.568 19.867 ( -7.757 -3.893 0.450) 8.691 20.976 ( 14.091 13.957 -1.759) 19.911 22.026 ( -8.348 -13.592 -8.792) 18.214 23.754 ( 1.273 0.448 -2.584) 2.915 ======================= Grid point 236 (105/433) ======================= q-point: (-0.17 0.50 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 794 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.051 ( -5.828 10.956 5.537) 13.588 3.301 ( 0.653 10.371 5.495) 11.755 4.227 ( 6.879 -3.913 3.534) 8.667 4.916 ( -3.234 4.471 3.645) 6.613 6.458 ( -3.252 -9.605 4.099) 10.938 7.267 ( 6.286 1.466 1.573) 6.644 7.883 ( 3.445 -1.616 -2.702) 4.667 7.943 ( 2.579 -9.627 3.278) 10.491 8.494 ( 9.702 20.456 -3.312) 22.881 8.834 ( -2.683 -2.196 -6.235) 7.134 8.929 ( -7.926 -8.467 -1.527) 11.698 9.187 ( 13.337 -2.056 6.374) 14.924 9.330 ( -2.972 -6.434 -8.646) 11.180 9.905 ( 4.054 -1.365 1.525) 4.541 10.091 ( 2.670 0.663 -2.961) 4.041 10.515 ( -2.964 0.461 1.102) 3.196 10.911 ( 3.818 -7.552 6.395) 10.607 11.025 ( 2.926 0.247 3.679) 4.707 11.254 ( 1.654 0.446 1.780) 2.470 11.556 ( -6.468 7.826 0.058) 10.153 11.914 ( -3.424 3.287 -11.507) 12.448 12.130 ( -5.154 -3.106 -0.955) 6.093 12.526 ( -6.397 2.010 -2.016) 7.002 13.134 ( -2.851 -1.944 2.720) 4.394 13.364 ( 4.216 3.928 -1.144) 5.875 13.480 ( 1.292 -9.423 5.336) 10.906 13.643 ( -1.982 4.081 -0.871) 4.620 14.295 ( -8.598 6.313 -5.930) 12.205 14.491 ( -3.431 -4.717 1.003) 5.918 15.654 ( 13.084 -6.218 1.806) 14.599 18.633 ( 0.362 10.233 5.135) 11.455 19.117 ( 0.929 -2.988 3.308) 4.553 19.756 ( -8.809 -0.959 0.727) 8.891 20.987 ( 4.939 11.581 -2.929) 12.927 22.056 ( -0.406 -14.280 -4.844) 15.085 23.757 ( 1.626 1.119 -2.013) 2.819 ======================= Grid point 237 (106/433) ======================= q-point: (-0.08 0.50 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.874 ( -7.611 4.910 -0.724) 9.086 3.246 ( -2.439 3.997 4.945) 6.810 4.354 ( 2.111 -3.050 -0.081) 3.710 4.865 ( -0.944 4.514 6.480) 7.954 6.513 ( -1.689 -5.195 3.048) 6.255 7.296 ( 1.474 3.437 -2.483) 4.489 7.889 ( 1.941 4.823 -6.895) 8.636 8.131 ( 4.959 -10.339 2.566) 11.750 8.485 ( 7.014 9.849 0.900) 12.125 8.831 ( 0.279 -7.875 -4.768) 9.210 8.869 ( -4.209 -5.036 -2.517) 7.029 9.200 ( -5.659 -2.558 -8.666) 10.661 9.507 ( 11.412 -2.233 4.995) 12.655 9.942 ( -1.707 -5.209 -6.984) 8.878 10.114 ( 2.971 1.433 -1.669) 3.697 10.435 ( -4.004 2.132 0.965) 4.638 10.848 ( -9.836 7.905 2.883) 12.944 11.211 ( 4.853 -5.647 2.384) 7.818 11.268 ( 1.007 -0.496 -2.548) 2.784 11.482 ( 3.515 -2.234 4.322) 6.003 11.735 ( -6.849 5.996 -4.055) 9.965 12.057 ( -6.372 -3.908 -0.051) 7.475 12.452 ( -1.001 -0.332 -2.184) 2.425 13.113 ( -1.812 -3.836 -4.194) 5.965 13.403 ( 5.650 8.672 4.630) 11.339 13.568 ( -1.494 -1.963 -0.719) 2.570 13.641 ( 2.755 -1.880 6.011) 6.875 14.100 ( -5.128 3.218 -1.424) 6.219 14.482 ( -1.519 -1.712 0.389) 2.322 15.871 ( 6.059 -3.748 -1.043) 7.201 18.597 ( 2.608 7.726 2.330) 8.481 19.153 ( -0.122 1.469 -0.646) 1.609 19.647 ( -5.891 -2.044 5.641) 8.409 20.936 ( -0.401 2.593 -0.832) 2.753 22.166 ( 2.358 -8.055 -4.309) 9.434 23.764 ( 2.049 1.724 -1.051) 2.877 ======================= Grid point 245 (107/433) ======================= q-point: ( 0.58 -0.42 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 432 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.273 ( 7.220 -0.000 13.723) 15.507 3.405 ( 8.796 -0.000 8.259) 12.065 4.052 ( -7.392 0.000 -2.708) 7.873 5.116 ( -3.162 0.000 2.334) 3.930 6.228 ( 0.086 -0.000 6.859) 6.859 6.815 ( 7.183 -0.000 4.950) 8.723 7.750 ( -3.833 0.000 19.701) 20.070 7.842 ( -4.025 0.000 -5.076) 6.478 8.295 ( 19.719 -0.000 1.515) 19.778 8.763 ( 5.607 -0.000 -1.473) 5.797 9.132 ( -1.502 0.000 -7.779) 7.923 9.138 ( -6.123 0.000 2.471) 6.602 9.467 ( -0.491 0.000 -11.141) 11.151 9.611 ( 6.695 -0.000 5.568) 8.708 9.981 ( -1.517 0.000 -3.337) 3.666 10.267 ( 3.188 -0.000 5.919) 6.723 10.698 ( 13.782 -0.000 0.397) 13.787 10.798 ( 2.706 -0.000 0.209) 2.714 11.134 ( 1.207 -0.000 -1.419) 1.863 11.915 ( -0.202 0.000 -12.253) 12.255 12.180 ( 2.651 -0.000 -2.959) 3.973 12.256 ( -9.672 0.000 12.923) 16.141 12.542 ( 5.196 -0.000 -4.157) 6.654 13.174 ( 5.378 -0.000 -1.403) 5.558 13.293 ( -8.563 0.000 6.923) 11.012 13.498 ( -10.681 0.000 -1.192) 10.747 14.009 ( -5.844 0.000 2.296) 6.279 14.151 ( 3.612 -0.000 1.864) 4.065 14.723 ( 2.149 -0.000 -3.959) 4.505 15.207 ( -0.910 0.000 -4.416) 4.509 18.892 ( 1.407 -0.000 9.155) 9.262 19.005 ( -3.948 0.000 6.692) 7.769 19.921 ( -8.301 0.000 -4.876) 9.627 20.910 ( 18.719 -0.000 0.368) 18.723 22.081 ( -12.186 0.000 -12.554) 17.496 23.760 ( 0.378 -0.000 -2.715) 2.742 ======================= Grid point 247 (108/433) ======================= q-point: (-0.33 0.58 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.320 ( -3.680 3.368 8.453) 9.815 3.621 ( 9.454 12.118 7.171) 16.960 3.936 ( -4.659 -8.116 -0.524) 9.373 5.073 ( -2.581 2.499 2.912) 4.625 6.251 ( -3.046 -4.058 5.625) 7.576 7.046 ( 14.254 -1.266 5.693) 15.401 7.756 ( -5.744 -2.022 10.374) 12.029 7.785 ( -1.669 -2.325 -1.060) 3.052 8.694 ( 23.688 2.664 6.703) 24.762 8.795 ( -0.772 -1.458 0.218) 1.664 9.009 ( -3.270 5.017 -5.217) 7.942 9.093 ( 0.296 1.719 -8.332) 8.513 9.329 ( -3.878 2.179 -14.889) 15.540 9.706 ( 2.278 -6.226 -2.897) 7.235 10.066 ( 6.566 -0.482 7.454) 9.945 10.360 ( 1.699 -2.529 7.266) 7.879 10.786 ( -2.530 0.573 -2.292) 3.462 10.936 ( 12.648 -0.171 0.356) 12.654 11.164 ( 3.287 -0.996 -0.095) 3.436 11.842 ( 1.027 3.197 -8.121) 8.788 12.098 ( -12.854 1.422 5.171) 13.927 12.189 ( 0.285 1.143 -5.336) 5.464 12.616 ( 1.752 -3.326 -3.965) 5.464 13.187 ( -7.381 1.623 7.249) 10.472 13.263 ( 2.096 0.472 6.230) 6.590 13.325 ( -8.210 -4.842 -3.271) 10.077 13.894 ( -2.890 6.840 -0.779) 7.466 14.265 ( 2.285 -7.482 2.814) 8.313 14.622 ( -9.214 1.328 -5.517) 10.821 15.306 ( 13.354 -0.825 -1.375) 13.450 18.909 ( -3.202 7.630 11.611) 14.258 19.003 ( -1.674 -3.159 5.580) 6.627 19.787 ( -6.389 -3.154 -3.441) 7.912 21.206 ( 19.255 8.289 -0.438) 20.968 21.805 ( -13.755 -7.904 -13.042) 20.536 23.760 ( 1.464 0.168 -2.234) 2.677 ======================= Grid point 248 (109/433) ======================= q-point: (-0.25 0.58 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.217 ( -8.681 5.949 5.539) 11.893 3.511 ( -5.300 11.176 -0.047) 12.369 4.086 ( 5.441 -9.543 2.862) 11.352 5.019 ( -1.861 5.076 4.313) 6.916 6.301 ( -0.473 -6.234 5.176) 8.116 7.299 ( 10.116 1.683 4.197) 11.081 7.774 ( -3.136 -6.881 6.568) 10.016 7.830 ( 6.534 -3.410 -2.229) 7.700 8.774 ( -1.439 -2.389 -1.370) 3.107 8.855 ( -4.404 4.368 -7.125) 9.447 8.913 ( 2.334 15.802 -7.630) 17.702 9.149 ( 13.330 -2.000 3.269) 13.870 9.205 ( 0.199 -5.662 -10.635) 12.050 9.781 ( 0.619 -8.852 -6.486) 10.992 10.181 ( 4.779 6.033 4.424) 8.877 10.466 ( -0.672 -5.896 5.540) 8.118 10.745 ( -0.198 -5.499 0.049) 5.503 11.081 ( 5.628 3.329 1.336) 6.674 11.256 ( 4.327 -1.000 1.842) 4.808 11.732 ( -8.093 9.056 2.966) 12.502 11.925 ( -3.769 -1.684 -6.984) 8.113 12.112 ( -4.400 0.988 -6.748) 8.116 12.570 ( -2.920 2.384 -6.216) 7.270 13.095 ( -6.940 -1.952 -0.256) 7.214 13.275 ( -2.223 -9.314 5.083) 10.841 13.382 ( 2.229 -1.183 9.350) 9.684 13.800 ( 2.479 9.851 -1.672) 10.295 14.373 ( -0.182 -6.990 2.778) 7.524 14.389 ( -10.564 3.210 -5.935) 12.535 15.575 ( 15.694 -2.291 0.157) 15.861 18.818 ( -4.793 8.199 9.470) 13.412 19.063 ( 0.891 -2.276 6.481) 6.927 19.712 ( -5.497 -3.137 -1.051) 6.416 21.218 ( -2.642 12.148 -8.452) 15.033 21.792 ( 6.673 -12.966 -4.896) 15.382 23.775 ( 1.956 0.694 -1.100) 2.349 ======================= Grid point 249 (110/433) ======================= q-point: (-0.17 -0.42 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.985 ( -13.267 6.356 -0.706) 14.728 3.322 ( -8.716 3.723 0.607) 9.497 4.239 ( 1.042 -7.877 -0.484) 7.960 4.979 ( 0.269 6.378 6.354) 9.006 6.413 ( 3.730 -4.713 4.696) 7.627 7.370 ( 1.535 4.308 1.005) 4.682 7.852 ( -1.276 -8.605 6.245) 10.708 8.021 ( 13.143 -0.618 -6.961) 14.886 8.684 ( -7.603 3.050 -5.078) 9.638 8.737 ( -2.217 1.161 -7.284) 7.702 8.799 ( 5.190 2.103 -3.534) 6.622 9.115 ( -3.182 -5.856 -13.833) 15.355 9.479 ( 12.408 -0.405 6.152) 13.855 9.802 ( -1.547 -8.226 -10.972) 13.800 10.181 ( 0.771 4.625 0.282) 4.697 10.459 ( -3.355 0.329 2.543) 4.223 10.930 ( 2.944 -7.880 6.685) 10.745 11.063 ( -2.498 1.767 3.192) 4.422 11.305 ( 1.996 2.819 1.026) 3.603 11.538 ( -3.488 5.772 0.327) 6.752 11.845 ( -4.315 4.706 -9.806) 11.702 11.977 ( -5.240 -4.120 -3.001) 7.310 12.468 ( -1.981 1.912 -5.678) 6.310 13.031 ( -2.301 -4.315 -2.960) 5.716 13.385 ( -0.557 -6.439 8.624) 10.777 13.499 ( 1.174 -5.021 9.146) 10.499 13.766 ( 6.379 11.508 -0.516) 13.168 14.169 ( -7.511 3.526 -3.187) 8.888 14.433 ( -0.173 -3.641 1.677) 4.013 15.819 ( 10.703 -1.686 -1.431) 10.929 18.733 ( -3.151 6.130 7.637) 10.288 19.143 ( 1.617 -1.705 5.252) 5.754 19.638 ( -4.599 0.315 1.189) 4.761 20.971 ( -10.460 1.264 -7.938) 13.191 22.037 ( 12.580 -5.173 -3.760) 14.113 23.796 ( 2.086 1.502 0.292) 2.587 ======================= Grid point 250 (111/433) ======================= q-point: (-0.08 -0.42 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.675 ( -15.948 1.218 -7.176) 17.530 3.153 ( -11.652 -2.637 0.713) 11.968 4.252 ( -6.273 -6.703 -3.670) 9.887 4.993 ( 3.411 6.181 8.012) 10.679 6.551 ( 6.432 0.465 3.996) 7.586 7.323 ( -0.830 4.876 -2.907) 5.738 7.934 ( 1.401 1.645 -0.094) 2.163 8.094 ( -1.215 -6.967 -3.328) 7.816 8.501 ( -7.768 2.391 -3.777) 8.962 8.771 ( 7.151 -3.590 -5.779) 9.871 8.880 ( 6.082 -1.898 -4.277) 7.674 9.054 ( 1.780 -4.760 -12.069) 13.095 9.566 ( -5.771 -3.307 -4.628) 8.103 9.793 ( -1.166 -5.243 -6.021) 8.069 10.162 ( 1.533 2.392 1.155) 3.067 10.435 ( -0.969 1.504 3.070) 3.554 10.759 ( -9.219 8.172 -3.163) 12.719 11.225 ( 2.806 -5.317 -1.778) 6.269 11.285 ( -0.785 4.686 -2.821) 5.526 11.551 ( 2.721 -2.431 3.725) 5.215 11.638 ( -4.673 0.185 2.347) 5.233 11.983 ( 2.177 -2.063 -1.851) 3.525 12.385 ( -3.482 -1.718 -7.512) 8.456 13.068 ( 3.360 -2.499 -0.911) 4.285 13.449 ( -3.633 -2.158 7.996) 9.043 13.606 ( 1.300 -3.621 5.271) 6.526 13.787 ( 7.182 9.053 4.046) 12.244 14.061 ( -1.469 1.525 0.723) 2.238 14.476 ( 1.574 -1.560 1.811) 2.862 15.917 ( 2.706 1.248 -4.991) 5.812 18.671 ( -4.282 4.080 5.929) 8.374 19.184 ( 2.334 3.408 -1.010) 4.252 19.617 ( -0.436 -1.555 7.759) 7.926 20.786 ( -10.937 -7.899 -4.756) 14.305 22.222 ( 10.343 1.334 -5.242) 11.672 23.820 ( 2.132 1.971 1.670) 3.350 ======================= Grid point 259 (112/433) ======================= q-point: (-0.33 -0.33 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 433 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.274 ( -8.768 0.000 5.738) 10.479 3.661 ( -13.757 0.000 -3.671) 14.238 3.949 ( 10.568 -0.000 4.618) 11.533 5.074 ( -1.362 0.000 3.829) 4.064 6.238 ( 0.626 -0.000 5.690) 5.724 7.319 ( 12.743 -0.000 5.221) 13.771 7.702 ( -5.125 0.000 6.689) 8.426 7.792 ( 6.184 -0.000 -0.759) 6.231 8.735 ( -2.713 0.000 -1.773) 3.241 8.925 ( -7.349 0.000 -3.642) 8.202 9.055 ( 3.113 -0.000 -18.621) 18.880 9.154 ( 20.955 -0.000 10.137) 23.278 9.174 ( -5.008 0.000 -14.895) 15.715 9.657 ( 1.307 -0.000 -6.503) 6.633 10.274 ( 9.210 -0.000 10.013) 13.604 10.357 ( -3.341 0.000 3.284) 4.685 10.704 ( -3.812 0.000 -3.001) 4.852 11.125 ( 8.147 -0.000 0.206) 8.150 11.232 ( 4.893 -0.000 2.549) 5.517 11.847 ( 3.791 -0.000 -8.630) 9.426 11.886 ( -18.178 0.000 10.382) 20.933 12.128 ( -3.535 0.000 -12.001) 12.511 12.599 ( 1.434 -0.000 -8.450) 8.571 13.075 ( -10.175 0.000 -3.252) 10.682 13.168 ( -2.336 0.000 9.821) 10.095 13.371 ( 0.821 -0.000 9.953) 9.987 13.924 ( 3.101 -0.000 -1.631) 3.503 14.278 ( 0.885 -0.000 4.336) 4.425 14.420 ( -10.265 0.000 -6.152) 11.968 15.555 ( 16.260 -0.000 -0.429) 16.266 18.907 ( -8.123 0.000 10.977) 13.656 19.039 ( 0.941 -0.000 8.905) 8.955 19.673 ( -2.826 0.000 -3.091) 4.189 21.390 ( -18.363 0.000 -14.634) 23.480 21.614 ( 22.126 -0.000 -0.610) 22.134 23.782 ( 2.098 -0.000 -0.760) 2.231 ======================= Grid point 260 (113/433) ======================= q-point: (-0.25 -0.33 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.092 ( -14.549 3.693 2.427) 15.205 3.375 ( -15.555 1.477 -3.361) 15.983 4.104 ( 2.862 -4.626 -0.663) 5.480 5.076 ( 0.539 2.952 4.626) 5.514 6.347 ( 6.871 -1.926 5.835) 9.218 7.453 ( 2.080 3.607 4.773) 6.334 7.697 ( -2.150 -5.808 3.722) 7.226 8.005 ( 17.730 -0.950 -2.160) 17.887 8.703 ( -8.772 0.897 -6.713) 11.082 8.706 ( -4.155 -0.685 -4.254) 5.986 8.965 ( -1.576 6.366 -13.360) 14.883 9.005 ( 0.200 -4.174 -18.545) 19.010 9.503 ( 12.320 2.981 8.102) 15.044 9.650 ( 0.134 -6.777 -10.434) 12.442 10.272 ( -2.900 4.149 1.421) 5.258 10.445 ( 0.541 -1.757 3.959) 4.365 10.740 ( 6.494 -6.539 5.592) 10.779 11.153 ( -4.047 3.549 0.754) 5.435 11.338 ( 4.725 0.460 3.070) 5.654 11.645 ( -11.305 3.966 6.145) 13.464 11.883 ( 4.583 -1.233 -7.131) 8.566 11.936 ( -9.164 0.688 -13.793) 16.574 12.508 ( -4.285 1.577 -10.313) 11.279 12.971 ( -1.220 -1.435 -1.060) 2.161 13.254 ( 1.219 -5.194 10.696) 11.953 13.436 ( -0.914 -1.481 10.675) 10.816 13.952 ( 4.171 6.187 -0.735) 7.498 14.235 ( -5.226 3.609 -3.006) 7.026 14.342 ( 0.008 -5.309 3.216) 6.207 15.801 ( 12.992 -0.371 -1.740) 13.113 18.819 ( -8.546 2.480 11.907) 14.865 19.114 ( 1.607 -0.948 7.664) 7.888 19.641 ( -0.235 -0.040 -1.289) 1.311 20.988 ( -18.126 0.504 -12.839) 22.218 21.970 ( 19.698 -1.759 -2.996) 20.002 23.817 ( 2.213 0.595 1.068) 2.528 ======================= Grid point 261 (114/433) ======================= q-point: (-0.17 -0.33 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 794 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.749 ( -19.974 5.809 -3.448) 21.086 3.097 ( -17.591 -3.438 -1.581) 17.993 4.113 ( -6.314 -6.564 -4.479) 10.149 5.102 ( 3.516 4.648 5.708) 8.157 6.550 ( 11.293 -0.332 5.475) 12.554 7.430 ( -0.482 6.157 1.462) 6.346 7.783 ( -0.345 -10.369 5.212) 11.610 8.158 ( -0.597 7.180 -8.877) 11.433 8.476 ( -7.345 -5.980 -5.321) 10.864 8.741 ( 8.499 1.198 -6.873) 10.996 8.865 ( 4.033 0.414 -8.492) 9.410 8.961 ( 2.678 -4.406 -16.497) 17.284 9.511 ( -3.972 -2.177 -12.645) 13.432 9.701 ( -2.870 -3.820 2.267) 5.288 10.232 ( 1.903 4.156 3.361) 5.674 10.452 ( -1.237 0.469 2.896) 3.183 10.903 ( -8.616 5.183 -1.044) 10.109 11.055 ( 5.093 -8.664 4.242) 10.908 11.384 ( 1.674 4.822 -0.720) 5.155 11.552 ( -0.710 1.583 3.181) 3.624 11.676 ( -8.892 2.040 -8.369) 12.380 11.949 ( 5.483 -1.354 -4.476) 7.206 12.352 ( -6.092 -1.746 -10.489) 12.255 13.028 ( 5.900 -0.985 1.224) 6.106 13.391 ( 0.579 -4.260 10.242) 11.108 13.493 ( -2.454 -4.744 8.372) 9.931 13.948 ( 2.675 4.938 1.941) 5.942 14.142 ( 0.596 7.407 0.742) 7.468 14.421 ( 1.899 -4.423 2.246) 5.311 15.942 ( 6.308 1.186 -5.121) 8.211 18.729 ( -8.308 1.993 11.074) 13.986 19.201 ( 2.640 -0.788 6.190) 6.776 19.638 ( 1.807 2.521 0.563) 3.152 20.652 ( -16.665 -5.458 -9.384) 19.889 22.247 ( 16.013 1.071 -5.495) 16.963 23.853 ( 1.865 1.357 2.690) 3.544 ======================= Grid point 262 (115/433) ======================= q-point: (-0.08 -0.33 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.317 ( -22.319 1.538 -8.324) 23.870 2.828 ( -20.324 -7.978 -1.808) 21.909 3.976 ( -14.907 -9.163 -5.920) 18.472 5.168 ( 5.481 5.658 6.746) 10.371 6.755 ( 10.580 4.316 4.388) 12.240 7.332 ( -2.762 7.372 -5.035) 9.345 7.880 ( -11.799 -6.451 -3.355) 13.860 7.966 ( 2.194 -3.740 5.785) 7.230 8.380 ( -4.146 2.553 -6.417) 8.056 8.771 ( 0.147 -3.788 -12.994) 13.536 8.967 ( 7.599 -5.654 -9.983) 13.762 9.094 ( 16.666 -0.777 -5.521) 17.574 9.361 ( -5.055 -0.122 -8.414) 9.817 9.632 ( -8.987 -6.166 -2.684) 11.224 10.212 ( -5.845 6.810 3.906) 9.788 10.438 ( 0.688 0.159 -1.083) 1.293 10.681 ( -4.634 4.550 -4.970) 8.178 11.121 ( -7.350 -1.428 -12.386) 14.473 11.295 ( -0.654 5.107 -1.419) 5.341 11.584 ( 2.797 1.133 4.410) 5.343 11.696 ( 8.179 -7.115 7.298) 13.069 12.037 ( 6.474 -0.884 -2.075) 6.856 12.233 ( -3.473 -3.409 -9.671) 10.827 13.167 ( 7.743 0.753 3.117) 8.381 13.414 ( -4.664 -0.378 6.828) 8.278 13.597 ( 0.551 -7.791 7.505) 10.832 13.994 ( 5.058 4.690 5.629) 8.903 14.097 ( 0.310 4.912 3.187) 5.864 14.519 ( 4.413 -2.214 1.795) 5.253 15.914 ( -1.311 4.307 -9.263) 10.299 18.623 ( -9.118 2.695 8.390) 12.681 19.280 ( 3.952 2.193 3.744) 5.869 19.680 ( 3.818 0.620 4.024) 5.582 20.432 ( -14.502 -12.058 -6.539) 19.961 22.413 ( 12.128 4.869 -6.846) 14.753 23.883 ( 1.094 1.707 3.731) 4.246 ======================= Grid point 272 (116/433) ======================= q-point: (-0.25 -0.25 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 432 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.833 ( -20.445 0.000 0.549) 20.453 3.044 ( -20.822 0.000 -3.849) 21.174 4.043 ( -5.962 0.000 -5.479) 8.097 5.150 ( 3.627 -0.000 4.557) 5.825 6.545 ( 12.917 -0.000 6.045) 14.261 7.526 ( 0.247 -0.000 8.383) 8.387 7.644 ( -1.192 0.000 -1.341) 1.794 8.273 ( 12.855 -0.000 -4.307) 13.558 8.363 ( -20.744 0.000 -8.599) 22.456 8.759 ( 11.626 -0.000 -5.061) 12.680 8.878 ( -1.214 0.000 -14.040) 14.092 8.912 ( 3.798 -0.000 -17.567) 17.973 9.489 ( -1.471 0.000 -18.313) 18.372 9.662 ( -5.159 0.000 8.392) 9.851 10.282 ( 1.482 -0.000 5.167) 5.375 10.456 ( -1.093 0.000 2.526) 2.752 10.907 ( 10.868 -0.000 6.178) 12.502 11.007 ( -13.197 0.000 -2.151) 13.371 11.436 ( 3.658 -0.000 0.601) 3.707 11.570 ( -4.106 0.000 5.389) 6.774 11.699 ( -8.190 0.000 -13.358) 15.669 11.936 ( 6.786 -0.000 -5.494) 8.731 12.330 ( -7.547 0.000 -11.677) 13.903 13.027 ( 6.875 -0.000 0.980) 6.944 13.326 ( 1.954 -0.000 11.748) 11.910 13.455 ( -3.409 0.000 8.894) 9.525 13.987 ( -0.725 0.000 1.313) 1.499 14.296 ( 7.910 -0.000 -2.599) 8.326 14.308 ( -2.959 0.000 6.534) 7.173 15.955 ( 7.641 -0.000 -5.196) 9.240 18.748 ( -9.898 0.000 13.303) 16.581 19.188 ( 2.108 -0.000 8.332) 8.594 19.668 ( 3.841 -0.000 -1.671) 4.189 20.597 ( -19.069 0.000 -11.214) 22.122 22.258 ( 17.899 -0.000 -5.661) 18.773 23.867 ( 1.804 -0.000 3.057) 3.549 ======================= Grid point 273 (117/433) ======================= q-point: (-0.17 -0.25 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.408 ( -25.631 5.932 -2.911) 26.469 2.684 ( -24.103 -6.402 -1.891) 25.010 3.831 ( -16.972 -4.588 -8.575) 19.561 5.254 ( 6.760 2.693 5.388) 9.055 6.804 ( 13.059 1.065 5.870) 14.357 7.489 ( -4.185 8.615 -4.047) 10.397 7.687 ( -1.045 -9.727 4.481) 10.761 7.991 ( -12.715 2.020 -1.350) 12.945 8.367 ( 1.580 -2.811 -6.240) 7.024 8.752 ( -1.128 2.471 -15.279) 15.518 8.839 ( 1.213 -6.033 -16.665) 17.764 9.090 ( 20.656 -0.287 -3.961) 21.035 9.393 ( 3.988 2.426 -13.822) 14.589 9.527 ( -13.716 -4.062 3.653) 14.764 10.334 ( -1.261 4.418 7.181) 8.525 10.435 ( -2.349 -0.539 0.793) 2.537 10.760 ( -8.731 2.988 -6.913) 11.530 11.047 ( -1.536 -3.983 -7.503) 8.633 11.412 ( 1.240 5.669 -4.854) 7.565 11.568 ( 0.083 -2.834 2.408) 3.720 11.628 ( 3.480 -0.593 4.846) 5.996 12.033 ( 7.863 0.238 -3.668) 8.680 12.181 ( -2.763 -1.690 -9.542) 10.077 13.174 ( 9.496 0.277 1.895) 9.687 13.415 ( -4.502 0.242 6.532) 7.937 13.452 ( -0.265 -5.313 10.565) 11.829 14.021 ( 2.249 0.270 6.309) 6.704 14.247 ( -2.500 6.832 5.447) 9.088 14.457 ( 7.550 -3.629 -0.633) 8.401 15.977 ( 1.204 1.817 -9.912) 10.149 18.662 ( -9.261 1.141 12.438) 15.549 19.279 ( 1.632 -0.946 9.340) 9.528 19.731 ( 6.524 2.811 -2.566) 7.554 20.254 ( -17.605 -5.498 -8.212) 20.190 22.478 ( 14.381 1.776 -7.786) 16.450 23.908 ( 0.713 0.730 4.324) 4.442 ======================= Grid point 274 (118/433) ======================= q-point: (-0.08 -0.25 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.887 ( -27.286 3.425 -4.343) 27.841 2.331 ( -26.847 -10.022 -1.907) 28.720 3.487 ( -27.134 -12.290 -8.059) 30.858 5.370 ( 7.373 6.417 6.157) 11.552 6.941 ( -0.670 7.439 -0.678) 7.500 7.244 ( -6.518 -2.197 -5.998) 9.126 7.744 ( 1.011 3.352 6.201) 7.121 8.023 ( 6.222 -7.143 8.854) 12.966 8.340 ( 0.000 4.182 -6.419) 7.661 8.607 ( -4.099 -3.391 -15.818) 16.689 8.858 ( 0.865 -13.758 -12.269) 18.454 9.171 ( -5.832 3.611 -0.699) 6.894 9.381 ( -2.894 -6.846 -4.192) 8.533 9.609 ( 23.747 5.218 -5.037) 24.830 10.134 ( -12.084 11.398 -2.651) 16.822 10.437 ( -1.735 -2.862 1.750) 3.777 10.625 ( -0.812 1.954 -7.846) 8.126 10.877 ( -9.852 -0.877 -12.277) 15.766 11.339 ( -0.690 7.487 -2.119) 7.812 11.638 ( 2.184 -4.772 -1.324) 5.413 11.846 ( 12.483 -5.316 7.266) 15.391 12.130 ( 5.210 0.007 -0.243) 5.216 12.172 ( 6.281 -0.972 -6.951) 9.419 13.336 ( 4.641 -1.805 4.972) 7.037 13.365 ( -1.822 1.955 5.410) 6.034 13.580 ( 0.663 -6.894 7.684) 10.345 14.123 ( 4.000 -1.136 8.660) 9.606 14.156 ( -4.192 6.338 4.920) 9.052 14.602 ( 6.973 -1.472 0.067) 7.127 15.838 ( -4.940 5.116 -14.418) 16.076 18.561 ( -8.128 3.936 9.943) 13.432 19.363 ( 0.414 -1.185 8.263) 8.358 19.786 ( 4.074 2.683 -1.323) 5.055 20.043 ( -11.416 -11.476 -7.206) 17.718 22.611 ( 11.315 4.555 -7.844) 14.502 23.926 ( -0.780 1.118 4.801) 4.990 ======================= Grid point 285 (119/433) ======================= q-point: (-0.17 -0.17 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 433 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.965 ( -29.926 0.000 -1.407) 29.959 2.204 ( -28.193 0.000 0.981) 28.210 3.355 ( -30.139 0.000 -11.211) 32.156 5.441 ( 9.641 -0.000 5.818) 11.260 7.030 ( 8.174 -0.000 7.383) 11.015 7.199 ( -20.806 0.000 -14.306) 25.250 7.838 ( 13.987 -0.000 9.291) 16.792 7.903 ( -1.807 0.000 7.586) 7.799 8.361 ( 3.099 -0.000 -4.191) 5.213 8.603 ( -5.816 0.000 -21.697) 22.463 8.698 ( -2.442 0.000 -9.333) 9.647 9.254 ( -17.003 0.000 7.214) 18.470 9.264 ( 9.018 -0.000 -13.959) 16.619 9.662 ( 25.144 -0.000 -4.352) 25.517 10.330 ( -8.763 0.000 5.471) 10.330 10.336 ( -5.054 0.000 -6.157) 7.966 10.642 ( -0.546 0.000 -7.971) 7.989 10.863 ( -8.594 0.000 -11.108) 14.044 11.493 ( -4.862 0.000 -0.729) 4.916 11.510 ( 5.911 -0.000 -5.003) 7.744 11.793 ( 11.228 -0.000 8.578) 14.130 12.149 ( 4.642 -0.000 -4.944) 6.782 12.156 ( 8.635 -0.000 -3.369) 9.269 13.292 ( -2.291 0.000 4.581) 5.122 13.408 ( 6.737 -0.000 1.660) 6.939 13.495 ( -1.044 0.000 11.848) 11.894 14.112 ( 2.604 -0.000 9.198) 9.559 14.230 ( -6.960 0.000 7.212) 10.023 14.582 ( 9.129 -0.000 -1.864) 9.317 15.891 ( -3.546 0.000 -15.545) 15.944 18.605 ( -7.202 0.000 12.110) 14.090 19.340 ( -0.768 0.000 10.488) 10.516 19.861 ( 9.707 -0.000 -5.874) 11.346 19.886 ( -17.594 0.000 -5.961) 18.577 22.656 ( 12.044 -0.000 -8.612) 14.806 23.938 ( -1.026 0.000 5.078) 5.181 ======================= Grid point 286 (120/433) ======================= q-point: (-0.08 -0.17 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.438 ( -30.421 3.273 4.811) 30.972 1.762 ( -31.093 -6.263 2.678) 31.831 2.745 ( -40.915 -12.846 -8.787) 43.775 5.601 ( 8.208 7.065 3.386) 11.347 6.762 ( -16.784 4.242 -12.403) 21.297 7.210 ( 4.362 -5.587 8.308) 10.921 7.943 ( 4.187 8.562 16.722) 19.248 8.163 ( 11.639 -3.931 3.654) 12.817 8.326 ( -4.550 3.797 -14.381) 15.554 8.479 ( 5.468 -2.653 -2.110) 6.433 8.629 ( -6.103 -12.066 -2.688) 13.786 9.070 ( -6.715 0.575 2.139) 7.071 9.326 ( 6.702 -2.642 -13.733) 15.508 9.887 ( -1.890 3.271 -1.521) 4.073 10.128 ( -0.572 8.855 -1.599) 9.016 10.364 ( 7.475 -5.173 -6.964) 11.451 10.603 ( 0.362 2.163 -8.066) 8.359 10.675 ( -6.141 0.804 -5.959) 8.595 11.365 ( -2.817 6.062 -2.750) 7.228 11.597 ( 2.976 -5.383 -3.505) 7.079 12.075 ( 15.189 -3.265 4.469) 16.166 12.234 ( 7.105 0.928 -0.661) 7.195 12.267 ( 8.007 -0.058 -4.983) 9.431 13.259 ( -6.154 -4.349 7.796) 10.843 13.511 ( -0.199 2.564 9.240) 9.591 13.601 ( 7.377 -3.439 1.249) 8.234 14.126 ( -8.263 2.707 6.013) 10.571 14.218 ( 2.488 -1.914 9.891) 10.377 14.714 ( 7.155 -0.128 0.289) 7.162 15.671 ( -7.666 3.518 -20.265) 21.950 18.557 ( -4.610 4.365 10.476) 12.250 19.373 ( -3.424 -0.341 7.309) 8.079 19.611 ( -14.670 -8.058 -2.659) 16.947 19.972 ( 8.574 0.604 -10.562) 13.618 22.781 ( 10.484 2.748 -6.831) 12.811 23.935 ( -2.701 0.514 5.211) 5.892 ======================= Grid point 298 (121/433) ======================= q-point: (-0.08 -0.08 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 432 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.038 ( -27.481 0.000 23.420) 36.106 1.251 ( -32.795 0.000 12.440) 35.076 1.837 ( -51.753 0.000 -5.086) 52.003 5.743 ( 3.256 -0.000 -10.049) 10.563 6.477 ( -10.223 0.000 -9.947) 14.264 7.293 ( 2.630 -0.000 5.633) 6.217 8.131 ( -3.564 0.000 -13.814) 14.266 8.313 ( 13.720 -0.000 44.485) 46.553 8.351 ( 8.486 -0.000 -2.145) 8.752 8.373 ( -12.199 0.000 5.579) 13.414 8.704 ( 14.742 -0.000 5.952) 15.898 9.034 ( 2.475 -0.000 -4.260) 4.927 9.325 ( 3.242 -0.000 -10.410) 10.903 9.798 ( -3.146 0.000 -6.682) 7.385 10.022 ( -8.998 0.000 1.855) 9.187 10.377 ( -7.648 0.000 -1.881) 7.876 10.529 ( -6.123 0.000 -10.906) 12.507 10.793 ( 20.700 -0.000 -5.005) 21.297 11.349 ( 0.353 -0.000 -1.803) 1.837 11.610 ( 2.821 -0.000 -0.910) 2.964 12.312 ( 7.759 -0.000 6.182) 9.920 12.356 ( 7.743 -0.000 -1.694) 7.926 12.366 ( 13.236 -0.000 -12.370) 18.117 13.190 ( -5.272 0.000 10.934) 12.139 13.500 ( -7.306 0.000 10.481) 12.776 13.754 ( 10.509 -0.000 -3.458) 11.063 14.021 ( -9.662 0.000 5.716) 11.226 14.284 ( 0.090 -0.000 6.768) 6.769 14.841 ( 6.097 -0.000 5.526) 8.228 15.422 ( -7.853 0.000 -18.734) 20.313 18.602 ( -1.007 0.000 10.123) 10.173 19.275 ( -14.913 0.000 -4.971) 15.720 19.370 ( -3.373 0.000 6.329) 7.171 19.981 ( 1.363 -0.000 -23.041) 23.082 22.941 ( 11.130 -0.000 -3.307) 11.611 23.912 ( -4.006 0.000 4.990) 6.399 ======================= Grid point 299 (122/433) ======================= q-point: ( 0.00 0.00 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 433 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.250 ( -7.079 0.000 29.679) 30.512 1.339 ( 16.411 -0.000 31.287) 35.330 2.393 ( 2.417 -0.000 51.642) 51.698 4.991 ( -5.993 0.000 -2.205) 6.386 6.483 ( 12.508 -0.000 10.784) 16.514 6.866 ( -5.284 0.000 -16.281) 17.117 8.067 ( -10.648 0.000 -0.589) 10.664 8.316 ( 2.729 -0.000 -5.869) 6.473 8.439 ( -11.070 0.000 -4.098) 11.804 8.482 ( 9.927 -0.000 8.816) 13.277 8.859 ( -9.945 0.000 -0.695) 9.969 9.340 ( 5.539 -0.000 7.489) 9.314 9.462 ( 12.400 -0.000 5.347) 13.503 10.028 ( -15.114 0.000 7.396) 16.827 10.030 ( 11.471 -0.000 -2.808) 11.809 10.248 ( 3.723 -0.000 8.174) 8.982 11.018 ( 14.597 -0.000 0.380) 14.602 11.214 ( 3.920 -0.000 0.632) 3.971 11.666 ( 1.107 -0.000 -0.443) 1.193 11.795 ( 14.258 -0.000 -0.209) 14.260 12.128 ( -0.928 0.000 -10.402) 10.443 12.337 ( -0.194 0.000 -6.996) 6.999 12.596 ( 6.566 -0.000 -6.322) 9.115 12.884 ( -20.427 0.000 2.844) 20.624 13.348 ( -14.128 0.000 2.673) 14.379 13.517 ( -0.090 0.000 -2.008) 2.010 13.902 ( -4.831 0.000 4.488) 6.594 14.096 ( -4.362 0.000 -4.060) 5.959 14.540 ( 6.550 -0.000 -16.490) 17.743 17.735 ( 9.583 -0.000 8.444) 12.772 18.563 ( -17.827 0.000 0.191) 17.828 18.623 ( 19.987 -0.000 0.800) 20.003 19.042 ( 12.432 -0.000 0.879) 12.463 19.282 ( -5.859 0.000 -0.299) 5.866 23.118 ( 0.672 -0.000 0.349) 0.757 23.812 ( -4.083 0.000 1.126) 4.236 ======================= Grid point 300 (123/433) ======================= q-point: ( 0.08 0.00 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.533 ( 6.914 -17.853 25.197) 31.646 1.972 ( 30.182 -7.002 23.757) 39.043 2.783 ( 8.611 -2.315 43.927) 44.823 4.969 ( 2.763 -0.326 -1.914) 3.377 6.721 ( -2.207 -2.579 -13.210) 13.639 6.813 ( 16.483 -0.159 14.177) 21.742 7.867 ( -7.622 6.414 -1.012) 10.013 8.215 ( -2.990 6.890 -2.170) 7.818 8.415 ( -3.985 -6.693 -1.919) 8.022 8.535 ( -5.854 -3.808 -2.614) 7.457 8.891 ( 10.038 -3.575 12.265) 16.248 9.460 ( 5.120 2.161 9.303) 10.837 9.662 ( 4.699 0.590 4.221) 6.344 9.814 ( -6.433 8.348 3.244) 11.027 10.078 ( 0.552 -1.777 0.723) 1.996 10.543 ( 16.483 -2.489 4.676) 17.313 11.092 ( -5.274 9.077 1.691) 10.634 11.206 ( 0.268 -2.910 0.532) 2.970 11.626 ( -1.225 9.121 2.304) 9.487 11.849 ( -0.439 3.470 -2.776) 4.465 12.014 ( -6.792 0.599 -5.143) 8.540 12.348 ( 1.513 -3.147 -9.682) 10.292 12.697 ( 2.398 -7.971 -9.012) 12.268 12.746 ( 3.330 -2.552 4.917) 6.463 13.111 ( -14.860 0.273 1.810) 14.972 13.511 ( 0.047 -1.418 -3.477) 3.755 13.883 ( -0.837 1.232 3.734) 4.020 13.985 ( -7.414 -5.155 -5.136) 10.389 14.566 ( 7.364 0.228 -14.744) 16.483 17.244 ( -28.053 26.971 19.488) 43.522 18.303 ( -13.273 -1.661 -1.547) 13.466 19.129 ( -2.601 -5.967 -4.626) 7.986 19.311 ( 16.060 -6.702 -0.888) 17.425 19.469 ( 33.455 -10.479 -8.451) 36.062 23.093 ( -2.201 3.801 3.482) 5.605 23.760 ( -2.835 0.299 -0.297) 2.867 ======================= Grid point 301 (124/433) ======================= q-point: ( 0.17 0.00 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 794 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.013 ( 12.812 -17.199 18.917) 28.598 2.612 ( 18.082 -10.000 21.150) 29.568 3.267 ( 18.800 -5.896 28.276) 34.464 5.013 ( 3.170 1.275 -1.194) 3.619 6.672 ( 0.637 -5.528 -11.063) 12.383 7.206 ( 19.531 0.106 16.637) 25.657 7.676 ( -6.988 8.566 -2.588) 11.353 8.004 ( -14.311 0.072 -7.723) 16.262 8.328 ( -0.301 5.238 3.262) 6.178 8.654 ( 7.266 -10.103 -1.006) 12.485 9.160 ( 7.682 -1.568 9.046) 11.970 9.508 ( -5.032 -0.241 2.532) 5.639 9.669 ( 2.934 7.440 5.459) 9.683 9.770 ( 1.581 -0.562 4.986) 5.260 10.148 ( 5.436 -1.017 -0.863) 5.597 10.645 ( -9.173 9.700 -3.500) 13.802 10.949 ( 3.803 3.818 5.436) 7.655 11.266 ( 1.335 -4.513 0.733) 4.763 11.489 ( -3.540 13.447 4.285) 14.551 11.763 ( -6.775 -0.446 -2.541) 7.250 11.905 ( -3.668 0.734 1.106) 3.901 12.287 ( -0.885 2.004 -4.847) 5.319 12.728 ( 2.517 -3.386 -10.291) 11.123 12.838 ( -8.116 -1.325 -3.833) 9.073 13.014 ( 5.600 -6.763 5.818) 10.534 13.507 ( -1.547 -3.952 -1.845) 4.628 13.788 ( -9.136 -1.542 -5.124) 10.588 13.983 ( 1.537 -3.927 1.575) 4.502 14.590 ( 5.836 1.036 -12.370) 13.717 16.734 ( -18.882 22.765 18.454) 34.862 18.152 ( -7.275 -4.628 -1.344) 8.727 19.082 ( -4.940 -6.252 -4.918) 9.364 19.606 ( 14.621 -2.492 -0.411) 14.837 19.962 ( 19.877 -9.702 -5.340) 22.754 23.008 ( -3.783 8.023 2.180) 9.134 23.703 ( -2.800 0.128 -1.893) 3.383 ======================= Grid point 302 (125/433) ======================= q-point: ( 0.25 0.00 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.468 ( 13.081 -11.185 12.030) 20.998 3.014 ( 6.039 -8.453 20.405) 22.897 3.797 ( 19.337 -8.464 12.713) 24.641 5.018 ( -0.449 2.783 1.451) 3.170 6.707 ( 2.707 -6.439 -7.112) 9.968 7.393 ( -13.545 9.024 -4.430) 16.868 7.649 ( 19.709 -0.174 9.364) 21.821 7.775 ( -6.443 -4.303 -3.406) 8.463 8.331 ( 4.339 6.636 2.838) 8.421 8.879 ( 9.809 -5.326 -1.529) 11.266 9.232 ( -1.680 0.919 3.321) 3.834 9.358 ( -9.175 3.128 -5.305) 11.050 9.745 ( 6.491 1.542 7.450) 10.001 9.848 ( -0.620 3.678 8.291) 9.091 10.236 ( 5.020 -2.045 -4.672) 7.156 10.287 ( -13.982 6.346 -5.053) 16.165 11.013 ( 1.132 2.190 2.128) 3.257 11.306 ( -3.039 -4.890 -6.382) 8.595 11.346 ( -1.670 10.359 3.692) 11.123 11.590 ( -7.757 3.117 -2.486) 8.722 11.897 ( 1.184 4.372 10.559) 11.490 12.301 ( 4.661 1.081 2.553) 5.423 12.636 ( -9.895 0.003 -0.541) 9.910 12.750 ( 0.226 -6.175 -13.169) 14.546 13.246 ( 10.589 -1.754 5.164) 11.911 13.514 ( -5.321 -7.980 2.598) 9.937 13.609 ( -7.813 -2.745 -9.811) 12.838 14.066 ( 2.933 -1.600 3.254) 4.664 14.584 ( 2.624 1.576 -9.223) 9.718 16.376 ( -12.408 17.701 11.558) 24.512 18.136 ( -1.100 -7.699 -1.167) 7.864 19.036 ( -4.686 -7.261 -5.222) 10.097 19.809 ( 9.962 3.183 0.526) 10.472 20.332 ( 15.312 -10.491 2.523) 18.732 22.824 ( -7.362 11.966 -0.927) 14.080 23.653 ( -1.386 -0.736 -2.999) 3.385 ======================= Grid point 303 (126/433) ======================= q-point: ( 0.33 0.00 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 794 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.762 ( 6.723 -3.710 3.672) 8.512 3.254 ( 1.624 -5.960 16.324) 17.454 4.175 ( 10.849 -7.131 3.433) 13.429 4.973 ( -3.488 2.325 4.760) 6.343 6.756 ( -2.349 -2.245 0.219) 3.256 7.101 ( -6.851 1.084 -8.216) 10.752 7.594 ( -5.267 -3.691 -12.687) 14.224 8.158 ( 22.244 -1.312 11.856) 25.240 8.364 ( 5.827 7.547 2.359) 9.822 8.954 ( -0.874 4.664 -6.962) 8.425 9.093 ( -9.254 0.322 -8.583) 12.626 9.276 ( -0.552 -0.061 5.651) 5.678 9.701 ( -6.117 12.582 6.198) 15.302 9.887 ( 7.234 0.470 1.929) 7.502 10.085 ( -4.861 1.409 -9.504) 10.768 10.300 ( 1.170 -6.754 -4.568) 8.237 10.947 ( -9.116 0.476 -0.479) 9.141 11.162 ( -6.138 -0.759 -8.562) 10.563 11.289 ( 1.123 4.989 1.496) 5.329 11.515 ( -0.890 -1.079 -0.641) 1.538 11.964 ( 4.120 8.901 15.829) 18.622 12.330 ( -3.091 6.236 3.285) 7.696 12.511 ( -4.210 0.101 -0.472) 4.238 12.790 ( 4.433 -11.954 -8.767) 15.473 13.337 ( -5.425 2.268 3.103) 6.648 13.523 ( 6.926 -1.711 -8.459) 11.066 13.586 ( -1.948 -10.868 6.675) 12.902 14.138 ( 1.607 0.546 5.094) 5.369 14.536 ( -0.385 2.104 -5.942) 6.315 16.110 ( -8.055 11.898 3.330) 14.749 18.239 ( 3.788 -9.747 -1.156) 10.521 19.001 ( -4.732 -7.859 -5.016) 10.455 19.901 ( 5.020 6.224 6.006) 10.001 20.695 ( 13.695 -8.376 5.419) 16.943 22.532 ( -10.369 13.403 -4.882) 17.635 23.645 ( 1.269 -1.737 -2.732) 3.477 ======================= Grid point 304 (127/433) ======================= q-point: ( 0.42 0.00 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.787 ( -4.145 2.402 -3.651) 6.023 3.370 ( -2.241 -0.721 10.787) 11.040 4.325 ( 1.003 -3.024 -2.423) 4.002 4.957 ( -1.276 -1.421 7.944) 8.171 6.644 ( -8.569 1.542 3.885) 9.535 7.087 ( 3.393 -5.895 -8.544) 10.921 7.506 ( -0.692 -7.068 -13.795) 15.516 8.391 ( 8.198 9.917 -1.792) 12.991 8.511 ( 6.829 0.142 6.777) 9.622 8.769 ( -5.011 -2.214 -10.541) 11.879 8.941 ( -3.086 8.718 -2.314) 9.534 9.151 ( -7.430 8.390 -3.292) 11.681 9.699 ( 5.424 3.727 7.788) 10.196 9.852 ( -5.521 8.093 -14.205) 17.255 10.004 ( 4.528 -3.873 -5.916) 8.396 10.374 ( 1.561 -7.047 1.113) 7.303 10.721 ( -13.135 -0.903 -6.782) 14.810 11.098 ( -1.436 -1.729 -2.631) 3.460 11.275 ( 0.054 2.151 0.418) 2.192 11.518 ( -1.280 -3.792 -1.572) 4.300 12.018 ( 1.075 9.770 12.112) 15.599 12.198 ( -3.747 8.218 7.624) 11.820 12.415 ( -3.528 2.786 -7.308) 8.580 12.982 ( 6.861 -7.799 -1.973) 10.574 13.274 ( -2.627 -7.446 1.410) 8.021 13.563 ( -0.400 -2.399 -0.364) 2.459 13.771 ( 8.090 -3.065 7.002) 11.130 14.152 ( -2.263 2.548 5.910) 6.822 14.494 ( 1.551 1.601 -2.218) 3.145 15.915 ( -5.414 5.524 -3.858) 8.643 18.417 ( 5.934 -10.388 -0.706) 11.984 18.968 ( -4.597 -7.836 -4.679) 10.219 19.947 ( 2.126 7.157 12.049) 14.175 20.968 ( 7.612 -1.382 5.718) 9.620 22.208 ( -8.235 9.651 -9.031) 15.574 23.696 ( 3.661 -2.570 -1.201) 4.631 ======================= Grid point 305 (128/433) ======================= q-point: (-0.50 0.00 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 794 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.566 ( -13.212 5.005 -6.424) 15.520 3.295 ( -9.918 5.610 4.706) 12.328 4.267 ( -6.061 1.146 -2.823) 6.784 5.050 ( 2.918 -3.818 7.213) 8.667 6.585 ( -1.541 -3.360 3.451) 5.056 7.103 ( -1.901 -4.714 -8.648) 10.031 7.567 ( 5.503 -10.881 -11.141) 16.517 8.394 ( -2.118 6.292 2.825) 7.215 8.434 ( -2.238 3.250 -9.325) 10.126 8.729 ( -2.982 6.679 -7.567) 10.524 8.818 ( 2.698 2.028 -0.453) 3.406 9.009 ( 5.216 9.467 -6.773) 12.756 9.497 ( -9.589 9.279 -13.237) 18.796 9.787 ( -1.602 0.871 -2.867) 3.398 10.147 ( 9.989 -2.782 1.629) 10.496 10.429 ( -8.560 -1.973 -1.196) 8.865 10.529 ( -1.478 -4.605 -4.880) 6.870 11.047 ( -6.443 -2.934 -3.821) 8.045 11.246 ( -1.739 0.874 -0.405) 1.988 11.531 ( -0.200 -3.571 0.061) 3.577 11.943 ( -1.955 6.287 0.984) 6.657 12.209 ( 4.687 11.376 16.603) 20.665 12.262 ( -3.631 3.439 -11.137) 12.208 13.090 ( 3.335 -1.136 2.321) 4.219 13.425 ( 4.551 -14.187 -1.030) 14.935 13.558 ( -4.346 -2.945 3.727) 6.438 13.965 ( 8.334 2.234 9.143) 12.571 14.119 ( -1.014 1.847 4.394) 4.873 14.533 ( 4.212 1.196 1.624) 4.670 15.766 ( -5.042 0.182 -8.922) 10.250 18.584 ( 1.193 -9.038 0.112) 9.117 18.974 ( 0.773 -8.192 -3.291) 8.863 19.980 ( -0.104 6.982 15.214) 16.740 20.968 ( -6.214 10.956 2.886) 12.922 22.053 ( 3.206 -0.655 -10.152) 10.666 23.791 ( 4.423 -2.883 0.506) 5.304 ======================= Grid point 306 (129/433) ======================= q-point: (-0.42 0.00 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.224 ( -18.243 3.572 -2.940) 18.820 2.993 ( -18.793 9.937 0.630) 21.268 4.081 ( -11.127 6.652 -0.434) 12.970 5.189 ( 4.848 -3.642 4.839) 7.758 6.673 ( 1.193 -8.007 -0.005) 8.096 7.055 ( -1.299 -6.381 -8.115) 10.405 7.698 ( 4.062 -8.309 -6.236) 11.155 8.235 ( -9.957 -2.240 -5.240) 11.473 8.323 ( 1.281 14.889 3.388) 15.324 8.624 ( -0.844 5.463 -12.393) 13.570 8.884 ( 11.654 -2.844 -5.377) 13.146 9.012 ( 10.191 9.489 -8.952) 16.554 9.241 ( -2.367 6.415 -7.504) 10.152 9.665 ( -8.110 1.086 -4.987) 9.582 10.148 ( -13.842 0.657 -2.384) 14.061 10.385 ( 5.443 -3.020 1.313) 6.361 10.564 ( -1.721 -3.659 -0.522) 4.077 10.888 ( -10.870 -2.032 -6.144) 12.650 11.214 ( -1.048 -0.625 -0.887) 1.509 11.598 ( 3.726 -2.905 1.059) 4.842 11.897 ( 2.541 4.212 -1.134) 5.048 12.094 ( -2.959 3.059 -9.791) 10.676 12.309 ( 8.021 11.624 14.043) 19.917 13.194 ( 4.777 -3.078 3.762) 6.815 13.532 ( -4.917 -2.419 5.349) 7.657 13.601 ( 3.551 -9.777 -3.887) 11.105 14.065 ( -2.381 -1.855 10.715) 11.132 14.205 ( 11.169 5.304 4.536) 13.170 14.609 ( 4.333 1.356 3.422) 5.685 15.623 ( -6.354 -2.968 -12.289) 14.149 18.607 ( -6.532 -6.900 1.005) 9.554 19.135 ( 8.743 -8.787 -1.124) 12.446 19.981 ( -3.076 6.542 14.301) 16.024 20.649 ( -13.997 16.409 -1.127) 21.598 22.160 ( 10.670 -5.383 -8.477) 14.652 23.890 ( 3.283 -2.561 1.523) 4.433 ======================= Grid point 307 (130/433) ======================= q-point: (-0.33 0.00 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 794 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.895 ( -20.119 -0.419 6.485) 21.143 2.520 ( -25.342 11.552 1.502) 27.891 3.739 ( -18.700 15.604 2.680) 24.502 5.333 ( 4.932 -4.310 2.554) 7.030 6.637 ( -10.583 -7.218 -9.702) 16.070 7.199 ( 11.917 -7.921 0.016) 14.309 7.778 ( 2.599 -2.512 -0.494) 3.648 8.105 ( -5.643 -3.757 -3.594) 7.673 8.251 ( -0.341 7.687 -1.585) 7.856 8.458 ( 2.949 7.564 -9.424) 12.439 8.964 ( 5.764 12.443 -7.371) 15.568 9.134 ( 7.198 1.675 -1.037) 7.462 9.322 ( 21.142 -9.047 -7.667) 24.240 9.458 ( -10.124 3.744 -3.637) 11.390 9.887 ( -13.970 -2.162 -4.418) 14.810 10.477 ( -2.213 -5.222 4.167) 7.038 10.503 ( -5.520 0.371 -1.888) 5.846 10.702 ( -8.510 -1.479 -4.793) 9.878 11.215 ( 0.210 -1.998 -0.792) 2.159 11.651 ( 1.096 2.206 -3.928) 4.637 11.928 ( 5.272 1.226 -2.112) 5.810 12.054 ( 6.362 -0.724 -4.326) 7.728 12.413 ( 8.192 11.354 11.456) 18.090 13.347 ( 6.767 -4.138 3.087) 8.511 13.504 ( -4.388 -0.919 4.989) 6.708 13.681 ( 0.606 -4.780 -3.239) 5.805 14.100 ( -4.826 -5.993 7.930) 11.050 14.361 ( 10.373 8.141 5.518) 14.294 14.695 ( 4.857 0.939 5.096) 7.102 15.458 ( -7.711 -3.593 -14.059) 16.433 18.564 ( -7.027 -6.974 2.716) 10.266 19.353 ( 7.913 -6.047 -1.107) 10.020 19.915 ( -6.578 5.199 9.202) 12.449 20.247 ( -13.388 16.103 -1.259) 20.979 22.360 ( 12.317 -5.328 -7.387) 15.319 23.959 ( 1.042 -1.910 1.776) 2.808 ======================= Grid point 308 (131/433) ======================= q-point: (-0.25 0.00 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.641 ( -22.529 -4.975 13.563) 26.763 2.012 ( -25.138 11.067 14.022) 30.838 3.186 ( -27.328 25.825 7.709) 38.382 5.444 ( 1.319 -5.567 -1.711) 5.971 6.437 ( -10.807 -4.203 -9.927) 15.265 7.438 ( 8.093 2.668 -0.849) 8.564 7.877 ( 4.440 -7.477 0.520) 8.711 8.025 ( -2.910 -3.493 -6.207) 7.694 8.201 ( 1.921 -4.872 -0.791) 5.297 8.528 ( 12.342 7.691 -0.480) 14.550 8.865 ( -0.298 8.268 -0.686) 8.302 9.199 ( 0.349 3.347 5.231) 6.220 9.265 ( 1.822 7.488 -6.652) 10.181 9.682 ( -7.578 -8.224 -5.678) 12.542 9.819 ( 22.495 -9.672 -6.701) 25.387 10.358 ( -4.857 1.251 -1.191) 5.155 10.507 ( -7.154 -5.297 2.298) 9.193 10.594 ( -3.765 -2.727 2.849) 5.452 11.241 ( 0.479 -2.647 -0.644) 2.766 11.590 ( 1.413 4.084 -6.282) 7.625 12.014 ( 8.191 -0.632 -5.968) 10.154 12.213 ( 9.829 -1.722 0.905) 10.020 12.491 ( 7.090 11.206 7.899) 15.435 13.450 ( -5.052 0.589 3.232) 6.027 13.526 ( 8.218 -2.727 1.540) 8.795 13.686 ( -2.610 -2.323 -0.292) 3.506 14.100 ( -7.956 -7.423 4.843) 11.910 14.423 ( 3.858 8.770 1.726) 9.735 14.819 ( 5.225 0.221 3.827) 6.480 15.304 ( -3.014 -2.070 -6.510) 7.467 18.557 ( -4.709 -8.188 3.951) 10.238 19.423 ( -3.196 1.104 -2.556) 4.238 19.796 ( -6.319 0.941 -0.717) 6.429 19.912 ( -8.572 15.246 1.598) 17.563 22.577 ( 12.744 -4.845 -5.679) 14.770 23.981 ( -1.368 -1.308 1.558) 2.451 ======================= Grid point 309 (132/433) ======================= q-point: (-0.17 0.00 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 794 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.322 ( -29.857 -7.154 11.794) 32.889 1.771 ( -13.145 8.275 36.945) 40.078 2.480 ( -30.438 31.723 18.907) 47.857 5.421 ( -6.943 -4.131 -8.669) 11.850 6.290 ( -3.986 -1.548 -4.637) 6.308 7.339 ( -5.110 8.027 -11.928) 15.258 8.008 ( 5.806 -3.112 2.400) 7.011 8.113 ( 4.857 -9.566 -7.397) 13.031 8.427 ( 5.341 -16.672 13.105) 21.868 8.525 ( -0.926 9.173 2.366) 9.519 8.878 ( 0.484 -4.900 0.688) 4.972 9.148 ( 5.095 5.783 -9.280) 12.063 9.321 ( 8.079 7.846 4.583) 12.159 9.621 ( 2.546 -1.131 -6.301) 6.889 10.116 ( 6.627 -2.441 0.739) 7.101 10.380 ( -4.994 -1.663 1.865) 5.584 10.454 ( 0.198 -10.027 6.382) 11.887 10.679 ( 9.648 -2.973 4.768) 11.165 11.289 ( 3.293 -3.325 0.373) 4.694 11.585 ( 4.438 0.806 -4.273) 6.213 12.125 ( 9.297 -0.823 -9.722) 13.477 12.366 ( 7.371 2.358 -0.307) 7.745 12.526 ( 5.504 10.010 4.211) 12.175 13.364 ( -6.725 0.044 2.792) 7.282 13.625 ( -2.984 -1.091 -4.270) 5.322 13.676 ( 2.827 0.510 2.696) 3.940 14.038 ( -10.583 -7.573 3.553) 13.490 14.343 ( -4.112 6.810 -1.863) 8.171 14.759 ( -4.018 3.089 -16.865) 17.610 15.551 ( 23.250 -5.789 27.983) 36.839 18.616 ( -2.065 -10.147 4.563) 11.315 19.227 ( -11.673 4.915 -4.160) 13.331 19.612 ( -13.559 2.235 -2.644) 13.994 19.681 ( -2.851 16.528 -6.533) 17.999 22.809 ( 12.709 -4.937 -3.456) 14.066 23.958 ( -3.666 -0.854 1.037) 3.904 ======================= Grid point 310 (133/433) ======================= q-point: (-0.08 0.00 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.096 ( -16.759 -9.624 26.182) 32.542 1.530 ( -21.265 27.658 25.045) 42.947 2.130 ( -7.498 7.870 50.035) 51.202 5.203 ( -13.126 -0.234 -9.050) 15.945 6.296 ( 4.339 -0.382 3.277) 5.450 7.085 ( -6.820 3.872 -16.164) 17.966 8.165 ( -3.644 -12.178 -0.582) 12.725 8.204 ( 9.353 2.425 2.184) 9.906 8.378 ( -4.379 2.851 2.723) 5.892 8.687 ( -5.461 -4.828 -5.396) 9.069 8.966 ( 3.851 -0.317 1.690) 4.217 9.104 ( 0.026 -11.363 -1.792) 11.503 9.370 ( 6.515 10.993 1.628) 12.882 9.760 ( 15.820 -0.026 -2.018) 15.948 10.158 ( -10.538 -8.297 3.814) 13.944 10.337 ( -4.910 6.015 4.494) 8.971 10.656 ( 17.641 -2.300 13.353) 22.244 11.007 ( 16.536 -5.642 -0.478) 17.478 11.464 ( 9.800 -8.525 4.744) 13.828 11.643 ( 4.991 0.515 -2.261) 5.503 12.189 ( 5.486 2.135 -11.684) 13.083 12.384 ( 2.428 4.155 -6.322) 7.946 12.553 ( 5.972 7.329 0.196) 9.456 13.227 ( -14.911 -1.484 -1.301) 15.041 13.517 ( -9.485 -2.590 0.463) 9.844 13.606 ( -6.418 5.152 -2.480) 8.596 13.972 ( -7.877 -4.127 4.714) 10.065 14.187 ( -3.980 3.975 -2.407) 6.118 14.584 ( 1.481 3.041 -18.180) 18.492 16.546 ( 56.517 -21.197 37.744) 71.191 18.709 ( -7.330 -13.455 4.674) 16.019 18.968 ( -5.012 7.663 -5.797) 10.837 19.169 ( -23.602 20.349 -12.635) 33.628 19.433 ( -7.030 9.356 1.413) 11.788 23.027 ( 9.120 -3.981 -2.637) 10.295 23.890 ( -5.610 -0.269 0.879) 5.685 ======================= Grid point 312 (134/433) ======================= q-point: ( 0.08 0.08 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 432 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.828 ( 18.405 -0.000 22.292) 28.908 2.511 ( 20.322 -0.000 21.802) 29.805 3.215 ( 17.372 -0.000 31.032) 35.563 5.028 ( 4.610 -0.000 -2.190) 5.103 6.613 ( 1.006 -0.000 -12.397) 12.437 7.212 ( 19.081 -0.000 17.803) 26.097 7.770 ( -6.146 0.000 -2.661) 6.697 8.003 ( -19.832 0.000 -7.885) 21.342 8.445 ( 0.209 -0.000 -0.341) 0.400 8.474 ( 10.067 -0.000 3.406) 10.627 9.145 ( 11.685 -0.000 11.191) 16.180 9.495 ( -4.939 0.000 8.764) 10.060 9.664 ( -5.277 0.000 -3.140) 6.141 9.873 ( 4.671 -0.000 2.423) 5.262 10.121 ( 4.759 -0.000 2.603) 5.424 10.732 ( -3.656 0.000 -3.455) 5.031 11.030 ( -0.836 0.000 4.664) 4.739 11.179 ( -1.698 0.000 1.779) 2.459 11.661 ( -1.751 0.000 0.833) 1.939 11.722 ( -9.213 0.000 1.956) 9.418 11.941 ( -4.058 0.000 0.996) 4.178 12.302 ( 0.644 -0.000 -6.980) 7.009 12.675 ( 5.165 -0.000 -12.925) 13.919 12.871 ( -14.845 0.000 2.747) 15.097 12.898 ( 11.050 -0.000 6.127) 12.635 13.467 ( -0.871 0.000 -5.782) 5.848 13.768 ( -10.087 0.000 -5.868) 11.669 13.950 ( 3.417 -0.000 4.465) 5.623 14.602 ( 6.135 -0.000 -12.468) 13.896 16.985 ( -26.812 0.000 17.260) 31.887 18.103 ( -7.322 0.000 -3.516) 8.122 18.994 ( -4.439 0.000 -5.574) 7.126 19.607 ( 19.106 -0.000 4.419) 19.611 19.846 ( 21.571 -0.000 -8.549) 23.203 23.087 ( -3.466 0.000 2.692) 4.389 23.704 ( -3.152 0.000 -1.981) 3.722 ======================= Grid point 313 (135/433) ======================= q-point: ( 0.17 0.08 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.309 ( 20.268 -4.677 17.035) 26.886 2.888 ( 8.095 -3.813 20.705) 22.556 3.690 ( 19.487 -2.623 15.901) 25.287 5.065 ( 1.152 1.572 -0.206) 1.959 6.606 ( 4.031 -3.097 -9.331) 10.626 7.548 ( -17.949 6.766 -6.053) 20.114 7.649 ( 13.876 -0.589 4.965) 14.749 7.696 ( -1.243 -3.704 5.051) 6.385 8.449 ( 3.864 4.808 0.981) 6.245 8.740 ( 13.340 -6.391 2.311) 14.971 9.268 ( -3.142 1.553 -5.705) 6.696 9.430 ( -5.768 4.684 4.497) 8.685 9.637 ( 0.949 -7.970 11.405) 13.946 9.956 ( 6.303 4.915 1.020) 8.058 10.211 ( 4.359 -1.287 -2.986) 5.438 10.417 ( -21.232 4.833 -2.792) 21.954 11.063 ( 1.025 3.288 -3.029) 4.586 11.181 ( -3.733 -6.270 -1.953) 7.554 11.546 ( -5.320 8.177 2.318) 10.027 11.626 ( -5.912 -0.092 -0.789) 5.965 11.960 ( 2.784 1.688 13.458) 13.846 12.301 ( 3.517 -0.828 -1.954) 4.108 12.647 ( -8.950 0.490 -1.118) 9.033 12.688 ( 0.412 -0.190 -8.662) 8.674 13.142 ( 9.191 -6.027 5.282) 12.194 13.435 ( 0.007 -0.976 -2.341) 2.537 13.566 ( -9.564 -1.255 -8.212) 12.668 14.048 ( 4.284 -0.474 4.766) 6.426 14.611 ( 3.238 0.869 -9.361) 9.943 16.638 ( -20.010 7.985 11.004) 24.192 18.028 ( -1.094 -3.153 -3.189) 4.616 18.913 ( -3.943 -4.101 -5.773) 8.105 19.921 ( 16.895 7.571 3.258) 18.798 20.131 ( 13.714 -9.796 0.845) 16.874 22.985 ( -7.740 4.385 -0.398) 8.904 23.644 ( -1.907 -0.248 -3.251) 3.777 ======================= Grid point 314 (136/433) ======================= q-point: ( 0.25 0.08 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.727 ( 15.220 -0.261 10.097) 18.267 3.133 ( 3.056 -6.061 17.191) 18.483 4.055 ( 11.959 -4.517 5.442) 13.894 5.032 ( -2.854 3.087 2.263) 4.774 6.674 ( 3.387 -4.477 -4.335) 7.092 7.149 ( -16.742 2.673 -7.113) 18.386 7.536 ( -5.747 -2.288 -10.838) 12.479 8.151 ( 23.514 0.225 13.988) 27.361 8.485 ( 4.847 4.337 0.780) 6.550 9.001 ( -8.267 0.271 -11.873) 14.471 9.030 ( 4.777 -4.467 -3.076) 7.227 9.350 ( -1.115 7.514 7.953) 10.998 9.840 ( 1.393 -3.655 13.868) 14.409 9.953 ( -2.639 8.000 -0.877) 8.470 10.052 ( -9.369 -1.057 -6.713) 11.574 10.237 ( 1.432 -0.869 -8.695) 8.855 10.966 ( -7.371 0.581 -7.053) 10.219 11.118 ( -5.838 -3.011 -1.499) 6.738 11.409 ( -3.281 6.558 1.184) 7.428 11.517 ( -4.634 0.922 -1.547) 4.972 12.104 ( 5.937 5.485 15.665) 17.628 12.428 ( 5.261 0.260 5.498) 7.614 12.488 ( -6.433 -0.747 3.617) 7.418 12.648 ( 1.483 -0.748 -12.394) 12.505 13.306 ( -6.825 -7.697 -0.056) 10.287 13.387 ( -4.279 -5.496 0.292) 6.971 13.523 ( 11.593 1.251 -2.997) 12.040 14.147 ( 3.394 0.274 5.706) 6.645 14.578 ( -0.028 1.855 -5.776) 6.067 16.309 ( -15.266 8.075 3.109) 17.548 18.084 ( 4.190 -6.009 -2.339) 7.690 18.864 ( -3.662 -5.589 -5.472) 8.636 20.052 ( 7.253 8.900 5.777) 12.853 20.518 ( 17.032 -9.646 6.289) 20.559 22.737 ( -13.127 7.548 -4.315) 15.745 23.621 ( 1.112 -0.817 -3.349) 3.622 ======================= Grid point 315 (137/433) ======================= q-point: ( 0.33 0.08 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.881 ( 2.859 6.965 1.588) 7.694 3.330 ( 2.991 -3.893 12.833) 13.740 4.232 ( 2.226 -5.515 -1.576) 6.153 4.969 ( -3.061 2.227 5.341) 6.547 6.645 ( -11.116 -1.304 3.002) 11.588 6.982 ( 3.053 -4.699 -10.500) 11.902 7.407 ( -3.733 -3.274 -12.633) 13.574 8.495 ( -0.806 0.274 5.046) 5.117 8.563 ( 13.475 4.602 -1.529) 14.321 8.687 ( -7.852 -4.551 -12.186) 15.194 9.118 ( 2.641 9.070 -1.253) 9.530 9.318 ( -1.873 9.013 3.179) 9.739 9.755 ( -1.025 1.235 6.318) 6.519 9.960 ( -0.383 0.604 -10.471) 10.495 9.970 ( -1.841 2.759 -3.033) 4.494 10.227 ( 1.840 -7.067 -3.736) 8.203 10.755 ( -9.101 2.759 -7.802) 12.301 11.059 ( -5.205 -2.308 1.947) 6.017 11.329 ( -0.999 3.326 -0.819) 3.569 11.456 ( -2.708 -2.392 -0.761) 3.692 12.170 ( -1.362 6.720 6.153) 9.213 12.365 ( -1.747 6.946 13.425) 15.216 12.490 ( -0.534 6.309 -7.415) 9.750 12.775 ( 10.261 -11.606 0.329) 15.495 13.180 ( -7.631 -3.621 -2.281) 8.749 13.431 ( -4.298 -10.562 1.356) 11.483 13.750 ( 14.670 0.956 3.329) 15.073 14.204 ( 0.002 2.621 6.401) 6.916 14.529 ( 0.134 1.597 -1.795) 2.406 16.020 ( -11.616 5.007 -3.935) 13.247 18.239 ( 7.289 -7.762 -1.520) 10.756 18.829 ( -3.601 -6.111 -4.671) 8.493 20.098 ( 2.443 7.965 11.075) 13.858 20.907 ( 15.586 -4.476 6.950) 17.643 22.379 ( -15.502 7.565 -8.353) 19.166 23.657 ( 3.868 -1.455 -2.105) 4.638 ======================= Grid point 316 (138/433) ======================= q-point: (-0.58 0.08 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.738 ( -6.862 11.979 -4.771) 14.606 3.397 ( -3.122 4.365 6.400) 8.352 4.232 ( -5.060 -4.552 -3.934) 7.862 4.989 ( 1.276 -1.933 7.447) 7.799 6.510 ( -7.915 -4.315 2.930) 9.478 7.028 ( 0.500 -3.281 -9.193) 9.774 7.374 ( 3.403 -8.510 -11.536) 14.734 8.302 ( -16.273 -8.069 -7.942) 19.824 8.580 ( 6.864 4.578 -6.271) 10.363 8.815 ( 6.978 1.207 -3.889) 8.080 8.968 ( -5.093 14.202 2.997) 15.382 9.198 ( 3.114 10.278 -3.951) 11.443 9.661 ( -11.099 7.364 -7.679) 15.374 9.824 ( -3.303 3.050 -4.958) 6.692 10.064 ( 14.008 -5.267 -3.009) 15.265 10.353 ( 1.165 -7.137 3.051) 7.849 10.539 ( -5.983 5.218 -7.691) 11.053 10.984 ( -8.778 -3.528 0.349) 9.467 11.283 ( -1.289 2.465 -0.489) 2.825 11.463 ( 0.164 -3.292 0.678) 3.365 12.062 ( -2.631 6.643 -0.378) 7.155 12.310 ( -5.170 2.765 -7.580) 9.583 12.443 ( 5.790 11.392 13.243) 18.403 13.026 ( 4.313 -6.315 1.201) 7.741 13.166 ( 1.310 -11.193 0.150) 11.270 13.455 ( -4.672 -7.956 2.013) 9.444 13.988 ( 9.368 0.795 7.143) 11.808 14.184 ( 0.645 4.646 4.603) 6.572 14.554 ( 3.360 0.522 2.584) 4.271 15.781 ( -9.103 1.321 -8.591) 12.586 18.423 ( 5.379 -7.358 -0.893) 9.159 18.823 ( -0.785 -7.156 -2.947) 7.778 20.118 ( -0.531 7.042 14.418) 16.054 21.137 ( 5.541 6.382 5.174) 9.910 22.054 ( -8.193 0.784 -10.662) 13.469 23.744 ( 5.062 -1.964 -0.264) 5.436 ======================= Grid point 317 (139/433) ======================= q-point: (-0.50 0.08 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.410 ( -11.533 14.876 -6.517) 19.919 3.201 ( -13.408 11.190 0.157) 17.465 4.138 ( -7.459 -0.773 -0.819) 7.543 5.114 ( 4.172 -4.093 6.549) 8.777 6.514 ( -1.846 -8.333 1.587) 8.682 6.953 ( -3.729 -3.863 -10.046) 11.391 7.507 ( 5.553 -10.977 -7.324) 14.316 8.122 ( -10.009 -8.811 -5.701) 14.502 8.628 ( 7.698 5.608 -6.897) 11.759 8.676 ( -4.735 9.557 -5.710) 12.098 8.904 ( 2.427 5.309 0.103) 5.838 9.175 ( 7.082 7.502 -6.382) 12.132 9.369 ( -6.848 6.960 -6.686) 11.834 9.689 ( -5.429 2.376 -6.216) 8.588 10.250 ( -9.335 8.051 -2.112) 12.507 10.327 ( 10.303 -3.266 -2.020) 10.996 10.483 ( -1.249 -4.384 -0.245) 4.565 10.833 ( -11.802 -3.418 -2.951) 12.636 11.236 ( -0.904 2.463 0.091) 2.625 11.532 ( 3.304 -3.692 1.878) 5.299 11.991 ( 2.302 5.609 -3.220) 6.865 12.148 ( -4.032 2.525 -9.747) 10.846 12.527 ( 6.861 10.529 13.668) 18.567 13.103 ( 0.169 -6.171 2.990) 6.860 13.354 ( 2.110 -13.196 -0.894) 13.393 13.471 ( -0.943 -5.523 0.506) 5.625 14.047 ( -4.364 0.375 9.429) 10.397 14.313 ( 14.046 4.774 5.119) 15.694 14.631 ( 3.310 0.657 4.433) 5.571 15.582 ( -7.960 -1.150 -10.930) 13.570 18.494 ( -2.978 -4.533 -0.461) 5.443 18.953 ( 7.522 -9.764 -0.224) 12.327 20.110 ( -3.432 6.595 14.372) 16.181 20.969 ( -10.925 16.451 -1.737) 19.824 22.043 ( 7.633 -6.752 -7.056) 12.395 23.846 ( 4.201 -1.984 1.166) 4.790 ======================= Grid point 318 (140/433) ======================= q-point: (-0.42 0.08 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.038 ( -11.819 14.781 -2.320) 19.067 2.777 ( -21.015 14.633 -0.731) 25.618 3.966 ( -11.062 7.525 2.585) 13.627 5.259 ( 4.166 -3.655 4.876) 7.382 6.513 ( -7.698 -5.879 -5.580) 11.179 6.992 ( 6.714 -11.744 -3.492) 13.971 7.638 ( 1.655 -11.274 -4.697) 12.325 8.058 ( -2.827 -3.124 -1.510) 4.476 8.506 ( -3.125 17.589 -1.119) 17.900 8.550 ( -0.039 2.050 -8.805) 9.041 9.006 ( 10.327 -7.133 -3.610) 13.060 9.175 ( 3.767 4.953 -5.342) 8.201 9.282 ( 5.558 2.586 -4.852) 7.818 9.539 ( -2.918 5.646 -5.599) 8.470 9.954 ( -12.424 8.484 -4.053) 15.581 10.409 ( -5.095 -1.742 1.966) 5.732 10.483 ( -0.147 -2.145 -1.133) 2.430 10.661 ( -8.969 -2.731 -4.754) 10.512 11.214 ( 0.229 1.404 0.257) 1.445 11.644 ( 3.502 -2.492 0.395) 4.316 11.982 ( 5.121 4.195 -4.509) 8.009 12.051 ( 2.178 0.396 -7.002) 7.344 12.627 ( 7.970 10.194 10.772) 16.837 13.216 ( 1.997 -9.125 4.011) 10.166 13.422 ( -5.124 -8.291 3.199) 10.258 13.556 ( 4.479 -6.200 -6.921) 10.315 14.028 ( -5.228 -1.571 9.117) 10.627 14.528 ( 13.193 7.457 6.466) 16.477 14.697 ( 1.666 -0.635 5.299) 5.591 15.404 ( -6.770 -1.543 -11.459) 13.399 18.457 ( -5.423 -3.828 1.448) 6.794 19.201 ( 9.526 -9.500 0.449) 13.461 20.035 ( -7.158 6.973 10.634) 14.593 20.568 ( -13.304 16.854 -4.439) 21.926 22.245 ( 11.778 -6.466 -5.306) 14.446 23.924 ( 1.889 -1.596 1.765) 3.038 ======================= Grid point 319 (141/433) ======================= q-point: (-0.33 0.08 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.723 ( -10.908 13.355 3.433) 17.582 2.278 ( -21.597 16.028 9.067) 28.382 3.630 ( -17.406 19.274 6.029) 26.661 5.362 ( 1.105 -3.026 2.376) 4.003 6.365 ( -8.551 -3.164 -6.540) 11.221 7.276 ( 9.770 -15.760 -3.531) 18.876 7.747 ( 1.147 -12.335 -0.400) 12.394 8.040 ( -0.059 6.487 3.997) 7.620 8.223 ( -5.682 8.601 -9.463) 13.994 8.622 ( 10.129 1.107 1.702) 10.330 9.009 ( -10.524 5.198 1.335) 11.814 9.270 ( 8.618 0.200 0.902) 8.667 9.345 ( 2.364 -0.412 -16.652) 16.824 9.521 ( 11.131 -0.344 -1.452) 11.231 9.734 ( -0.207 -0.168 -3.875) 3.884 10.313 ( -8.167 -3.160 2.327) 9.061 10.464 ( -5.347 -0.773 -1.864) 5.715 10.549 ( -2.867 -1.757 -0.044) 3.363 11.216 ( 0.439 -0.122 0.335) 0.565 11.646 ( -0.841 1.788 -4.278) 4.712 12.033 ( 8.623 2.248 -5.969) 10.726 12.159 ( 9.900 -3.477 -0.905) 10.532 12.712 ( 7.563 10.790 7.039) 14.939 13.356 ( -3.280 -10.858 1.864) 11.495 13.443 ( 0.364 -5.527 5.711) 7.956 13.613 ( 1.829 -4.088 -8.537) 9.640 14.002 ( -6.426 -2.586 6.614) 9.577 14.602 ( 1.256 8.128 2.054) 8.477 14.811 ( 4.882 -1.415 6.370) 8.150 15.277 ( -0.676 0.100 -5.757) 5.797 18.429 ( -4.166 -4.607 3.445) 7.103 19.403 ( 5.045 -4.465 -1.803) 6.974 19.866 ( -9.560 6.682 3.211) 12.097 20.203 ( -9.326 14.817 -1.781) 17.598 22.471 ( 11.758 -5.918 -4.665) 13.965 23.956 ( -0.829 -1.162 1.692) 2.214 ======================= Grid point 320 (142/433) ======================= q-point: (-0.25 0.08 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.412 ( -12.012 15.802 4.518) 20.357 1.979 ( -10.475 13.409 31.399) 35.713 3.101 ( -22.628 30.711 11.356) 39.801 5.359 ( -5.030 -1.810 -1.808) 5.643 6.259 ( -2.966 -1.438 -1.908) 3.809 7.406 ( -3.747 -6.308 -13.903) 15.720 7.919 ( -4.170 1.363 -1.223) 4.554 7.978 ( 10.505 -7.740 10.189) 16.555 8.202 ( 4.771 -5.146 1.540) 7.184 8.734 ( -17.137 1.106 7.817) 18.868 8.799 ( 10.385 7.683 -0.358) 12.923 9.209 ( -1.973 -0.144 -16.591) 16.709 9.424 ( 7.474 1.532 3.867) 8.553 9.625 ( 8.742 3.009 -3.457) 9.870 9.962 ( 11.384 -12.596 -8.409) 18.946 10.302 ( -0.262 -5.486 8.702) 10.291 10.341 ( -6.525 -2.006 1.050) 6.907 10.609 ( 5.440 -3.240 4.092) 7.539 11.234 ( 0.313 -2.224 0.382) 2.278 11.597 ( 0.712 0.881 -3.955) 4.114 12.140 ( 11.793 1.836 -10.015) 15.580 12.364 ( 9.644 -2.385 1.826) 10.101 12.743 ( 5.046 11.164 2.988) 12.611 13.311 ( -9.294 -5.945 -0.408) 11.040 13.573 ( -4.494 -5.697 -1.878) 7.495 13.633 ( 6.898 -3.878 0.663) 7.941 13.933 ( -8.170 -2.078 2.489) 8.790 14.482 ( -7.083 6.331 -0.221) 9.503 14.827 ( -0.755 3.244 -9.685) 10.242 15.438 ( 14.032 -4.809 18.606) 23.795 18.454 ( -1.976 -5.910 4.579) 7.733 19.370 ( -3.946 7.250 -5.313) 9.817 19.661 ( -9.996 3.891 -3.418) 11.258 19.967 ( -2.257 12.934 -0.914) 13.162 22.693 ( 10.568 -6.702 -3.338) 12.951 23.940 ( -3.305 -0.859 1.239) 3.632 ======================= Grid point 321 (143/433) ======================= q-point: (-0.17 0.08 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.208 ( 4.172 19.252 17.631) 26.436 1.963 ( -5.689 15.497 35.940) 39.550 2.516 ( -18.464 31.495 25.346) 44.444 5.210 ( -10.221 1.205 -4.188) 11.111 6.286 ( 4.333 -0.525 4.743) 6.446 7.192 ( -7.692 4.945 -16.534) 18.895 7.892 ( -4.666 -11.183 -3.192) 12.531 8.257 ( 8.436 -0.524 6.462) 10.639 8.368 ( -3.883 -4.296 8.844) 10.571 8.605 ( 1.412 -4.418 16.595) 17.231 8.842 ( 2.068 -0.349 -3.339) 3.943 9.065 ( -4.767 -0.425 -16.312) 16.999 9.529 ( 7.117 5.403 1.345) 9.036 9.774 ( 13.119 1.854 -1.598) 13.346 10.003 ( -9.372 -7.774 -4.704) 13.053 10.364 ( 0.337 -3.631 2.968) 4.702 10.564 ( 14.830 -7.301 13.620) 21.418 10.854 ( 13.251 -8.156 2.593) 15.774 11.295 ( 1.279 -7.756 2.643) 8.293 11.616 ( 3.030 -1.939 -2.322) 4.282 12.245 ( 11.589 3.021 -13.851) 18.311 12.487 ( 4.098 4.318 -3.773) 7.048 12.718 ( 3.245 8.184 1.979) 9.024 13.178 ( -11.698 -3.307 -2.340) 12.380 13.467 ( -9.020 -2.863 -3.963) 10.260 13.717 ( -3.902 5.397 -0.969) 6.730 13.854 ( -3.699 -6.997 4.486) 9.098 14.296 ( -5.460 6.165 -1.046) 8.301 14.682 ( -0.139 6.392 -15.890) 17.128 16.045 ( 22.636 -24.744 33.881) 47.671 18.519 ( -1.468 -6.544 4.221) 7.925 19.177 ( -1.451 11.514 -6.431) 13.268 19.394 ( -10.515 8.283 -5.081) 14.318 19.787 ( -1.334 18.783 -6.425) 19.896 22.902 ( 7.264 -8.086 -1.682) 10.999 23.882 ( -5.040 -0.464 0.887) 5.139 ======================= Grid point 322 (144/433) ======================= q-point: (-0.08 0.08 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.432 ( 25.786 17.204 24.962) 39.799 1.701 ( -10.924 31.657 23.574) 40.954 2.458 ( 1.470 7.546 47.671) 48.287 5.016 ( -6.215 2.505 -1.828) 6.946 6.476 ( 11.883 -0.728 11.217) 16.357 6.928 ( -5.225 5.864 -16.063) 17.880 7.901 ( -6.792 -13.234 -2.770) 15.131 8.236 ( -8.062 -2.838 4.390) 9.608 8.466 ( 7.256 3.748 3.163) 8.758 8.671 ( -1.338 8.756 1.451) 8.976 8.860 ( -6.733 0.065 -5.931) 8.973 9.123 ( 12.391 -15.477 12.537) 23.457 9.585 ( 6.288 8.140 3.772) 10.956 9.862 ( -10.535 -8.778 3.597) 14.177 10.008 ( 9.705 -2.369 -3.599) 10.618 10.384 ( 2.526 5.231 5.895) 8.276 10.947 ( 11.493 -8.088 2.920) 14.353 11.129 ( 7.512 -6.805 0.611) 10.154 11.475 ( 2.186 -15.496 5.917) 16.731 11.706 ( 6.054 -5.148 -1.760) 8.140 12.235 ( -1.248 8.545 -11.509) 14.389 12.397 ( 2.739 3.709 -13.097) 13.885 12.727 ( 3.545 6.419 1.338) 7.454 12.923 ( -13.856 6.166 -3.547) 15.576 13.314 ( -11.872 -3.269 -0.035) 12.314 13.563 ( -3.628 4.435 0.077) 5.731 13.880 ( -3.102 -2.264 4.320) 5.780 14.168 ( -3.298 6.652 -3.716) 8.302 14.563 ( 4.233 2.537 -16.591) 17.309 16.924 ( 6.387 -50.169 28.212) 57.911 18.516 ( -9.107 -3.024 1.137) 9.663 19.084 ( 3.917 3.413 -2.347) 5.700 19.208 ( 16.925 24.436 -7.799) 30.731 19.479 ( -4.055 23.189 -6.050) 24.306 23.044 ( 0.960 -7.116 0.680) 7.213 23.809 ( -4.176 -0.217 0.925) 4.283 ======================= Grid point 325 (145/433) ======================= q-point: ( 0.17 0.17 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 433 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.730 ( 20.243 -0.000 13.562) 24.366 3.064 ( 2.074 -0.000 16.565) 16.694 4.012 ( 12.070 -0.000 6.175) 13.558 5.065 ( -2.413 0.000 1.275) 2.729 6.626 ( 4.773 -0.000 -5.526) 7.302 7.178 ( -20.383 0.000 -7.294) 21.649 7.512 ( -5.012 0.000 -9.853) 11.055 8.155 ( 23.915 -0.000 13.882) 27.652 8.523 ( 2.233 -0.000 0.391) 2.267 8.986 ( 16.716 -0.000 1.871) 16.820 8.994 ( -16.760 0.000 -15.745) 22.996 9.468 ( -0.666 0.000 9.137) 9.161 9.743 ( 5.019 -0.000 13.400) 14.309 10.043 ( 2.464 -0.000 -4.460) 5.095 10.058 ( -19.761 0.000 -5.425) 20.492 10.231 ( 0.775 -0.000 -4.520) 4.586 10.967 ( -6.858 0.000 -11.360) 13.270 11.084 ( -4.404 0.000 2.314) 4.975 11.486 ( -7.139 0.000 1.683) 7.335 11.528 ( -5.329 0.000 -2.388) 5.840 12.165 ( 7.573 -0.000 15.995) 17.698 12.376 ( 7.272 -0.000 1.248) 7.379 12.504 ( -8.539 0.000 3.226) 9.128 12.681 ( 2.647 -0.000 -6.887) 7.378 13.191 ( -1.320 0.000 3.677) 3.907 13.343 ( -10.107 0.000 -8.353) 13.112 13.542 ( 12.167 -0.000 0.255) 12.169 14.149 ( 4.126 -0.000 5.650) 6.996 14.597 ( -0.082 0.000 -5.589) 5.590 16.392 ( -18.379 0.000 2.871) 18.602 18.023 ( 4.449 -0.000 -2.855) 5.286 18.808 ( -2.765 0.000 -5.196) 5.886 20.180 ( 3.280 -0.000 4.981) 5.964 20.383 ( 22.833 -0.000 7.108) 23.914 22.811 ( -14.117 0.000 -4.221) 14.735 23.613 ( 1.123 -0.000 -3.542) 3.716 ======================= Grid point 326 (146/433) ======================= q-point: ( 0.25 0.17 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.038 ( 8.666 8.838 7.661) 14.557 3.213 ( 5.198 -7.886 12.164) 15.400 4.153 ( 1.781 -2.217 -1.113) 3.055 5.014 ( -3.554 1.680 2.893) 4.881 6.614 ( -9.924 -1.274 2.096) 10.223 6.919 ( -0.394 -1.653 -11.176) 11.304 7.371 ( -4.397 -0.750 -11.767) 12.584 8.469 ( -13.441 -1.804 -4.307) 14.229 8.583 ( 17.818 -0.737 5.127) 18.555 8.671 ( -4.254 1.227 -11.056) 11.909 9.240 ( 11.443 2.928 -0.077) 11.812 9.514 ( 4.352 10.377 9.132) 14.492 9.746 ( -11.175 -1.722 -3.459) 11.824 9.905 ( 0.585 -6.996 10.039) 12.250 9.999 ( -0.846 1.732 -8.737) 8.947 10.176 ( -1.411 0.788 -10.590) 10.713 10.786 ( -6.327 0.466 -9.171) 11.152 11.025 ( -6.122 -0.885 4.090) 7.415 11.384 ( -3.395 1.672 -0.533) 3.821 11.427 ( -4.895 -0.586 -1.093) 5.049 12.286 ( -0.342 4.605 3.314) 5.684 12.436 ( -1.408 2.046 8.454) 8.811 12.573 ( 9.799 -6.576 4.191) 12.523 12.659 ( 1.770 6.362 -1.869) 6.863 13.123 ( -8.345 -2.045 -6.490) 10.767 13.229 ( -3.735 -7.940 3.138) 9.319 13.775 ( 14.535 0.980 2.359) 14.758 14.243 ( 2.865 1.137 6.549) 7.238 14.549 ( -2.090 0.488 -1.664) 2.716 16.091 ( -15.413 2.070 -4.187) 16.105 18.132 ( 8.252 -2.967 -1.759) 8.944 18.747 ( -2.672 -2.253 -4.295) 5.537 20.224 ( -0.076 4.154 10.367) 11.168 20.826 ( 21.943 -2.981 7.411) 23.352 22.481 ( -18.877 2.788 -7.988) 20.687 23.640 ( 4.005 -0.411 -2.608) 4.797 ======================= Grid point 327 (147/433) ======================= q-point: ( 0.33 0.17 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 794 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.987 ( -2.709 12.752 0.771) 13.059 3.436 ( 5.181 -0.820 7.272) 8.967 4.121 ( -6.403 -5.668 -5.398) 10.113 4.982 ( -0.771 0.811 5.002) 5.126 6.431 ( -12.186 -3.475 2.738) 12.964 6.970 ( 5.172 -2.706 -9.131) 10.837 7.259 ( -1.182 -3.343 -12.172) 12.678 8.140 ( -19.381 -7.430 -10.728) 23.365 8.632 ( 2.108 1.540 -4.826) 5.487 8.823 ( 8.924 -0.015 -1.799) 9.103 9.248 ( -0.592 12.667 1.539) 12.774 9.392 ( -1.517 9.267 -6.526) 11.435 9.768 ( -4.642 4.185 5.340) 8.221 9.888 ( -1.675 2.663 -7.373) 8.016 9.983 ( 9.011 -2.640 -6.345) 11.333 10.184 ( 2.973 -9.648 0.785) 10.126 10.638 ( -3.644 3.761 -7.936) 9.508 10.925 ( -10.700 -2.064 3.888) 11.570 11.324 ( -2.003 1.679 -0.366) 2.639 11.407 ( 0.558 -2.518 0.868) 2.721 12.194 ( -2.807 5.839 -0.833) 6.532 12.382 ( -3.884 5.792 -4.853) 8.496 12.644 ( 4.282 9.281 10.173) 14.421 12.837 ( 6.973 -11.670 0.546) 13.605 13.022 ( -3.437 -5.247 -3.272) 7.074 13.281 ( -3.404 -8.718 5.532) 10.872 14.005 ( 10.306 0.833 4.267) 11.186 14.280 ( 1.436 4.843 6.004) 7.846 14.542 ( 1.124 -1.684 2.619) 3.310 15.809 ( -11.681 1.342 -8.505) 14.512 18.311 ( 9.027 -4.115 -0.832) 9.956 18.712 ( -2.083 -4.123 -2.867) 5.437 20.234 ( -2.321 4.562 13.774) 14.695 21.215 ( 17.380 2.046 6.418) 18.640 22.077 ( -18.317 1.297 -10.913) 21.361 23.716 ( 5.460 -0.879 -0.816) 5.590 ======================= Grid point 328 (148/433) ======================= q-point: (-0.58 0.17 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.745 ( -6.140 18.385 -4.633) 19.929 3.404 ( -7.338 9.604 -0.047) 12.087 4.052 ( -5.729 -7.939 -2.506) 10.106 5.046 ( 3.168 -2.532 6.112) 7.335 6.360 ( -4.671 -7.375 2.761) 9.156 6.916 ( -4.772 -0.039 -10.747) 11.759 7.299 ( 3.837 -10.000 -8.676) 13.784 7.922 ( -9.760 -10.735 -7.347) 16.263 8.617 ( 0.439 -0.727 -7.135) 7.185 8.857 ( 1.422 3.676 -7.563) 8.528 9.105 ( 0.018 13.857 3.847) 14.381 9.293 ( 2.057 4.420 -10.125) 11.237 9.527 ( -10.463 10.264 -1.179) 14.704 9.772 ( -1.402 6.087 -4.143) 7.496 10.238 ( 12.917 -6.704 -6.481) 15.931 10.325 ( 1.338 -3.316 5.751) 6.773 10.477 ( -4.729 5.914 -6.856) 10.215 10.767 ( -12.242 -3.170 -0.005) 12.646 11.282 ( -1.501 1.698 0.795) 2.401 11.466 ( 2.139 -2.881 2.566) 4.411 12.108 ( 0.931 5.497 -3.542) 6.605 12.210 ( -3.749 5.455 -8.519) 10.788 12.705 ( 4.892 7.881 10.906) 14.317 12.959 ( -1.784 -9.466 -2.082) 9.855 13.104 ( 1.763 -11.458 -0.313) 11.597 13.355 ( 0.850 -5.903 4.087) 7.230 14.075 ( -3.439 2.144 7.362) 8.404 14.380 ( 10.812 2.283 5.410) 12.303 14.624 ( 3.110 -1.346 4.775) 5.855 15.580 ( -8.127 0.723 -9.821) 12.768 18.439 ( 2.195 -1.119 -0.682) 2.557 18.773 ( 4.673 -8.663 -0.141) 9.844 20.223 ( -4.074 4.859 14.442) 15.773 21.269 ( -6.744 14.538 -2.308) 16.191 21.902 ( 3.904 -8.037 -5.944) 10.731 23.816 ( 4.937 -1.096 0.910) 5.139 ======================= Grid point 329 (149/433) ======================= q-point: (-0.50 0.17 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 794 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.413 ( -5.241 22.557 -5.503) 23.803 3.059 ( -17.159 14.118 -2.938) 22.414 4.022 ( -4.756 -1.632 1.545) 5.260 5.185 ( 4.578 -3.964 5.769) 8.363 6.397 ( -3.678 -6.619 0.304) 7.578 6.802 ( -1.402 -6.811 -8.272) 10.807 7.395 ( -0.680 -13.108 -6.573) 14.679 7.940 ( 2.413 -8.931 -1.208) 9.330 8.541 ( -3.630 -0.956 -11.989) 12.563 8.813 ( 4.184 5.863 -5.559) 9.098 8.995 ( -2.309 12.069 5.408) 13.425 9.229 ( 0.643 0.827 -10.122) 10.176 9.334 ( -1.826 3.946 0.022) 4.348 9.690 ( 3.510 9.263 -3.941) 10.661 10.159 ( -11.050 11.478 -6.289) 17.129 10.379 ( -6.517 -4.068 3.275) 8.351 10.433 ( 5.225 -1.529 -3.049) 6.239 10.611 ( -7.140 -2.035 -4.465) 8.663 11.249 ( -1.164 1.688 1.075) 2.315 11.578 ( 4.755 -3.906 3.267) 6.968 12.060 ( 0.887 1.107 -9.075) 9.185 12.089 ( 2.153 6.429 -3.952) 7.847 12.789 ( 6.534 6.546 8.513) 12.570 13.021 ( -1.460 -10.822 -0.001) 10.920 13.208 ( -2.530 -12.217 0.173) 12.478 13.467 ( 5.531 -3.594 -1.980) 6.887 14.027 ( -5.385 1.022 8.585) 10.186 14.585 ( 7.819 -2.191 7.605) 11.125 14.701 ( 2.811 1.803 3.898) 5.133 15.408 ( -4.073 1.782 -8.914) 9.961 18.424 ( -2.562 0.515 0.723) 2.712 19.001 ( 9.088 -11.014 1.400) 14.348 20.167 ( -6.180 6.312 11.918) 14.834 20.877 ( -14.769 14.807 -7.798) 22.320 22.117 ( 12.291 -6.726 -2.866) 14.301 23.900 ( 2.704 -0.916 1.820) 3.386 ======================= Grid point 330 (150/433) ======================= q-point: (-0.42 0.17 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.103 ( -1.501 24.387 -3.081) 24.626 2.600 ( -18.384 16.743 4.215) 25.220 3.902 ( -8.256 8.900 3.779) 12.714 5.312 ( 2.274 -2.668 4.438) 5.655 6.319 ( -7.098 -1.708 -2.458) 7.703 6.953 ( 7.024 -16.577 -4.585) 18.578 7.475 ( -1.118 -14.527 -2.463) 14.777 8.086 ( 6.469 -1.415 1.891) 6.887 8.410 ( -4.644 1.696 -9.691) 10.880 8.704 ( 0.252 13.241 1.742) 13.358 8.967 ( -6.059 -5.693 5.127) 9.768 9.213 ( 5.541 -1.245 -5.793) 8.112 9.366 ( 7.612 -1.112 -9.505) 12.228 9.654 ( 5.632 11.433 -2.895) 13.069 9.811 ( -10.958 7.338 -4.129) 13.819 10.290 ( -7.130 0.372 3.024) 7.754 10.436 ( -5.271 -2.062 -3.435) 6.621 10.534 ( 0.368 0.145 -2.873) 2.900 11.224 ( -1.246 0.620 0.949) 1.684 11.665 ( 0.788 0.381 -0.315) 0.930 12.077 ( 4.248 -0.854 1.370) 4.544 12.104 ( 10.300 0.964 -10.717) 14.896 12.880 ( 6.369 6.269 4.352) 9.940 13.108 ( -3.644 -13.398 2.373) 14.086 13.282 ( -0.985 -10.405 0.552) 10.466 13.562 ( 5.820 -1.392 -6.782) 9.045 13.981 ( -5.746 -0.079 8.012) 9.860 14.675 ( -5.923 -2.065 4.846) 7.927 14.783 ( 6.053 0.355 4.712) 7.679 15.322 ( 2.827 4.122 -4.558) 6.764 18.388 ( -2.083 0.322 2.914) 3.596 19.257 ( 7.663 -10.036 0.338) 12.631 20.028 ( -8.147 9.202 6.131) 13.734 20.474 ( -11.487 13.187 -5.976) 18.481 22.356 ( 11.349 -5.887 -3.665) 13.300 23.939 ( -0.213 -0.616 1.838) 1.950 ======================= Grid point 331 (151/433) ======================= q-point: (-0.33 0.17 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 794 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.843 ( 1.464 26.694 -1.556) 26.779 2.273 ( -8.994 16.661 22.285) 29.242 3.608 ( -13.228 21.356 6.346) 25.910 5.344 ( -2.820 -0.320 1.881) 3.405 6.239 ( -2.558 -0.688 1.540) 3.064 7.162 ( 1.845 -15.556 -9.449) 18.294 7.653 ( 3.561 -16.841 4.719) 17.849 8.146 ( -1.849 1.701 -6.902) 7.345 8.241 ( 4.016 15.505 6.520) 17.293 8.653 ( -9.555 -3.540 4.216) 11.027 8.951 ( 0.686 -2.101 5.625) 6.043 9.230 ( -5.072 6.921 -9.959) 13.146 9.387 ( 7.976 -3.911 -7.846) 11.852 9.730 ( 8.399 -7.757 1.421) 11.521 9.735 ( 8.571 5.400 -8.138) 12.994 10.231 ( -2.001 -1.622 6.558) 7.046 10.312 ( -8.115 -0.918 -0.701) 8.197 10.570 ( 4.796 -1.048 -0.467) 4.932 11.203 ( -2.212 -1.068 0.677) 2.548 11.628 ( -0.596 2.437 -2.707) 3.690 12.175 ( 10.579 1.401 -7.596) 13.099 12.290 ( 10.697 -4.858 0.445) 11.757 12.908 ( 1.295 4.515 0.029) 4.697 13.152 ( -5.701 -8.938 0.826) 10.634 13.401 ( 1.302 -10.586 1.071) 10.719 13.600 ( 3.400 0.240 -5.822) 6.747 13.929 ( -5.084 0.648 4.838) 7.048 14.559 ( -9.577 1.560 1.610) 9.835 14.853 ( 0.006 -0.740 -0.841) 1.120 15.398 ( 8.510 0.763 7.416) 11.314 18.394 ( 0.078 -0.408 4.613) 4.631 19.402 ( 1.437 -4.207 -4.334) 6.209 19.814 ( -6.623 11.584 -0.148) 13.344 20.192 ( -5.675 10.726 -1.392) 12.215 22.562 ( 8.993 -6.777 -4.064) 11.971 23.927 ( -2.846 -0.440 1.283) 3.153 ======================= Grid point 332 (152/433) ======================= q-point: (-0.25 0.17 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.694 ( 12.793 28.404 8.369) 32.257 2.234 ( -0.263 14.423 33.651) 36.613 3.156 ( -15.046 31.808 11.034) 36.876 5.248 ( -7.462 2.490 -0.423) 7.878 6.278 ( 3.620 -0.409 7.138) 8.014 7.185 ( -2.680 -5.856 -13.020) 14.525 7.779 ( -7.162 -5.161 -2.548) 9.189 8.151 ( 7.482 -6.061 7.643) 12.294 8.331 ( 8.275 3.501 5.165) 10.364 8.505 ( -12.932 -4.343 12.884) 18.764 8.985 ( -7.869 -4.029 -13.255) 15.933 9.043 ( 5.771 12.289 1.455) 13.654 9.545 ( 7.462 -5.042 -1.815) 9.187 9.817 ( 10.891 1.322 -8.781) 14.053 9.883 ( -0.620 -3.306 -2.051) 3.939 10.247 ( -2.341 -6.123 3.312) 7.345 10.396 ( 8.378 -8.941 13.334) 18.109 10.730 ( 11.077 -4.965 0.291) 12.142 11.183 ( -3.436 -3.995 1.149) 5.393 11.602 ( 1.192 0.716 -1.699) 2.196 12.288 ( 11.326 1.117 -13.333) 17.530 12.505 ( 8.646 -2.227 1.077) 8.992 12.837 ( -4.876 2.862 -0.826) 5.714 13.111 ( -5.047 -3.471 -2.488) 6.612 13.417 ( -5.663 -1.789 -5.396) 8.024 13.690 ( 4.086 -6.545 3.993) 8.688 13.838 ( -5.737 4.321 0.592) 7.207 14.392 ( -6.436 3.528 -0.004) 7.340 14.791 ( -1.767 3.818 -9.148) 10.069 15.677 ( 7.335 -13.300 21.559) 26.373 18.447 ( 1.385 -1.047 5.268) 5.547 19.323 ( -5.478 2.996 -8.349) 10.425 19.613 ( -0.387 14.441 -2.520) 14.664 20.051 ( -0.056 9.652 -2.248) 9.911 22.737 ( 5.566 -8.818 -3.124) 10.886 23.874 ( -4.475 -0.301 0.659) 4.533 ======================= Grid point 333 (153/433) ======================= q-point: (-0.17 0.17 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 794 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.845 ( 24.725 24.104 17.531) 38.726 2.275 ( -1.326 22.556 26.250) 34.636 2.765 ( -4.225 26.473 26.924) 37.995 5.081 ( -6.745 4.049 -0.649) 7.893 6.456 ( 9.733 -1.402 12.105) 15.596 7.053 ( -2.096 5.871 -14.503) 15.786 7.690 ( -6.446 -8.032 -2.482) 10.594 8.207 ( -7.342 -0.382 4.707) 8.730 8.468 ( 2.722 -2.736 3.761) 5.389 8.687 ( 3.859 -15.211 9.375) 18.280 8.830 ( 1.427 3.656 4.569) 6.023 9.021 ( 4.303 7.332 -3.169) 9.073 9.680 ( 2.965 -5.125 -2.468) 6.415 9.789 ( -3.993 6.091 2.846) 7.820 9.961 ( 9.152 -1.889 -4.652) 10.439 10.354 ( 2.980 -8.065 3.416) 9.252 10.744 ( 7.579 -11.363 11.975) 18.165 10.988 ( 11.418 -8.148 -2.281) 14.211 11.213 ( -1.934 -10.051 5.019) 11.400 11.633 ( 2.539 -2.307 -0.887) 3.543 12.347 ( 6.658 1.475 -15.670) 17.089 12.505 ( -4.557 7.671 -9.263) 12.861 12.751 ( -3.447 -1.173 3.097) 4.780 13.053 ( -0.136 2.152 -4.141) 4.669 13.259 ( -9.600 0.052 -3.460) 10.205 13.672 ( -6.703 6.557 1.168) 9.449 13.815 ( 0.605 -4.431 4.057) 6.038 14.300 ( -0.240 5.772 -2.677) 6.367 14.638 ( -1.053 4.924 -14.820) 15.652 16.134 ( 1.167 -31.775 29.270) 43.217 18.480 ( -3.694 -0.138 4.305) 5.674 19.149 ( -3.249 2.976 -6.197) 7.603 19.544 ( 12.003 15.870 -2.560) 20.062 19.906 ( 0.834 16.189 -9.247) 18.663 22.872 ( 0.858 -10.280 -0.805) 10.347 23.805 ( -4.138 -0.214 0.383) 4.161 ======================= Grid point 334 (154/433) ======================= q-point: (-0.08 0.17 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.020 ( 0.123 25.843 19.594) 32.432 2.250 ( 26.885 22.520 17.930) 39.388 2.891 ( 10.509 9.885 37.639) 40.309 4.987 ( -0.273 1.662 -0.743) 1.840 6.732 ( 7.108 -2.499 8.099) 11.061 6.899 ( 7.179 9.466 -6.278) 13.437 7.686 ( -4.704 -10.666 -1.476) 11.750 8.136 ( -4.079 -1.853 0.610) 4.522 8.421 ( -11.869 -3.738 -1.567) 12.542 8.670 ( 2.787 6.658 -4.051) 8.277 9.018 ( 8.000 9.191 9.859) 15.674 9.268 ( 14.011 -16.937 12.606) 25.339 9.623 ( -9.388 -3.321 2.034) 10.164 9.790 ( 3.895 6.851 3.815) 8.756 10.073 ( 4.566 -2.061 -2.429) 5.567 10.536 ( 8.174 -6.445 1.432) 10.507 10.900 ( -4.743 -8.061 5.869) 11.041 11.203 ( 7.292 -4.243 -2.328) 8.752 11.361 ( -1.827 -14.778 8.198) 16.998 11.726 ( 3.787 -6.273 -0.584) 7.351 12.149 ( -10.817 11.193 -9.193) 18.078 12.352 ( -2.196 -1.756 -10.625) 10.991 12.741 ( 1.575 0.624 -2.096) 2.695 12.970 ( 2.207 11.485 -7.283) 13.778 13.089 ( -10.192 -0.869 0.993) 10.277 13.562 ( -1.965 3.681 2.032) 4.641 13.855 ( -1.142 -1.808 2.568) 3.342 14.143 ( -5.973 10.336 -5.973) 13.348 14.563 ( 5.572 0.086 -14.630) 15.656 16.570 ( -11.025 -36.374 25.588) 45.819 18.349 ( -10.603 3.428 1.594) 11.257 19.138 ( 3.139 -1.362 -2.146) 4.039 19.580 ( 4.283 15.295 -1.929) 16.000 19.770 ( 19.947 17.287 -12.757) 29.317 22.957 ( -2.350 -9.880 1.946) 10.341 23.752 ( -2.834 -0.427 -0.353) 2.888 ======================= Grid point 338 (155/433) ======================= q-point: ( 0.25 0.25 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 432 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.146 ( -4.298 0.000 6.053) 7.424 3.398 ( 12.841 -0.000 5.366) 13.917 4.060 ( -8.412 0.000 -6.263) 10.487 4.995 ( -1.528 0.000 3.449) 3.772 6.394 ( -13.729 0.000 2.711) 13.994 6.940 ( 7.307 -0.000 -9.088) 11.661 7.232 ( -3.171 0.000 -12.360) 12.760 8.062 ( -20.529 0.000 -11.209) 23.389 8.647 ( 0.687 -0.000 -4.387) 4.441 8.822 ( 9.243 -0.000 -1.403) 9.349 9.381 ( 1.363 -0.000 1.168) 1.795 9.496 ( -7.004 0.000 -12.023) 13.915 9.858 ( 13.829 -0.000 14.889) 20.320 9.893 ( -3.234 0.000 8.068) 8.693 9.935 ( 3.424 -0.000 -13.366) 13.797 10.068 ( -3.606 0.000 -10.762) 11.350 10.671 ( -2.345 0.000 -7.768) 8.115 10.908 ( -11.007 0.000 4.417) 11.860 11.343 ( -4.022 0.000 0.670) 4.078 11.377 ( 1.826 -0.000 0.184) 1.835 12.247 ( -3.702 0.000 -3.548) 5.128 12.506 ( -0.852 0.000 4.816) 4.890 12.661 ( 4.257 -0.000 -5.026) 6.587 12.759 ( 2.567 -0.000 7.931) 8.336 12.953 ( -2.196 0.000 -6.943) 7.282 13.184 ( -2.184 0.000 9.673) 9.917 14.014 ( 10.495 -0.000 3.192) 10.970 14.338 ( 2.298 -0.000 7.405) 7.753 14.515 ( -0.678 0.000 1.645) 1.780 15.823 ( -12.528 0.000 -8.497) 15.138 18.271 ( 10.545 -0.000 -0.637) 10.564 18.671 ( -2.647 0.000 -2.894) 3.922 20.280 ( -3.435 0.000 13.548) 13.977 21.232 ( 22.210 -0.000 6.708) 23.200 22.091 ( -22.039 0.000 -10.905) 24.590 23.708 ( 5.574 -0.000 -1.012) 5.665 ======================= Grid point 339 (156/433) ======================= q-point: (-0.67 0.25 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.041 ( -4.575 9.898 0.696) 10.926 3.565 ( 3.343 6.872 0.525) 7.660 3.865 ( -10.235 -9.462 -6.485) 15.374 5.020 ( 1.883 -0.414 4.290) 4.703 6.252 ( -6.701 -3.205 3.162) 8.073 6.941 ( -2.673 1.924 -9.235) 9.805 7.145 ( -0.292 -5.234 -10.879) 12.076 7.761 ( -9.449 -4.846 -7.674) 13.102 8.611 ( -1.276 -0.082 -5.782) 5.922 8.887 ( 1.523 0.448 -5.042) 5.286 9.304 ( -3.597 5.613 -3.031) 7.323 9.342 ( -2.027 0.783 -12.557) 12.743 9.772 ( -5.634 14.095 3.252) 15.524 9.897 ( -1.389 5.479 1.397) 5.822 10.058 ( 4.563 -11.675 -4.714) 13.392 10.228 ( 14.344 -4.731 2.399) 15.294 10.582 ( -1.720 3.320 -8.791) 9.554 10.724 ( -12.852 -1.121 0.938) 12.934 11.296 ( -2.724 0.074 2.044) 3.406 11.427 ( 1.619 -1.102 2.668) 3.310 12.162 ( -2.311 0.913 -6.041) 6.532 12.398 ( -2.340 12.521 -2.381) 12.958 12.713 ( -0.867 -14.093 -8.158) 16.307 12.826 ( 2.295 3.974 8.439) 9.606 12.966 ( 1.543 -3.466 -1.204) 3.980 13.264 ( 2.802 -2.935 9.011) 9.883 14.112 ( -1.506 1.278 5.113) 5.481 14.407 ( 2.752 0.679 7.341) 7.870 14.594 ( 6.496 -1.227 3.415) 7.441 15.596 ( -7.788 0.610 -9.053) 11.958 18.444 ( 8.884 1.026 0.061) 8.943 18.639 ( -0.579 -4.480 -0.865) 4.600 20.288 ( -4.584 1.792 14.542) 15.352 21.523 ( -0.315 11.858 -2.294) 12.082 21.733 ( -2.068 -9.588 -5.752) 11.371 23.803 ( 5.315 -0.325 0.805) 5.385 ======================= Grid point 340 (157/433) ======================= q-point: (-0.58 0.25 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.831 ( -2.627 18.623 -3.004) 19.046 3.307 ( -15.014 11.680 -5.679) 19.852 3.911 ( 0.982 -9.304 -0.140) 9.357 5.119 ( 4.526 -2.559 5.095) 7.280 6.265 ( -0.936 -6.200 3.597) 7.229 6.747 ( -8.348 0.538 -9.673) 12.789 7.161 ( -1.233 -10.514 -7.905) 13.212 7.765 ( 4.711 -7.713 -2.191) 9.299 8.534 ( -2.720 0.058 -10.268) 10.622 8.829 ( -2.993 -0.312 -4.566) 5.468 9.216 ( 0.638 3.488 -2.652) 4.428 9.235 ( -1.247 1.487 -10.674) 10.849 9.530 ( -6.672 17.393 5.376) 19.389 9.860 ( 4.030 7.566 -0.820) 8.611 10.212 ( -0.819 -11.959 1.981) 12.149 10.356 ( -11.536 7.322 -0.834) 13.689 10.438 ( 5.545 1.649 -7.149) 9.197 10.581 ( -3.328 -1.576 -6.714) 7.657 11.265 ( -2.659 0.098 2.053) 3.361 11.506 ( 3.923 -3.276 5.014) 7.160 12.077 ( -1.567 0.787 -8.548) 8.726 12.252 ( 0.681 10.457 -3.072) 10.920 12.785 ( -2.195 -13.882 -5.446) 15.072 12.880 ( 3.396 2.915 6.808) 8.147 13.025 ( 1.170 -5.723 -1.155) 5.954 13.408 ( 6.375 -2.427 2.810) 7.377 14.056 ( -6.150 1.774 7.511) 9.869 14.506 ( 0.371 -4.498 7.886) 9.086 14.734 ( 6.965 1.214 2.523) 7.506 15.451 ( -2.170 2.095 -6.724) 7.370 18.476 ( 0.406 4.755 0.668) 4.818 18.791 ( 7.633 -10.459 1.498) 13.034 20.266 ( -5.125 3.711 12.841) 14.316 21.117 ( -17.629 9.615 -11.279) 23.032 21.998 ( 14.387 -5.239 0.011) 15.311 23.888 ( 3.255 -0.340 1.943) 3.806 ======================= Grid point 341 (158/433) ======================= q-point: (-0.50 0.25 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.590 ( 1.738 24.477 -3.990) 24.861 2.894 ( -16.302 13.248 0.218) 21.007 3.976 ( -0.367 -0.818 1.178) 1.480 5.254 ( 3.734 -3.134 5.031) 7.006 6.289 ( -5.151 -1.775 2.378) 5.944 6.678 ( 2.240 -10.922 -6.238) 12.776 7.216 ( -0.303 -11.773 -3.425) 12.265 7.982 ( 10.482 -8.465 2.142) 13.642 8.394 ( -4.581 0.421 -12.429) 13.253 8.776 ( -5.245 -4.334 -1.358) 6.938 9.132 ( -1.521 11.076 -0.547) 11.193 9.199 ( 2.206 2.761 -0.878) 3.641 9.355 ( -0.246 4.432 -1.745) 4.769 9.863 ( 6.614 8.964 -3.100) 11.563 9.978 ( -18.024 8.688 -1.566) 20.070 10.276 ( -2.472 -2.807 -0.483) 3.771 10.416 ( -3.125 0.698 -3.568) 4.794 10.539 ( 1.970 -0.203 -6.983) 7.258 11.229 ( -3.075 -0.094 1.866) 3.598 11.657 ( 4.980 -1.393 4.977) 7.177 12.027 ( 2.165 -2.063 -5.505) 6.264 12.185 ( 4.346 6.009 -5.985) 9.530 12.835 ( -3.982 -12.643 -3.927) 13.825 12.973 ( 5.198 0.890 6.096) 8.061 13.097 ( 1.134 -7.458 -2.790) 8.043 13.543 ( 8.055 -0.801 -3.569) 8.846 13.990 ( -6.158 0.893 8.925) 10.880 14.573 ( -5.008 -6.365 8.040) 11.412 14.810 ( 2.686 1.387 0.492) 3.062 15.407 ( 3.592 4.056 -2.620) 6.018 18.438 ( 0.042 4.729 2.755) 5.473 19.042 ( 7.584 -11.686 1.777) 14.044 20.190 ( -5.581 7.120 8.132) 12.164 20.696 ( -13.797 9.512 -9.570) 19.298 22.253 ( 11.462 -4.686 -2.604) 12.654 23.932 ( 0.244 -0.145 2.032) 2.051 ======================= Grid point 342 (159/433) ======================= q-point: (-0.42 0.25 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.368 ( 3.852 26.386 -3.957) 26.957 2.593 ( -6.490 15.986 14.806) 22.736 3.908 ( -4.258 9.849 2.263) 10.967 5.332 ( -0.682 -1.102 3.767) 3.984 6.229 ( -3.551 -0.567 4.480) 5.744 6.861 ( 5.448 -15.023 -6.034) 17.082 7.357 ( 3.487 -13.241 2.695) 13.956 8.173 ( 1.276 2.132 -5.327) 5.878 8.332 ( 4.226 -8.114 0.724) 9.178 8.670 ( -10.808 -0.565 2.236) 11.051 8.971 ( -4.023 13.746 7.603) 16.216 9.258 ( 5.700 -3.274 -5.394) 8.504 9.375 ( 4.091 -1.885 -11.315) 12.178 9.650 ( -8.990 3.405 5.310) 10.982 9.884 ( 7.814 7.410 -6.995) 12.840 10.233 ( -2.104 1.187 2.218) 3.279 10.315 ( -5.447 1.357 -1.553) 5.824 10.555 ( 3.427 -1.064 -4.432) 5.702 11.187 ( -3.861 -0.723 1.525) 4.214 11.690 ( 0.186 3.887 -0.431) 3.915 12.159 ( 6.713 -5.134 5.955) 10.338 12.219 ( 10.332 0.014 -12.164) 15.960 12.842 ( -5.354 -9.885 -4.046) 11.947 13.063 ( 1.134 -1.368 -0.241) 1.793 13.205 ( 4.565 -8.833 1.228) 10.018 13.629 ( 6.119 2.307 -6.960) 9.550 13.944 ( -4.462 0.895 8.291) 9.458 14.541 ( -9.322 -3.232 5.679) 11.384 14.824 ( -0.729 -1.470 -0.100) 1.643 15.445 ( 4.897 3.306 2.139) 6.284 18.432 ( 1.801 4.216 4.883) 6.698 19.255 ( 3.782 -10.028 -0.659) 10.737 20.046 ( -3.733 11.360 1.245) 12.023 20.379 ( -8.631 8.614 -4.167) 12.886 22.439 ( 7.833 -5.805 -4.836) 10.883 23.923 ( -2.541 -0.025 1.330) 2.868 ======================= Grid point 343 (160/433) ======================= q-point: (-0.33 0.25 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.228 ( 10.856 25.735 5.679) 28.502 2.533 ( 2.796 16.703 23.562) 29.016 3.675 ( -7.436 21.381 4.016) 22.991 5.293 ( -5.435 1.907 2.178) 6.158 6.263 ( 1.744 -1.376 8.975) 9.246 7.019 ( 3.858 -10.385 -7.724) 13.505 7.577 ( 1.374 -12.958 3.279) 13.437 8.101 ( 0.243 -0.792 -2.150) 2.304 8.441 ( -12.590 -2.736 10.096) 16.368 8.534 ( 7.361 12.163 3.606) 14.667 8.836 ( -7.216 -4.207 -6.256) 10.436 9.318 ( 1.645 12.013 4.620) 12.975 9.373 ( 5.354 -9.877 -8.592) 14.144 9.733 ( 6.537 -9.322 -0.261) 11.388 9.904 ( 5.522 3.110 -5.710) 8.530 10.207 ( -4.701 2.057 1.505) 5.347 10.276 ( 4.565 -2.335 7.495) 9.081 10.646 ( 7.586 -4.226 -2.353) 8.997 11.133 ( -4.758 -1.427 1.476) 5.182 11.645 ( 0.230 3.674 -1.124) 3.849 12.282 ( 7.449 -1.665 -10.749) 13.183 12.424 ( 10.122 -5.732 3.316) 12.095 12.805 ( -4.598 -5.551 -4.395) 8.443 13.039 ( -4.497 -4.111 -5.276) 8.059 13.382 ( 4.597 -3.419 1.995) 6.067 13.622 ( 1.555 1.166 -3.159) 3.709 13.914 ( -2.444 3.341 3.903) 5.689 14.428 ( -7.311 0.171 2.576) 7.753 14.807 ( -2.841 -1.853 -2.475) 4.199 15.525 ( 1.099 -3.211 9.169) 9.777 18.474 ( 3.169 3.586 6.606) 8.158 19.310 ( -3.384 -3.890 -5.928) 7.856 19.900 ( 2.703 14.375 -2.852) 14.903 20.198 ( -3.337 6.340 0.196) 7.168 22.572 ( 3.947 -8.181 -5.604) 10.673 23.871 ( -4.154 -0.027 0.404) 4.173 ======================= Grid point 344 (161/433) ======================= q-point: (-0.25 0.25 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.309 ( 18.614 23.102 13.500) 32.595 2.609 ( 5.276 15.447 27.325) 31.829 3.347 ( -4.264 29.428 8.030) 30.801 5.162 ( -7.008 4.146 1.300) 8.245 6.417 ( 6.565 -2.760 12.312) 14.223 7.105 ( 5.665 -1.421 -9.137) 10.844 7.571 ( -9.065 -4.791 -3.257) 10.759 8.222 ( -2.136 0.891 4.412) 4.982 8.350 ( 0.793 -10.740 13.409) 17.198 8.538 ( -0.264 5.421 0.330) 5.438 8.791 ( 1.526 -6.074 -6.093) 8.737 9.257 ( 1.881 13.382 7.537) 15.473 9.504 ( 1.840 -11.133 -7.503) 13.551 9.887 ( 1.390 -2.166 3.192) 4.101 9.950 ( 8.917 1.487 -7.223) 11.572 10.183 ( -0.563 -4.730 4.108) 6.290 10.528 ( 9.449 -10.269 12.759) 18.908 10.838 ( 8.408 -7.174 -2.089) 11.249 11.094 ( -2.534 -3.083 2.377) 4.645 11.623 ( 0.664 1.374 -0.363) 1.568 12.317 ( 1.932 -3.854 -13.470) 14.143 12.600 ( 4.011 0.087 -3.785) 5.515 12.748 ( -1.213 1.662 -3.969) 4.470 12.968 ( -5.489 -7.782 -3.049) 9.999 13.346 ( -3.254 6.657 -2.505) 7.822 13.716 ( 3.821 -5.411 3.256) 7.381 13.804 ( -6.645 6.801 1.595) 9.641 14.374 ( 1.419 2.038 -1.156) 2.739 14.716 ( -4.030 2.056 -8.907) 9.990 15.679 ( -3.339 -16.169 19.258) 25.366 18.520 ( 0.383 4.208 7.411) 8.531 19.187 ( -5.370 0.737 -7.999) 9.663 19.849 ( 10.816 15.521 -2.999) 19.154 20.111 ( -0.603 6.401 -2.494) 6.896 22.664 ( -0.200 -10.997 -4.338) 11.823 23.802 ( -3.973 -0.083 -0.211) 3.979 ======================= Grid point 345 (162/433) ======================= q-point: (-0.17 0.25 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.449 ( 7.863 20.578 15.931) 27.186 2.699 ( 9.780 19.344 20.408) 29.771 3.211 ( 12.233 23.202 18.893) 32.326 5.035 ( -3.817 3.296 0.967) 5.135 6.659 ( 7.842 -4.641 11.403) 14.596 7.115 ( 8.737 11.253 -8.007) 16.342 7.480 ( -7.090 -10.272 -1.545) 12.577 8.130 ( -5.078 1.136 1.340) 5.373 8.357 ( -9.831 -1.580 -2.533) 10.274 8.700 ( 6.725 -4.704 4.412) 9.317 8.950 ( 10.405 -12.885 3.628) 16.954 9.240 ( 4.904 13.011 13.177) 19.156 9.529 ( -3.526 -6.717 -6.101) 9.735 9.901 ( -3.133 -1.424 5.087) 6.142 10.063 ( 11.135 4.182 -4.903) 12.866 10.309 ( 1.360 -12.454 2.500) 12.775 10.812 ( 3.192 -3.880 11.032) 12.123 11.001 ( 4.407 -12.624 -0.883) 13.400 11.182 ( 4.004 -5.837 4.027) 8.144 11.640 ( 1.174 -2.267 0.080) 2.554 12.251 ( -5.435 -3.640 -13.259) 14.785 12.421 ( -8.770 10.456 -8.606) 16.134 12.752 ( 4.940 0.674 -5.178) 7.188 12.958 ( -5.595 -6.106 -1.341) 8.390 13.225 ( -0.323 8.636 -1.891) 8.846 13.645 ( -5.293 4.864 3.580) 8.031 13.808 ( 0.216 -3.133 1.648) 3.546 14.335 ( -2.263 8.418 -4.744) 9.924 14.579 ( 1.489 1.659 -13.500) 13.683 15.953 ( -5.616 -27.099 24.028) 36.650 18.449 ( -6.730 7.146 5.022) 11.027 19.115 ( 1.609 -1.220 -4.271) 4.724 19.872 ( 5.954 15.095 -1.554) 16.302 20.034 ( 9.333 9.748 -8.217) 15.800 22.731 ( -3.256 -13.133 -1.503) 13.614 23.745 ( -2.668 -0.217 -0.737) 2.776 ======================= Grid point 346 (163/433) ======================= q-point: (-0.08 0.25 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.396 ( 5.249 20.967 13.136) 25.293 2.853 ( 10.921 13.564 20.821) 27.144 3.459 ( 21.186 13.967 19.509) 32.009 4.995 ( -0.215 -0.189 0.881) 0.926 6.773 ( 1.131 3.130 -3.956) 5.169 7.248 ( 19.120 5.864 9.687) 22.221 7.476 ( -7.145 -11.845 -2.013) 13.978 8.009 ( -8.417 1.138 -7.862) 11.573 8.242 ( -3.938 -3.748 3.446) 6.437 8.797 ( 7.192 3.851 -2.184) 8.446 9.187 ( 1.163 -2.386 6.342) 6.875 9.442 ( 8.872 -6.567 11.263) 15.770 9.481 ( -0.430 -3.525 -2.414) 4.294 9.868 ( -5.335 0.879 6.795) 8.684 10.169 ( 9.149 3.333 -4.678) 10.803 10.404 ( -7.436 -12.577 -0.910) 14.639 10.911 ( 4.111 -0.768 5.735) 7.098 11.203 ( 2.555 -12.554 1.858) 12.945 11.311 ( 2.082 -2.802 5.389) 6.421 11.691 ( -1.611 -5.640 -0.774) 5.916 11.978 ( -12.386 5.366 -9.392) 16.444 12.258 ( -1.057 0.335 -1.977) 2.267 12.766 ( -0.637 1.164 -6.432) 6.568 12.878 ( -3.826 0.901 -4.653) 6.091 13.143 ( 3.066 7.118 -0.265) 7.755 13.591 ( -1.346 3.770 4.785) 6.239 13.797 ( -5.063 -0.962 -2.498) 5.727 14.117 ( -4.230 9.587 -4.767) 11.512 14.572 ( 4.990 -0.503 -11.527) 12.571 16.239 ( -8.545 -26.531 19.566) 34.055 18.274 ( -6.166 8.199 1.595) 10.382 19.145 ( 0.320 0.243 -2.023) 2.063 19.744 ( 2.865 10.782 -5.499) 12.438 20.160 ( 17.246 10.187 -2.352) 20.167 22.794 ( -4.612 -13.802 0.288) 14.555 23.702 ( -2.042 0.047 -1.804) 2.725 ======================= Grid point 351 (164/433) ======================= q-point: (-0.67 0.33 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 433 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.028 ( -3.051 0.000 0.190) 3.057 3.469 ( -18.424 0.000 -8.465) 20.276 3.759 ( 8.541 -0.000 -0.703) 8.570 5.094 ( 4.218 -0.000 4.371) 6.074 6.199 ( -0.635 0.000 4.115) 4.164 6.771 ( -11.863 0.000 -8.598) 14.651 7.042 ( 0.150 -0.000 -8.985) 8.986 7.686 ( 5.229 -0.000 -2.607) 5.843 8.536 ( -2.001 0.000 -9.454) 9.663 8.826 ( -5.425 0.000 -3.680) 6.556 9.225 ( -1.030 0.000 -14.846) 14.881 9.260 ( -2.218 0.000 -1.414) 2.631 9.820 ( -6.373 0.000 5.070) 8.144 9.966 ( -1.562 0.000 7.629) 7.787 9.967 ( 4.735 -0.000 -2.599) 5.401 10.400 ( -0.887 0.000 5.137) 5.213 10.510 ( -3.726 0.000 -12.300) 12.852 10.539 ( 0.526 -0.000 -10.336) 10.350 11.264 ( -3.011 0.000 2.944) 4.211 11.470 ( 2.660 -0.000 5.626) 6.223 12.086 ( -1.928 0.000 -8.177) 8.401 12.449 ( -3.942 0.000 4.364) 5.881 12.550 ( 1.362 -0.000 -12.916) 12.987 12.908 ( 1.134 -0.000 5.297) 5.417 12.976 ( 3.403 -0.000 -2.774) 4.390 13.383 ( 6.760 -0.000 5.114) 8.476 14.078 ( -6.620 0.000 6.890) 9.555 14.455 ( -1.260 0.000 7.962) 8.061 14.746 ( 7.703 -0.000 2.067) 7.976 15.473 ( -1.679 0.000 -5.947) 6.179 18.583 ( -1.299 0.000 0.969) 1.621 18.629 ( 9.850 -0.000 1.189) 9.921 20.302 ( -4.705 0.000 13.184) 13.999 21.216 ( -19.907 0.000 -13.379) 23.985 21.941 ( 16.379 -0.000 1.888) 16.487 23.885 ( 3.444 -0.000 2.010) 3.987 ======================= Grid point 353 (165/433) ======================= q-point: (-0.58 0.33 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.954 ( 0.739 10.531 0.306) 10.561 3.094 ( -16.119 7.190 -4.259) 18.157 3.910 ( 6.639 -4.046 -1.842) 7.990 5.206 ( 4.473 -1.487 4.921) 6.814 6.246 ( -1.070 -2.009 5.573) 6.020 6.556 ( -5.512 -2.347 -6.997) 9.211 7.049 ( 2.226 -4.907 -3.876) 6.638 7.841 ( 10.606 -4.466 0.501) 11.519 8.422 ( -2.974 1.435 -13.397) 13.798 8.708 ( -7.871 -2.085 1.182) 8.227 9.142 ( 0.364 -0.868 -10.726) 10.767 9.237 ( 0.209 -0.469 -1.544) 1.627 9.643 ( -6.962 15.881 8.696) 19.399 9.963 ( -5.201 -0.971 6.924) 8.714 10.060 ( -2.029 0.291 0.677) 2.159 10.239 ( -2.830 0.566 -9.711) 10.131 10.448 ( -1.395 2.249 -6.342) 6.872 10.509 ( 0.954 -2.783 -10.360) 10.770 11.229 ( -3.403 0.163 3.162) 4.648 11.619 ( 8.179 -1.791 8.585) 11.992 12.007 ( -0.999 -0.285 -8.347) 8.411 12.337 ( -0.524 9.493 -2.391) 9.803 12.583 ( -1.729 -12.456 -6.095) 13.974 12.967 ( 3.131 -0.862 3.700) 4.923 13.022 ( 3.165 -1.189 -5.044) 6.072 13.530 ( 9.152 -0.441 -1.063) 9.224 14.009 ( -6.600 0.751 9.547) 11.631 14.475 ( -3.982 -3.028 7.722) 9.200 14.828 ( 1.705 0.460 -0.340) 1.799 15.462 ( 3.258 1.527 -1.580) 3.930 18.553 ( 1.025 6.106 2.995) 6.878 18.835 ( 7.453 -8.604 2.155) 11.585 20.286 ( -4.025 2.641 9.143) 10.333 20.825 ( -15.413 3.547 -11.747) 19.701 22.187 ( 11.828 -1.875 -1.755) 12.103 23.932 ( 0.464 0.009 2.184) 2.233 ======================= Grid point 354 (166/433) ======================= q-point: (-0.50 0.33 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 794 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.779 ( -6.883 13.601 0.677) 15.258 2.884 ( 3.198 14.755 5.849) 16.191 4.004 ( 3.433 1.039 -1.498) 3.887 5.304 ( 1.268 -1.462 4.932) 5.298 6.214 ( -5.688 -0.874 6.137) 8.413 6.617 ( 6.503 -9.530 -3.769) 12.137 7.162 ( 5.217 -6.845 2.360) 8.924 8.105 ( 11.365 -9.212 2.135) 14.785 8.257 ( -3.981 3.084 -12.639) 13.606 8.611 ( -10.452 -3.256 5.922) 12.447 9.129 ( 2.167 -1.504 -6.609) 7.116 9.271 ( 2.921 -4.589 -0.507) 5.464 9.427 ( -5.109 18.022 5.730) 19.589 9.767 ( -15.179 5.618 6.652) 17.499 9.995 ( 3.614 4.995 -10.125) 11.855 10.254 ( 3.823 -0.201 -3.681) 5.311 10.355 ( -3.004 2.305 -2.517) 4.546 10.502 ( 0.679 -4.662 -7.557) 8.905 11.183 ( -3.967 0.572 3.026) 5.022 11.771 ( 3.250 4.432 3.940) 6.763 12.034 ( 5.915 -6.804 1.022) 9.073 12.261 ( 3.024 4.101 -7.338) 8.934 12.627 ( -2.493 -11.427 -6.142) 13.211 13.024 ( -0.498 -2.271 -7.075) 7.447 13.091 ( 6.815 -3.334 3.751) 8.464 13.668 ( 9.535 1.416 -5.962) 11.335 13.965 ( -4.817 1.287 11.230) 12.287 14.462 ( -7.384 -3.999 7.291) 11.122 14.808 ( -2.291 -0.294 -1.997) 3.054 15.501 ( 2.852 2.212 1.243) 3.817 18.545 ( 2.790 6.985 5.067) 9.069 19.049 ( 4.963 -10.553 2.106) 11.851 20.223 ( -2.097 6.609 2.019) 7.221 20.512 ( -10.413 4.950 -6.607) 13.289 22.348 ( 7.087 -3.499 -5.257) 9.492 23.925 ( -2.424 0.120 1.403) 2.804 ======================= Grid point 355 (167/433) ======================= q-point: (-0.42 0.33 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.636 ( 3.511 15.976 9.756) 19.045 2.866 ( 7.002 17.045 10.789) 21.353 3.971 ( -0.409 9.768 -0.687) 9.801 5.317 ( -3.551 0.702 4.234) 5.571 6.221 ( -0.816 -2.857 9.284) 9.748 6.811 ( 6.619 -10.482 -3.129) 12.785 7.372 ( 7.397 -7.538 6.117) 12.205 8.097 ( -3.946 -0.309 -8.514) 9.389 8.368 ( 2.568 -5.347 4.731) 7.587 8.509 ( -6.373 -5.492 6.841) 10.843 9.084 ( -3.462 17.622 1.121) 17.994 9.224 ( 1.114 -1.354 -10.852) 10.992 9.434 ( 6.974 -4.250 3.807) 9.011 9.592 ( -5.296 0.410 6.122) 8.105 9.942 ( 0.333 1.245 -5.790) 5.932 10.275 ( -1.723 3.472 0.876) 3.974 10.303 ( 6.180 3.525 -3.848) 8.089 10.549 ( 3.471 -6.210 -3.208) 7.804 11.125 ( -4.147 0.691 2.479) 4.881 11.739 ( 0.304 5.922 -1.205) 6.051 12.239 ( 2.207 -2.393 -2.966) 4.403 12.297 ( 10.104 -6.918 0.919) 12.280 12.652 ( -1.412 -9.658 -7.563) 12.347 12.972 ( -2.726 -2.420 -8.195) 8.969 13.291 ( 8.714 -4.823 4.694) 11.011 13.701 ( 2.021 5.112 -5.967) 8.113 13.968 ( -0.313 2.408 7.734) 8.106 14.400 ( -7.892 -2.847 5.876) 10.243 14.754 ( -3.939 -2.674 -2.485) 5.371 15.512 ( -1.596 0.779 3.403) 3.838 18.576 ( 4.238 6.667 7.330) 10.777 19.193 ( 0.245 -7.694 -0.911) 7.751 20.137 ( 3.228 9.654 -5.021) 11.351 20.306 ( -6.558 4.976 0.566) 8.251 22.432 ( 2.514 -6.048 -7.722) 10.125 23.872 ( -4.062 0.132 0.249) 4.071 ======================= Grid point 356 (168/433) ======================= q-point: (-0.33 0.33 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 794 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.696 ( 12.228 16.550 15.042) 25.489 2.913 ( 7.688 15.971 16.446) 24.179 3.812 ( -1.290 18.297 0.672) 18.355 5.234 ( -6.502 3.163 3.469) 8.020 6.347 ( 3.849 -4.443 11.725) 13.116 6.990 ( 5.710 -9.465 -2.852) 11.416 7.522 ( 1.085 -0.098 -0.841) 1.376 8.118 ( 4.986 -8.591 6.041) 11.626 8.284 ( -10.973 1.460 9.339) 14.483 8.621 ( -1.258 -7.692 -3.188) 8.421 8.822 ( 1.851 18.916 -4.404) 19.510 9.290 ( 2.948 -9.501 -7.830) 12.660 9.465 ( 0.063 6.936 6.566) 9.552 9.710 ( -0.351 -12.390 3.812) 12.968 9.961 ( 6.270 -0.964 -3.058) 7.043 10.214 ( -0.570 4.499 3.744) 5.881 10.411 ( 9.262 -1.388 1.669) 9.512 10.700 ( 7.142 -7.324 -0.591) 10.247 11.073 ( -2.498 0.498 1.976) 3.224 11.683 ( 0.050 4.558 -1.063) 4.681 12.224 ( -1.690 -5.007 -11.083) 12.279 12.537 ( 6.501 -5.242 -0.531) 8.368 12.703 ( 2.606 -8.759 -3.113) 9.655 12.883 ( -3.176 0.783 -7.195) 7.903 13.448 ( 0.633 1.940 2.145) 2.961 13.643 ( 1.683 -0.237 -0.373) 1.740 13.929 ( -4.556 6.081 2.232) 7.919 14.380 ( 0.926 -1.480 2.608) 3.138 14.697 ( -4.560 -3.494 -4.178) 7.103 15.489 ( -6.468 -4.563 8.318) 11.482 18.632 ( 3.493 7.051 9.688) 12.481 19.175 ( -4.503 -1.775 -5.979) 7.693 20.113 ( 9.860 9.873 -6.695) 15.477 20.198 ( -3.129 4.788 3.555) 6.734 22.463 ( -1.758 -9.541 -8.256) 12.739 23.802 ( -3.873 0.051 -0.642) 3.926 ======================= Grid point 357 (169/433) ======================= q-point: (-0.25 0.33 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.823 ( 9.637 17.865 13.282) 24.258 3.002 ( 6.635 13.730 20.065) 25.202 3.662 ( 7.135 20.684 4.541) 22.347 5.108 ( -5.930 4.082 2.995) 7.798 6.559 ( 6.408 -5.826 11.506) 14.401 7.145 ( 2.993 -10.186 -2.360) 10.876 7.449 ( 1.216 9.082 -4.664) 10.282 8.161 ( -7.879 1.314 7.381) 10.876 8.348 ( -3.880 -3.221 0.767) 5.101 8.563 ( 8.061 -2.890 5.224) 10.031 8.819 ( 5.212 -1.590 -5.701) 7.887 9.356 ( -1.131 -9.000 -5.908) 10.826 9.478 ( 3.853 8.127 10.388) 13.741 9.758 ( -7.353 -9.922 2.695) 12.640 10.052 ( 5.569 -4.363 -10.831) 12.937 10.277 ( 7.101 5.407 10.689) 13.925 10.662 ( 10.094 -9.226 7.906) 15.796 10.852 ( 2.547 -4.825 -0.011) 5.456 11.094 ( 3.523 -2.797 1.631) 4.785 11.643 ( -0.110 2.399 -0.364) 2.429 12.153 ( -4.697 -5.478 -11.640) 13.695 12.528 ( -6.571 -1.682 -12.391) 14.126 12.802 ( 3.378 4.353 -5.806) 8.004 12.844 ( 2.164 -4.139 3.970) 6.130 13.353 ( -2.946 5.256 0.554) 6.050 13.710 ( -3.962 -2.352 1.524) 4.853 13.778 ( -2.735 4.380 1.026) 5.265 14.442 ( 3.333 2.724 -1.977) 4.737 14.607 ( -2.295 0.241 -9.368) 9.648 15.541 ( -6.513 -15.532 16.634) 23.672 18.623 ( -2.651 10.623 8.996) 14.170 19.088 ( -0.761 -1.492 -5.863) 6.097 20.109 ( -3.852 5.200 -0.266) 6.477 20.195 ( 15.692 11.395 -4.298) 19.864 22.471 ( -4.829 -13.438 -6.286) 15.602 23.743 ( -2.421 -0.024 -1.143) 2.678 ======================= Grid point 358 (170/433) ======================= q-point: (-0.17 0.33 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 794 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.791 ( 2.554 19.916 8.571) 21.832 3.098 ( 5.395 11.786 19.349) 23.289 3.754 ( 17.596 14.710 9.434) 24.800 5.015 ( -3.499 2.328 3.130) 5.240 6.758 ( 3.255 -4.343 5.775) 7.925 7.232 ( -3.992 -12.218 -2.420) 13.079 7.443 ( 14.093 12.237 0.782) 18.681 8.063 ( -4.872 4.366 -3.051) 7.219 8.191 ( -6.880 -0.980 -0.389) 6.961 8.812 ( 6.418 -1.308 -0.713) 6.589 8.988 ( 7.851 -12.961 7.402) 16.865 9.355 ( -4.665 -8.130 -5.843) 11.045 9.550 ( 7.895 10.356 12.087) 17.768 9.730 ( -9.518 -11.471 2.164) 15.062 10.127 ( 3.364 -8.994 -11.712) 15.145 10.380 ( 5.063 8.635 7.928) 12.769 10.900 ( 2.546 -0.895 4.798) 5.505 10.967 ( 6.452 -11.722 4.223) 14.031 11.227 ( 4.754 -5.089 2.808) 7.509 11.626 ( -1.429 -0.423 -0.177) 1.500 12.012 ( -9.148 -1.552 -12.791) 15.802 12.308 ( -6.712 2.552 -6.082) 9.411 12.781 ( -3.724 0.390 -3.272) 4.973 12.900 ( 5.866 3.170 -0.796) 6.715 13.274 ( -1.790 5.647 -2.249) 6.337 13.628 ( -2.659 0.020 5.851) 6.427 13.761 ( -3.231 -2.103 -2.032) 4.358 14.310 ( -6.058 9.303 -6.028) 12.633 14.576 ( 3.823 0.767 -9.202) 9.994 15.764 ( -2.908 -22.205 17.846) 28.636 18.470 ( -5.047 12.181 3.944) 13.762 19.119 ( 2.702 -2.359 -0.529) 3.626 19.951 ( -4.277 9.043 -4.521) 10.978 20.349 ( 16.676 9.982 -1.367) 19.483 22.498 ( -5.779 -16.506 -3.315) 17.800 23.705 ( -1.223 0.273 -1.735) 2.140 ======================= Grid point 359 (171/433) ======================= q-point: (-0.08 0.33 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.718 ( 5.032 14.495 5.816) 16.409 3.184 ( 3.046 8.754 18.362) 20.568 3.988 ( 16.801 10.067 7.911) 21.123 4.981 ( -2.589 -0.581 3.887) 4.707 6.798 ( -0.518 1.237 -0.492) 1.429 7.221 ( -6.840 -7.791 -4.915) 11.474 7.671 ( 15.006 2.070 1.558) 15.228 7.887 ( -0.234 8.496 -2.546) 8.872 8.208 ( 1.565 -6.045 3.994) 7.413 8.895 ( 4.375 -2.863 -4.367) 6.812 9.214 ( 2.347 -3.456 7.792) 8.842 9.284 ( -7.503 -5.118 -6.554) 11.201 9.669 ( -2.737 -7.447 2.885) 8.442 9.731 ( 2.913 -2.592 8.201) 9.081 10.163 ( -1.114 -7.645 -11.874) 14.166 10.367 ( 1.443 9.797 2.167) 10.137 10.976 ( 1.072 -1.496 4.060) 4.458 11.174 ( 4.094 -7.118 3.690) 9.003 11.336 ( -0.790 -2.632 -3.625) 4.549 11.540 ( -7.102 -1.018 -1.848) 7.409 11.831 ( -3.417 -1.862 1.041) 4.028 12.265 ( 1.460 -2.632 0.688) 3.087 12.645 ( -8.958 0.821 -0.682) 9.021 12.908 ( 3.381 9.771 -8.928) 13.660 13.238 ( 3.631 -0.937 2.898) 4.739 13.641 ( -2.112 2.098 -1.781) 3.469 13.661 ( -5.494 2.590 1.339) 6.220 14.130 ( -1.402 5.768 -1.046) 6.028 14.563 ( 1.081 -0.470 -7.966) 8.053 16.011 ( -3.772 -19.251 11.442) 22.710 18.317 ( -1.038 11.079 0.722) 11.151 19.140 ( -1.450 2.832 -1.254) 3.420 19.815 ( 0.503 3.578 -2.042) 4.151 20.524 ( 14.950 9.395 2.308) 17.807 22.543 ( -6.724 -16.806 -2.577) 18.284 23.671 ( -0.474 1.135 -2.487) 2.775 ======================= Grid point 365 (172/433) ======================= q-point: (-0.58 0.42 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 432 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.899 ( -9.840 0.000 4.478) 10.811 3.056 ( 4.061 -0.000 1.513) 4.334 4.000 ( 7.486 -0.000 -3.735) 8.366 5.288 ( 2.101 -0.000 5.406) 5.800 6.203 ( -6.748 0.000 6.634) 9.463 6.522 ( 6.311 -0.000 -3.011) 6.993 7.097 ( 6.476 -0.000 2.705) 7.018 8.006 ( 10.455 -0.000 0.327) 10.460 8.298 ( -2.296 0.000 -14.178) 14.363 8.575 ( -10.014 0.000 7.834) 12.714 9.107 ( 2.500 -0.000 -7.324) 7.739 9.219 ( -0.365 0.000 -1.056) 1.117 9.643 ( -8.632 0.000 9.903) 13.137 9.809 ( -13.905 0.000 12.924) 18.984 10.131 ( 0.797 -0.000 -13.187) 13.211 10.170 ( 8.534 -0.000 -11.358) 14.207 10.385 ( -3.279 0.000 -4.046) 5.207 10.435 ( -0.275 0.000 -5.555) 5.562 11.195 ( -3.461 0.000 3.599) 4.993 11.837 ( 10.189 -0.000 13.162) 16.645 11.942 ( -0.177 0.000 -8.288) 8.290 12.347 ( -4.333 0.000 -1.321) 4.530 12.465 ( 3.121 -0.000 -11.303) 11.725 13.002 ( -0.152 0.000 -7.818) 7.820 13.058 ( 6.665 -0.000 2.859) 7.252 13.681 ( 10.742 -0.000 -5.035) 11.864 13.981 ( -4.944 0.000 12.419) 13.367 14.419 ( -6.503 0.000 6.875) 9.463 14.806 ( -2.896 0.000 -2.476) 3.810 15.523 ( 2.209 -0.000 1.212) 2.520 18.643 ( 2.712 -0.000 5.061) 5.741 18.915 ( 5.728 -0.000 3.151) 6.538 20.288 ( -1.559 0.000 2.242) 2.731 20.561 ( -11.015 0.000 -7.510) 13.331 22.313 ( 6.832 -0.000 -5.366) 8.687 23.926 ( -2.404 0.000 1.441) 2.803 ======================= Grid point 367 (173/433) ======================= q-point: (-0.50 0.42 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.839 ( 0.260 5.312 11.602) 12.762 3.123 ( 6.416 7.850 5.066) 11.333 4.075 ( 4.574 2.032 -3.810) 6.290 5.324 ( -2.101 0.107 5.623) 6.004 6.171 ( -2.643 -1.735 8.843) 9.391 6.657 ( 7.173 -4.514 -0.761) 8.510 7.285 ( 10.541 -1.908 8.878) 13.913 8.059 ( -3.544 -2.641 -11.716) 12.522 8.304 ( 9.816 -0.588 -0.374) 9.840 8.457 ( -12.085 -1.010 11.606) 16.786 9.126 ( 3.401 -0.564 -5.354) 6.367 9.259 ( 3.367 -5.362 -0.373) 6.342 9.522 ( -6.760 11.161 9.033) 15.870 9.648 ( -9.522 2.184 4.494) 10.753 10.015 ( 0.974 8.421 -9.442) 12.689 10.253 ( 3.039 -10.615 -12.357) 16.571 10.328 ( -1.149 1.225 -0.391) 1.724 10.465 ( 5.011 -0.654 0.029) 5.054 11.152 ( -3.150 1.425 2.832) 4.470 11.862 ( 0.850 5.984 -5.231) 7.993 12.136 ( 9.474 -6.673 14.246) 18.364 12.245 ( -2.825 0.767 -6.530) 7.156 12.481 ( 1.563 -6.315 -11.792) 13.467 12.946 ( -0.005 -0.511 -9.126) 9.140 13.223 ( 9.270 -1.933 3.732) 10.178 13.776 ( 4.267 2.173 -6.263) 7.883 14.007 ( 0.388 1.364 11.686) 11.772 14.342 ( -8.343 -2.258 6.197) 10.636 14.721 ( -4.947 -0.821 -4.092) 6.472 15.529 ( -2.602 0.595 2.057) 3.369 18.705 ( 4.186 5.474 6.653) 9.579 19.047 ( 3.032 -5.966 3.677) 7.636 20.257 ( 1.391 2.942 -8.465) 9.069 20.382 ( -6.395 2.402 2.018) 7.123 22.350 ( 1.643 -2.280 -8.872) 9.306 23.875 ( -4.073 0.079 0.190) 4.078 ======================= Grid point 368 (174/433) ======================= q-point: (-0.42 0.42 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.938 ( 8.970 8.679 16.096) 20.368 3.184 ( 6.924 10.964 8.476) 15.492 4.053 ( 0.890 7.400 -3.040) 8.050 5.282 ( -5.522 1.793 5.138) 7.753 6.260 ( 2.316 -4.098 11.146) 12.099 6.809 ( 3.945 -7.784 -0.067) 8.727 7.547 ( 11.830 2.025 7.875) 14.355 7.974 ( -1.402 -6.285 -4.636) 7.935 8.314 ( -10.892 1.116 10.492) 15.164 8.496 ( 6.380 -3.879 1.228) 7.567 9.160 ( 2.209 -1.982 -4.309) 5.232 9.225 ( -2.317 17.640 -10.858) 20.843 9.457 ( -0.583 -9.150 6.124) 11.026 9.559 ( -2.684 0.436 5.235) 5.899 9.953 ( 2.154 1.599 0.021) 2.682 10.276 ( -1.330 -0.841 -1.528) 2.193 10.385 ( 8.173 -3.143 -3.243) 9.338 10.590 ( 7.596 -2.314 1.089) 8.015 11.103 ( -1.902 2.272 1.494) 3.318 11.782 ( 0.091 5.184 -5.245) 7.375 12.156 ( -2.790 -1.590 -8.517) 9.102 12.427 ( 6.112 -5.564 -0.971) 8.322 12.507 ( 1.918 -9.628 2.872) 10.228 12.914 ( 3.267 1.413 -9.194) 9.859 13.416 ( 6.301 -2.966 4.831) 8.476 13.708 ( -3.407 4.581 -3.263) 6.576 14.039 ( -1.817 5.460 4.249) 7.153 14.312 ( -1.971 -5.398 6.428) 8.623 14.628 ( -4.157 -2.685 -5.523) 7.416 15.454 ( -7.650 -0.224 3.301) 8.335 18.769 ( 4.746 6.450 9.133) 12.147 19.127 ( -1.246 -2.858 0.579) 3.171 20.173 ( -3.065 0.125 -5.819) 6.578 20.350 ( 6.195 7.291 0.970) 9.616 22.313 ( -3.150 -5.701 -11.190) 12.948 23.803 ( -3.862 0.081 -0.871) 3.959 ======================= Grid point 369 (175/433) ======================= q-point: (-0.33 0.42 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.115 ( 11.007 12.090 14.047) 21.555 3.241 ( 5.037 10.811 12.668) 17.399 3.959 ( 1.567 10.303 -1.373) 10.512 5.183 ( -6.191 3.527 4.569) 8.464 6.440 ( 4.415 -6.191 11.630) 13.895 6.931 ( 0.597 -9.917 -0.349) 9.941 7.636 ( 6.712 8.672 -4.915) 12.017 8.144 ( -1.757 -5.650 17.669) 18.634 8.220 ( 0.136 -4.066 3.844) 5.597 8.593 ( 4.149 1.299 -0.457) 4.372 8.936 ( -1.550 13.920 -12.757) 18.945 9.188 ( -1.204 -6.910 -6.357) 9.466 9.495 ( -4.298 -6.260 2.235) 7.915 9.637 ( 2.401 -2.834 7.540) 8.405 10.006 ( 2.269 -0.981 -4.242) 4.910 10.324 ( 5.213 -0.309 10.773) 11.972 10.561 ( 11.308 -2.245 -1.385) 11.611 10.750 ( 5.372 -4.862 1.256) 7.353 11.080 ( 1.019 0.907 0.631) 1.503 11.711 ( -0.015 3.664 -4.201) 5.574 12.073 ( -2.698 -2.003 -9.974) 10.525 12.415 ( -4.047 -7.849 -13.508) 16.138 12.737 ( 2.776 -4.888 12.035) 13.284 12.923 ( 8.460 4.654 -6.845) 11.836 13.443 ( -5.734 3.685 2.216) 7.167 13.638 ( -2.063 -2.956 0.164) 3.608 13.903 ( -6.160 7.293 0.047) 9.546 14.425 ( 2.221 -5.547 3.246) 6.800 14.582 ( 1.084 -1.347 -6.815) 7.031 15.355 ( -9.107 -4.568 7.863) 12.869 18.830 ( 2.203 9.590 12.629) 16.009 19.070 ( -3.046 0.394 -5.224) 6.060 20.111 ( -4.692 -2.899 0.649) 5.553 20.430 ( 14.278 10.977 -3.034) 18.264 22.236 ( -6.737 -10.455 -11.109) 16.676 23.744 ( -2.226 0.067 -1.384) 2.622 ======================= Grid point 370 (176/433) ======================= q-point: (-0.25 0.42 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.150 ( 2.805 17.032 5.713) 18.182 3.305 ( 3.431 9.650 15.755) 18.791 3.965 ( 9.249 6.536 2.785) 11.663 5.080 ( -4.919 4.052 4.704) 7.921 6.627 ( 0.431 -8.629 9.638) 12.944 7.030 ( 2.302 -8.235 -1.804) 8.738 7.647 ( 8.449 7.357 -5.068) 12.296 8.101 ( -6.833 -1.118 9.443) 11.709 8.284 ( -0.954 10.341 -3.488) 10.955 8.766 ( 12.321 -4.035 7.791) 15.125 8.817 ( 2.439 -1.962 -6.093) 6.850 9.174 ( -5.581 -9.546 -6.036) 12.598 9.496 ( -6.815 -10.224 0.866) 12.317 9.741 ( 5.128 4.066 7.905) 10.263 9.996 ( 1.218 -1.989 -8.094) 8.424 10.500 ( 5.746 1.740 8.229) 10.187 10.782 ( 9.984 -5.874 2.460) 11.842 10.854 ( 2.082 -4.199 1.764) 5.008 11.149 ( 4.846 -2.669 1.630) 5.767 11.662 ( 0.105 3.044 -2.141) 3.723 11.975 ( -3.861 -0.783 -11.420) 12.081 12.292 ( -8.045 -3.625 -9.605) 13.043 12.778 ( -3.634 -0.842 0.527) 3.767 13.017 ( 9.346 7.799 1.749) 12.298 13.340 ( -3.521 1.430 0.383) 3.819 13.591 ( -6.475 -3.802 1.441) 7.646 13.761 ( -4.107 3.069 -1.799) 5.434 14.430 ( -3.656 1.858 -3.350) 5.296 14.593 ( 2.539 1.043 -6.136) 6.722 15.413 ( -1.234 -13.605 13.240) 19.024 18.736 ( -4.371 15.037 6.006) 16.772 19.069 ( 2.850 -2.606 0.619) 3.911 20.043 ( -6.565 0.160 0.784) 6.614 20.560 ( 16.646 11.899 -3.480) 20.756 22.181 ( -7.433 -15.811 -8.207) 19.303 23.711 ( -0.508 0.362 -1.590) 1.708 ======================= Grid point 371 (177/433) ======================= q-point: (-0.17 0.42 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.013 ( -0.886 15.789 1.400) 15.876 3.344 ( 0.780 7.954 14.401) 16.470 4.128 ( 11.598 3.392 3.788) 12.663 5.005 ( -3.689 3.046 5.759) 7.486 6.713 ( -5.642 -9.109 6.261) 12.410 7.131 ( 4.766 -1.888 -4.839) 7.049 7.708 ( 6.556 1.226 -6.437) 9.269 8.089 ( -2.673 -3.090 -1.313) 4.292 8.145 ( 6.523 15.017 4.752) 17.048 8.814 ( 0.737 -4.492 -4.799) 6.614 9.104 ( -1.150 -7.104 -0.415) 7.208 9.137 ( 4.249 -8.859 4.967) 11.010 9.458 ( -9.719 -10.786 -1.151) 14.564 9.829 ( 6.709 5.949 5.514) 10.526 10.001 ( 0.839 -6.305 -11.035) 12.737 10.527 ( -0.464 5.583 1.330) 5.758 10.952 ( 4.796 -1.244 1.759) 5.258 11.029 ( 6.837 -8.851 6.419) 12.895 11.263 ( 2.588 -3.318 1.209) 4.379 11.581 ( -6.042 5.381 -1.691) 8.266 11.815 ( -4.492 -0.189 -9.244) 10.279 12.199 ( -1.956 -3.981 -2.431) 5.058 12.662 ( -9.366 0.732 -0.595) 9.413 13.108 ( 9.572 10.406 -0.875) 14.166 13.234 ( -4.519 0.396 -1.223) 4.698 13.625 ( -1.626 -5.420 4.546) 7.258 13.657 ( -2.316 0.350 -2.038) 3.105 14.275 ( -5.050 8.006 -2.659) 9.832 14.560 ( -1.344 -0.309 -5.130) 5.312 15.668 ( 3.595 -15.703 9.819) 18.866 18.558 ( -1.720 13.853 1.634) 14.055 19.152 ( 1.828 -0.955 3.513) 4.074 19.902 ( -6.513 3.945 -0.813) 7.657 20.702 ( 14.048 9.596 -0.437) 17.018 22.199 ( -5.873 -18.515 -5.530) 20.196 23.695 ( 0.581 1.272 -1.789) 2.271 ======================= Grid point 372 (178/433) ======================= q-point: (-0.08 0.42 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.875 ( -1.539 8.039 -1.514) 8.324 3.357 ( -1.480 4.928 13.193) 14.161 4.281 ( 7.806 2.700 0.987) 8.318 4.965 ( -3.097 1.765 7.081) 7.928 6.711 ( -7.339 -6.418 4.685) 10.817 7.138 ( 2.934 4.364 -7.911) 9.500 7.669 ( -1.318 3.680 -13.325) 13.886 8.162 ( 9.574 -5.692 -2.079) 11.331 8.281 ( 11.571 4.558 11.829) 17.164 8.843 ( -0.750 -6.306 -4.273) 7.654 9.013 ( -9.378 -7.012 -6.137) 13.220 9.263 ( -6.614 -3.338 -2.515) 7.824 9.488 ( 4.252 -8.489 7.363) 12.014 9.902 ( 2.350 -1.674 -3.607) 4.619 9.997 ( 1.390 -2.782 -9.652) 10.140 10.444 ( -1.662 6.378 -0.761) 6.635 10.982 ( -6.323 3.930 3.092) 8.061 11.161 ( -3.731 0.094 -12.361) 12.912 11.220 ( 2.226 -2.404 2.295) 4.000 11.529 ( 2.387 -0.968 2.944) 3.912 11.804 ( 0.542 -5.925 8.464) 10.346 12.216 ( -3.540 -5.681 0.579) 6.719 12.501 ( -7.373 -0.615 -1.730) 7.598 13.022 ( 1.897 9.774 -7.580) 12.514 13.303 ( 3.216 0.969 7.347) 8.078 13.544 ( 0.333 0.300 -7.945) 7.958 13.728 ( -0.021 2.263 9.410) 9.678 14.148 ( -2.334 2.572 2.155) 4.088 14.508 ( -1.492 -0.785 -4.691) 4.984 15.879 ( 0.302 -11.458 2.892) 11.821 18.449 ( 2.940 11.973 -0.025) 12.329 19.133 ( -3.298 5.128 -1.518) 6.283 19.826 ( -0.894 -1.468 5.378) 5.646 20.834 ( 10.048 6.125 3.384) 12.244 22.243 ( -5.880 -16.155 -6.218) 18.282 23.685 ( 1.785 2.331 -1.758) 3.421 ======================= Grid point 379 (179/433) ======================= q-point: ( 0.50 -0.50 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 433 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.023 ( 8.330 0.000 15.682) 17.757 3.295 ( 5.668 0.000 6.465) 8.597 4.120 ( 1.829 0.000 -4.332) 4.702 5.300 ( -5.016 0.000 5.812) 7.677 6.215 ( 1.853 0.000 10.857) 11.014 6.730 ( 3.775 -0.000 0.834) 3.866 7.574 ( 16.083 -0.000 14.782) 21.844 7.904 ( -3.946 0.000 -12.052) 12.682 8.322 ( -12.317 0.000 12.600) 17.620 8.467 ( 9.575 0.000 -0.255) 9.579 9.152 ( 2.443 -0.000 -5.490) 6.009 9.295 ( 4.004 0.000 0.789) 4.081 9.486 ( -10.426 -0.000 -2.503) 10.722 9.555 ( -2.550 0.000 6.614) 7.088 10.031 ( -3.404 -0.000 -9.252) 9.858 10.153 ( 5.626 0.000 0.377) 5.638 10.372 ( 4.647 0.000 2.177) 5.132 10.582 ( 8.218 0.000 -1.001) 8.279 11.132 ( -1.752 0.000 0.920) 1.978 11.843 ( -0.301 -0.000 -10.686) 10.690 12.151 ( -2.919 0.000 -5.973) 6.648 12.362 ( 5.061 -0.000 -3.829) 6.346 12.399 ( 3.803 0.000 9.904) 10.609 12.928 ( 4.740 0.000 -9.586) 10.693 13.383 ( 7.049 0.000 4.544) 8.387 13.759 ( -3.724 0.000 -3.510) 5.117 14.119 ( 2.914 -0.000 7.661) 8.197 14.225 ( -7.520 0.000 5.015) 9.039 14.604 ( -3.606 0.000 -6.368) 7.319 15.455 ( -7.887 0.000 2.289) 8.212 18.842 ( 4.134 -0.000 6.335) 7.564 19.091 ( 1.518 0.000 6.439) 6.615 20.171 ( -5.731 -0.000 -6.715) 8.828 20.423 ( 7.161 0.000 0.291) 7.167 22.256 ( -3.726 0.000 -12.269) 12.822 23.804 ( -3.871 0.000 -0.938) 3.983 ======================= Grid point 381 (180/433) ======================= q-point: (-0.42 0.50 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.276 ( 12.362 4.385 14.946) 19.885 3.392 ( 3.504 4.259 7.657) 9.436 4.077 ( -2.036 2.624 -3.764) 5.020 5.234 ( -5.689 1.502 5.269) 7.898 6.344 ( 2.794 -3.029 11.421) 12.141 6.797 ( 2.225 -3.600 1.109) 4.375 7.766 ( 1.390 4.466 -7.632) 8.952 8.007 ( 15.853 -5.406 17.723) 24.385 8.196 ( -10.316 -0.272 8.745) 13.527 8.606 ( 7.782 0.322 -1.380) 7.910 9.113 ( -3.435 -0.768 -5.462) 6.498 9.224 ( -5.201 11.299 -14.644) 19.214 9.371 ( -4.039 -4.676 4.891) 7.880 9.573 ( 2.389 -3.137 -1.730) 4.306 9.989 ( 1.160 -0.810 3.694) 3.955 10.296 ( 5.338 -2.162 7.261) 9.268 10.515 ( 10.436 -1.612 1.198) 10.628 10.707 ( 6.782 -0.309 -1.035) 6.868 11.105 ( -0.480 1.038 -0.973) 1.501 11.756 ( -0.729 0.967 -10.814) 10.882 12.082 ( -0.112 1.937 -6.890) 7.158 12.282 ( -1.911 -4.756 -14.550) 15.427 12.659 ( 4.334 -2.546 19.749) 20.379 12.980 ( 9.096 1.360 -7.522) 11.882 13.468 ( -2.073 -0.446 4.850) 5.293 13.629 ( -7.582 1.071 -2.995) 8.223 14.056 ( -5.173 8.828 1.215) 10.304 14.255 ( -1.745 -10.341 4.265) 11.321 14.576 ( 4.909 0.100 -5.666) 7.497 15.317 ( -10.080 -0.475 3.993) 10.852 18.934 ( 3.825 1.534 6.528) 7.720 19.124 ( -1.612 3.605 5.797) 7.014 20.044 ( -7.443 -2.796 -0.985) 8.012 20.583 ( 14.924 4.354 -2.461) 15.740 22.091 ( -8.338 -4.084 -14.275) 17.029 23.745 ( -2.129 0.040 -1.478) 2.592 ======================= Grid point 382 (181/433) ======================= q-point: (-0.33 0.50 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 794 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.409 ( 1.547 8.180 4.838) 9.629 3.479 ( 6.917 9.271 12.889) 17.318 4.012 ( -0.207 -0.862 -1.289) 1.565 5.154 ( -4.657 3.264 4.921) 7.520 6.465 ( -2.592 -7.070 9.949) 12.478 6.917 ( 7.952 -3.741 0.370) 8.796 7.719 ( 1.969 1.018 -7.302) 7.631 8.070 ( -10.586 -1.488 9.005) 13.977 8.437 ( 17.434 3.598 13.848) 22.553 8.721 ( 8.525 -0.878 0.064) 8.571 8.913 ( -4.841 10.165 -13.391) 17.495 9.039 ( -5.269 -2.954 -6.730) 9.044 9.338 ( -6.761 -5.600 0.623) 8.801 9.666 ( 3.195 -8.515 -5.946) 10.866 10.059 ( 3.647 4.225 6.714) 8.731 10.456 ( 4.396 -3.590 9.543) 11.103 10.736 ( 12.561 -1.775 -0.200) 12.688 10.774 ( 0.859 -2.020 -1.471) 2.642 11.119 ( 3.400 -0.937 0.306) 3.540 11.695 ( 0.997 0.087 -8.093) 8.155 12.013 ( 0.317 4.145 -8.457) 9.423 12.213 ( -3.519 -3.808 -10.135) 11.385 12.749 ( -4.598 -1.820 6.649) 8.286 13.134 ( 12.325 3.348 2.099) 12.943 13.369 ( -8.016 2.459 1.714) 8.558 13.505 ( -8.382 -4.465 -0.045) 9.497 13.871 ( -5.738 7.674 -3.272) 10.125 14.357 ( 0.119 -8.210 1.828) 8.412 14.621 ( 2.005 1.507 -5.008) 5.601 15.249 ( -2.111 -4.077 7.851) 9.095 19.019 ( -4.341 11.689 2.512) 12.720 19.028 ( 3.368 0.000 7.346) 8.081 19.977 ( -7.319 -5.826 3.754) 10.080 20.778 ( 17.931 9.681 -3.970) 20.761 21.916 ( -10.246 -10.968 -13.224) 20.003 23.717 ( -0.021 0.253 -1.419) 1.441 ======================= Grid point 383 (182/433) ======================= q-point: (-0.25 0.50 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.301 ( -4.408 13.014 0.827) 13.765 3.496 ( -0.389 8.443 9.187) 12.483 4.107 ( 5.930 -5.268 1.729) 8.119 5.082 ( -3.399 4.258 5.437) 7.697 6.520 ( -5.933 -9.473 7.685) 13.565 7.113 ( 11.818 -0.536 -1.721) 11.955 7.713 ( 2.580 -0.487 -7.293) 7.751 7.990 ( -6.599 -4.972 3.493) 8.971 8.526 ( 6.948 21.041 -0.427) 22.163 8.757 ( -0.021 -0.831 -7.596) 7.641 8.933 ( -6.775 -8.205 -3.513) 11.206 9.025 ( 13.853 -4.236 8.279) 16.685 9.275 ( -8.226 -7.954 -1.865) 11.593 9.739 ( 0.659 -9.974 -11.133) 14.962 10.090 ( 4.133 9.483 4.774) 11.393 10.566 ( -0.830 -1.378 1.823) 2.432 10.836 ( 2.576 -9.603 5.530) 11.377 10.938 ( 9.918 -0.288 -0.284) 9.926 11.220 ( 4.880 -1.689 2.111) 5.579 11.679 ( 1.400 1.998 -3.973) 4.662 11.858 ( -6.429 6.401 -11.441) 14.602 12.135 ( -2.249 -2.089 -3.810) 4.893 12.663 ( -9.541 -0.845 0.410) 9.587 13.229 ( -7.835 -0.573 -0.968) 7.915 13.282 ( 8.581 6.052 1.293) 10.580 13.490 ( -0.703 -7.335 6.685) 9.949 13.706 ( -3.230 5.456 -4.514) 7.783 14.388 ( -2.552 2.300 -0.494) 3.470 14.538 ( -5.731 -1.539 -2.309) 6.368 15.432 ( 8.712 -8.480 6.810) 13.935 18.834 ( -2.852 14.063 0.632) 14.363 19.128 ( 2.266 -0.977 7.707) 8.093 19.920 ( -8.112 -2.487 4.523) 9.615 20.908 ( 12.901 11.990 -4.717) 18.233 21.849 ( -5.486 -17.507 -9.154) 20.503 23.718 ( 1.495 1.012 -1.097) 2.112 ======================= Grid point 384 (183/433) ======================= q-point: (-0.17 0.50 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 794 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.064 ( -8.022 11.297 -3.067) 14.191 3.448 ( -4.400 4.527 9.079) 11.058 4.258 ( 4.484 -4.974 -0.107) 6.697 5.029 ( -2.122 4.289 6.490) 8.064 6.558 ( -4.716 -8.346 6.126) 11.376 7.233 ( 6.580 5.022 -4.592) 9.466 7.720 ( 4.520 1.403 -11.253) 12.208 8.007 ( 0.336 -8.629 -0.162) 8.638 8.473 ( 8.415 12.759 0.592) 15.296 8.738 ( -2.100 -3.562 -2.866) 5.031 8.861 ( -6.824 -7.945 -4.298) 11.320 9.146 ( -9.612 -7.936 -7.653) 14.626 9.383 ( 12.554 -2.907 10.390) 16.553 9.740 ( -2.429 -10.437 -16.066) 19.311 10.086 ( 3.588 7.602 0.774) 8.442 10.518 ( -2.871 1.593 -0.665) 3.350 11.038 ( 2.012 -1.257 4.423) 5.019 11.082 ( 6.205 -6.762 2.657) 9.554 11.256 ( -2.435 4.245 -4.205) 6.452 11.535 ( -4.245 5.247 0.873) 6.805 11.749 ( 1.263 -1.286 -3.721) 4.134 12.117 ( -3.916 -4.315 -0.685) 5.867 12.492 ( -9.176 -0.314 -2.159) 9.431 13.086 ( -6.193 -1.568 -5.038) 8.136 13.410 ( 10.203 5.461 5.887) 12.984 13.559 ( -0.568 2.920 -1.672) 3.412 13.681 ( 2.704 -4.412 6.848) 8.583 14.234 ( -7.700 5.217 0.074) 9.302 14.493 ( -1.815 -1.389 -1.125) 2.548 15.689 ( 7.679 -7.986 1.670) 11.204 18.691 ( 1.218 12.938 0.471) 13.003 19.187 ( -0.815 0.711 3.830) 3.980 19.826 ( -6.310 0.493 6.137) 8.816 20.939 ( 4.029 5.188 -1.174) 6.673 21.934 ( 1.038 -15.367 -7.755) 17.244 23.730 ( 2.508 2.223 -0.684) 3.420 ======================= Grid point 385 (184/433) ======================= q-point: (-0.08 -0.50 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.803 ( -11.003 4.279 -5.294) 12.938 3.376 ( -7.443 0.226 7.810) 10.792 4.324 ( -0.885 -3.329 -2.469) 4.238 5.014 ( 0.294 3.911 7.285) 8.274 6.591 ( -2.693 -3.688 4.895) 6.694 7.203 ( 1.578 6.328 -6.424) 9.155 7.664 ( 4.165 8.684 -13.815) 16.841 8.172 ( 6.735 -12.305 -1.354) 14.092 8.534 ( 2.597 2.518 3.294) 4.893 8.728 ( -1.368 -6.353 -5.463) 8.489 8.811 ( -3.387 -4.234 -2.912) 6.155 8.998 ( -8.149 -7.818 -10.293) 15.280 9.604 ( -1.524 -7.945 -4.578) 9.296 9.714 ( 5.156 -3.683 -5.798) 8.588 10.078 ( 3.310 3.965 -2.361) 5.679 10.473 ( 0.130 3.122 1.907) 3.661 10.826 ( -15.251 9.335 -6.979) 19.195 11.133 ( 1.600 1.985 -5.398) 5.970 11.247 ( 1.279 -0.996 1.157) 1.992 11.571 ( 1.258 0.605 0.353) 1.440 11.820 ( 1.130 -8.381 12.962) 15.477 12.066 ( -6.076 -6.112 1.359) 8.725 12.368 ( -4.796 -2.108 -6.994) 8.738 13.035 ( 1.128 -1.087 -1.520) 2.183 13.488 ( 4.110 12.752 0.484) 13.407 13.563 ( 3.718 -0.802 3.316) 5.046 13.800 ( 1.899 -1.540 8.931) 9.260 14.120 ( -3.570 -0.345 3.394) 4.938 14.480 ( 1.032 0.119 -0.959) 1.414 15.819 ( 1.368 -4.192 -4.216) 6.100 18.627 ( 4.033 11.252 0.665) 11.971 19.107 ( -4.175 5.927 -3.090) 7.881 19.838 ( -0.890 -3.953 12.633) 13.267 20.950 ( -2.044 -3.303 2.727) 4.746 22.033 ( 2.591 -7.969 -9.442) 12.625 23.752 ( 3.576 3.059 -0.125) 4.708 ======================= Grid point 393 (185/433) ======================= q-point: ( 0.58 -0.42 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 432 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.479 ( -0.208 0.000 6.082) 6.085 3.593 ( 12.711 -0.000 11.641) 17.236 3.987 ( -6.914 0.000 -3.788) 7.883 5.189 ( -4.301 0.000 4.714) 6.381 6.392 ( -3.252 0.000 9.820) 10.345 6.881 ( 9.609 -0.000 1.516) 9.727 7.723 ( -0.145 0.000 -7.219) 7.220 8.055 ( -11.885 0.000 9.323) 15.105 8.462 ( 23.618 -0.000 17.126) 29.174 8.712 ( 6.353 -0.000 -4.387) 7.721 8.975 ( -7.033 0.000 -7.299) 10.136 9.101 ( -6.239 0.000 -11.339) 12.942 9.304 ( -5.382 0.000 0.588) 5.414 9.534 ( 2.136 -0.000 -10.339) 10.557 10.094 ( 5.575 -0.000 11.588) 12.859 10.420 ( 2.874 -0.000 8.182) 8.672 10.711 ( 13.302 -0.000 0.680) 13.319 10.765 ( 1.197 -0.000 -3.551) 3.748 11.108 ( 2.199 -0.000 -0.812) 2.345 11.690 ( 1.034 -0.000 -10.273) 10.324 12.073 ( 1.423 -0.000 -7.662) 7.793 12.166 ( 0.340 -0.000 -11.116) 11.122 12.728 ( -5.807 0.000 10.708) 12.181 13.159 ( 12.430 -0.000 1.388) 12.507 13.411 ( -7.226 0.000 5.100) 8.844 13.447 ( -11.345 0.000 -3.312) 11.819 13.988 ( -7.575 0.000 -5.180) 9.177 14.227 ( 3.244 -0.000 5.401) 6.300 14.637 ( 2.247 -0.000 -4.774) 5.276 15.217 ( -2.714 0.000 5.965) 6.553 19.010 ( 2.570 -0.000 1.578) 3.016 19.171 ( -2.889 0.000 10.293) 10.691 19.898 ( -8.150 0.000 3.772) 8.981 20.882 ( 19.967 -0.000 -3.152) 20.214 21.801 ( -12.665 0.000 -15.890) 20.320 23.720 ( 0.152 -0.000 -1.342) 1.350 ======================= Grid point 395 (186/433) ======================= q-point: (-0.33 0.58 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.459 ( -4.748 3.475 5.382) 7.974 3.705 ( -1.697 12.814 1.784) 13.049 3.944 ( 2.137 -11.049 1.374) 11.337 5.146 ( -2.872 1.982 4.101) 5.385 6.386 ( -4.952 -3.834 8.183) 10.304 7.105 ( 15.058 -0.252 0.201) 15.062 7.700 ( 1.858 -0.569 -5.920) 6.231 7.918 ( -9.972 -2.092 4.248) 11.039 8.751 ( 3.066 0.274 -5.440) 6.251 8.810 ( -5.669 1.602 -8.209) 10.104 8.914 ( -2.300 7.478 -9.590) 12.377 8.951 ( 19.392 -1.413 12.967) 23.370 9.180 ( -8.583 -1.111 0.022) 8.654 9.549 ( 1.215 -8.347 -12.090) 14.742 10.244 ( 5.555 5.577 8.904) 11.884 10.485 ( -1.143 -5.357 4.605) 7.155 10.725 ( -2.005 -1.720 -2.413) 3.578 10.938 ( 12.585 0.027 -0.282) 12.589 11.187 ( 5.496 -1.402 2.060) 6.034 11.677 ( 3.321 -0.635 -7.692) 8.402 11.996 ( -2.884 5.143 -10.160) 11.747 12.121 ( -1.513 0.063 -4.255) 4.516 12.636 ( -9.804 -1.343 3.257) 10.418 13.205 ( -10.331 -1.087 -5.302) 11.662 13.339 ( -1.627 -0.294 5.356) 5.606 13.392 ( 4.935 -1.494 6.299) 8.140 13.840 ( -1.576 6.102 -4.941) 8.008 14.342 ( 2.434 -4.378 4.987) 7.068 14.538 ( -9.443 0.785 -3.025) 9.947 15.336 ( 10.430 -2.053 4.426) 11.515 19.030 ( 0.730 3.972 -3.477) 5.329 19.147 ( -3.185 3.578 12.585) 13.466 19.837 ( -7.100 -4.236 8.948) 12.183 21.146 ( 16.504 11.303 -5.739) 20.810 21.545 ( -9.818 -12.851 -13.146) 20.842 23.731 ( 2.021 0.387 -0.661) 2.161 ======================= Grid point 396 (187/433) ======================= q-point: (-0.25 0.58 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.283 ( -11.063 10.255 0.614) 15.098 3.532 ( -7.996 4.278 3.278) 9.643 4.113 ( 3.496 -9.071 -0.304) 9.726 5.107 ( -1.559 3.283 3.931) 5.354 6.421 ( -1.525 -5.370 7.012) 8.963 7.322 ( 11.063 3.946 -1.776) 11.880 7.728 ( 6.835 -0.106 -7.573) 10.202 7.852 ( -4.038 -7.051 0.355) 8.134 8.656 ( -1.703 4.306 -11.038) 11.970 8.730 ( -5.851 -4.501 -4.669) 8.734 8.772 ( 1.396 5.591 -5.855) 8.215 9.000 ( -11.145 -5.474 -5.155) 13.444 9.364 ( 14.655 0.934 10.243) 17.904 9.556 ( 0.583 -8.333 -13.481) 15.859 10.240 ( 0.212 8.207 1.028) 8.273 10.517 ( -2.156 -1.976 0.187) 2.930 10.830 ( 5.056 -11.700 7.979) 15.037 11.093 ( 6.957 1.998 -0.110) 7.239 11.299 ( 3.853 0.311 1.494) 4.145 11.705 ( 0.663 3.702 -3.421) 5.084 11.739 ( -6.423 6.286 -10.361) 13.715 12.053 ( -6.896 -2.813 -1.198) 7.544 12.488 ( -8.589 -0.089 -2.775) 9.027 13.036 ( -7.503 -2.606 -3.509) 8.683 13.396 ( 1.917 -4.492 5.587) 7.420 13.541 ( 4.890 -2.869 6.607) 8.706 13.772 ( 4.719 9.842 -1.197) 10.980 14.317 ( -10.337 3.055 -0.798) 10.808 14.441 ( -0.354 -3.742 3.659) 5.245 15.579 ( 12.081 -3.471 0.222) 12.572 18.928 ( -0.290 11.065 -0.291) 11.072 19.175 ( -1.406 -1.622 7.177) 7.491 19.814 ( -6.741 -1.802 10.720) 12.791 21.044 ( -6.580 5.596 -8.122) 11.857 21.673 ( 11.661 -11.200 -7.749) 17.929 23.766 ( 3.122 1.356 0.151) 3.407 ======================= Grid point 397 (188/433) ======================= q-point: (-0.17 -0.42 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.947 ( -15.568 10.176 -2.649) 18.787 3.379 ( -11.821 -0.151 5.017) 12.842 4.206 ( -1.554 -8.298 -2.716) 8.868 5.089 ( 0.765 3.528 4.150) 5.501 6.518 ( 2.975 -3.531 5.821) 7.430 7.336 ( 1.235 7.557 -4.224) 8.745 7.816 ( 10.312 6.650 -11.660) 16.927 7.933 ( 3.001 -12.283 -0.488) 12.654 8.569 ( 0.875 -1.476 -8.355) 8.529 8.626 ( -7.344 -1.586 -1.434) 7.649 8.753 ( 0.821 -1.291 -2.518) 2.947 8.842 ( -7.868 -8.134 -12.550) 16.899 9.422 ( -4.432 -9.228 -17.294) 20.097 9.706 ( 9.942 1.464 6.458) 11.946 10.170 ( 1.147 5.797 -0.787) 5.961 10.504 ( -0.458 0.303 1.666) 1.754 10.987 ( -8.662 3.265 -3.084) 9.757 11.130 ( 1.365 -3.035 2.304) 4.047 11.263 ( 1.694 4.900 -4.429) 6.819 11.560 ( 1.078 1.179 4.661) 4.927 11.752 ( -0.280 -0.444 0.411) 0.667 11.949 ( -7.227 -6.046 -0.081) 9.423 12.335 ( -6.621 -1.324 -8.127) 10.566 12.992 ( 0.789 -2.448 -0.124) 2.575 13.510 ( 2.712 -3.360 3.551) 5.590 13.674 ( 0.914 -1.877 8.521) 8.773 13.789 ( 7.539 8.010 2.711) 11.329 14.143 ( -5.584 2.494 0.970) 6.192 14.480 ( 0.227 -0.787 2.661) 2.784 15.758 ( 6.818 -2.219 -4.932) 8.702 18.839 ( 1.151 10.577 2.392) 10.905 19.175 ( -2.085 0.965 -0.099) 2.299 19.796 ( -4.188 -0.682 13.157) 13.825 20.858 ( -11.147 -5.377 -2.663) 12.660 21.913 ( 13.124 -4.454 -9.030) 16.542 23.807 ( 3.671 2.486 0.824) 4.509 ======================= Grid point 398 (189/433) ======================= q-point: (-0.08 -0.42 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.566 ( -18.607 5.044 -3.384) 19.573 3.198 ( -15.599 -4.414 3.481) 16.581 4.186 ( -7.533 -7.120 -2.716) 10.715 5.120 ( 3.685 3.334 4.541) 6.732 6.635 ( 5.535 1.786 4.263) 7.211 7.216 ( -2.335 7.232 -7.643) 10.778 7.774 ( 4.524 10.490 -10.821) 15.735 8.125 ( 2.986 -15.150 0.509) 15.450 8.459 ( -11.262 0.646 -1.381) 11.365 8.614 ( 3.384 -5.654 -9.877) 11.874 8.780 ( 4.237 -2.819 -7.602) 9.148 8.831 ( 5.228 -8.369 -7.447) 12.363 9.316 ( -5.945 -9.206 -16.153) 19.519 9.777 ( -2.804 -0.427 -1.024) 3.015 10.208 ( 7.103 4.857 4.711) 9.810 10.477 ( -6.832 1.780 -0.067) 7.061 10.657 ( -7.522 8.501 -6.586) 13.123 11.092 ( -5.600 1.374 -6.596) 8.761 11.258 ( -0.664 1.843 -0.817) 2.123 11.590 ( -0.247 2.410 0.896) 2.583 11.806 ( 0.045 -7.414 8.003) 10.910 12.015 ( 4.865 -7.875 8.043) 12.263 12.199 ( -5.324 -3.424 -11.152) 12.823 13.085 ( 5.993 -1.293 2.428) 6.594 13.566 ( -0.451 0.051 2.762) 2.799 13.670 ( -1.625 6.765 4.024) 8.038 13.913 ( 8.209 -0.708 6.705) 10.623 14.114 ( 0.127 1.304 5.105) 5.270 14.519 ( 2.736 -0.536 2.144) 3.517 15.772 ( -0.575 0.768 -9.672) 9.719 18.758 ( -2.809 8.806 2.594) 9.601 19.119 ( 2.967 6.394 -3.552) 7.894 19.865 ( -1.527 -4.558 15.520) 16.248 20.738 ( -13.158 -12.255 0.226) 17.983 22.073 ( 11.229 1.215 -9.961) 15.060 23.849 ( 3.814 2.981 1.261) 5.003 ======================= Grid point 407 (190/433) ======================= q-point: (-0.33 -0.33 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 433 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.393 ( -9.926 0.000 6.470) 11.848 3.592 ( -13.933 0.000 -3.208) 14.298 3.994 ( 5.879 -0.000 -0.067) 5.880 5.141 ( -1.385 0.000 2.571) 2.920 6.367 ( -0.243 0.000 7.395) 7.399 7.366 ( 14.845 -0.000 -0.585) 14.856 7.735 ( 7.654 -0.000 -5.351) 9.339 7.766 ( -7.906 0.000 -0.112) 7.907 8.679 ( -4.313 0.000 -3.988) 5.874 8.725 ( 0.665 -0.000 -14.349) 14.365 8.780 ( -6.057 0.000 -12.043) 13.480 8.984 ( -11.649 0.000 -2.462) 11.907 9.423 ( 19.151 -0.000 15.712) 24.772 9.425 ( -1.165 0.000 -16.772) 16.812 10.386 ( -5.366 0.000 -0.424) 5.383 10.429 ( 4.401 -0.000 4.906) 6.591 10.710 ( 2.821 -0.000 4.775) 5.546 11.119 ( 8.164 -0.000 -0.935) 8.217 11.294 ( 5.895 -0.000 2.847) 6.547 11.700 ( 4.727 -0.000 -6.500) 8.037 11.880 ( -6.798 0.000 -12.178) 13.947 12.002 ( -12.580 0.000 1.652) 12.688 12.488 ( -7.265 0.000 -3.323) 7.989 13.009 ( -7.170 0.000 -2.817) 7.703 13.336 ( 0.202 -0.000 7.273) 7.276 13.517 ( 4.504 -0.000 4.703) 6.512 13.887 ( 4.909 -0.000 -1.951) 5.282 14.346 ( -11.046 0.000 -1.123) 11.103 14.390 ( 1.099 -0.000 6.696) 6.785 15.548 ( 13.290 -0.000 -0.398) 13.296 19.067 ( 3.603 -0.000 -5.190) 6.318 19.137 ( -7.329 0.000 11.894) 13.970 19.787 ( -5.348 0.000 13.987) 14.975 21.114 ( -16.928 0.000 -12.829) 21.240 21.549 ( 21.753 -0.000 -6.082) 22.588 23.779 ( 3.361 -0.000 0.466) 3.393 ======================= Grid point 408 (191/433) ======================= q-point: (-0.25 -0.33 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.157 ( -17.016 9.915 3.506) 20.004 3.347 ( -15.719 -3.602 1.394) 16.187 4.055 ( -0.695 -5.457 -4.290) 6.976 5.139 ( 0.991 1.464 1.543) 2.347 6.468 ( 6.209 -1.429 6.345) 8.992 7.492 ( 3.377 8.296 -1.062) 9.020 7.713 ( -0.865 -10.007 -2.012) 10.244 7.905 ( 16.676 2.328 -7.965) 18.627 8.542 ( -10.042 0.497 -10.472) 14.518 8.606 ( -1.750 -1.068 -6.302) 6.628 8.683 ( -1.213 -5.688 -14.178) 15.325 8.791 ( -6.860 1.802 -2.408) 7.490 9.288 ( -3.601 -4.022 -20.288) 20.994 9.737 ( 8.424 1.139 8.941) 12.337 10.293 ( 0.162 5.786 1.878) 6.085 10.490 ( 0.104 -1.553 0.994) 1.847 10.888 ( 6.570 -6.593 7.256) 11.802 11.148 ( -4.421 1.918 -0.904) 4.903 11.364 ( 1.599 3.225 -3.305) 4.887 11.641 ( -4.998 5.518 -3.990) 8.447 11.753 ( 1.551 0.847 -1.928) 2.615 11.833 ( -8.386 -6.123 0.510) 10.396 12.316 ( -8.837 -0.596 -9.435) 12.941 12.963 ( 1.608 -0.485 0.576) 1.776 13.432 ( 3.090 -3.417 7.412) 8.727 13.615 ( 1.369 -1.657 7.669) 7.964 13.937 ( 4.583 4.383 -0.950) 6.412 14.202 ( -3.387 2.871 0.611) 4.482 14.446 ( -0.540 -2.052 6.383) 6.727 15.731 ( 9.645 -0.608 -5.527) 11.132 19.020 ( -3.263 7.686 5.407) 9.947 19.147 ( 0.950 -3.592 -0.058) 3.716 19.794 ( -4.763 0.070 14.900) 15.643 20.776 ( -16.568 -2.486 -7.850) 18.502 21.858 ( 18.996 -1.373 -8.457) 20.839 23.841 ( 3.800 0.956 1.374) 4.153 ======================= Grid point 409 (192/433) ======================= q-point: (-0.17 -0.33 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 794 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.738 ( -21.569 11.715 2.213) 24.644 3.115 ( -19.612 -4.877 3.296) 20.477 4.020 ( -8.514 -8.781 -4.677) 13.095 5.175 ( 4.527 2.285 1.602) 5.319 6.655 ( 10.703 0.426 4.915) 11.785 7.379 ( -2.228 9.522 -6.549) 11.769 7.849 ( 1.519 -13.222 0.852) 13.336 7.971 ( 2.813 10.110 -9.645) 14.253 8.386 ( -7.667 -8.820 -5.896) 13.090 8.557 ( 0.839 -0.417 -10.420) 10.462 8.681 ( 6.759 -3.822 -10.779) 13.285 8.745 ( 4.292 -2.826 -4.401) 6.765 9.164 ( -2.298 -5.992 -18.273) 19.368 9.769 ( -5.588 -0.314 0.243) 5.603 10.334 ( 7.000 7.227 7.748) 12.699 10.486 ( -3.537 -0.426 -0.111) 3.565 10.828 ( -12.316 8.323 -6.115) 16.073 11.066 ( -5.346 -4.522 -3.718) 7.928 11.299 ( 0.764 2.079 -3.927) 4.508 11.626 ( 0.482 1.771 4.900) 5.232 11.706 ( -1.725 -2.607 7.588) 8.207 11.906 ( 6.167 -3.753 1.020) 7.291 12.134 ( -6.432 -3.031 -11.664) 13.660 13.056 ( 7.121 -1.339 1.662) 7.434 13.549 ( 1.316 -1.684 5.904) 6.279 13.656 ( -4.287 -3.979 7.995) 9.906 13.982 ( 6.290 3.897 1.455) 7.541 14.185 ( 3.634 6.210 3.891) 8.180 14.493 ( 0.218 -2.417 4.620) 5.218 15.789 ( 2.837 0.789 -10.570) 10.973 18.907 ( -6.823 6.224 6.144) 11.093 19.203 ( 6.315 2.181 -3.285) 7.445 19.813 ( -3.581 -0.932 14.781) 15.237 20.528 ( -16.308 -8.669 -2.426) 18.628 22.093 ( 15.661 0.810 -10.102) 18.654 23.898 ( 3.457 1.918 1.786) 4.338 ======================= Grid point 410 (193/433) ======================= q-point: (-0.08 -0.33 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.278 ( -23.359 8.453 4.166) 25.188 2.830 ( -23.184 -7.065 1.816) 24.305 3.895 ( -15.467 -11.817 -1.777) 19.545 5.256 ( 6.530 3.390 2.281) 7.703 6.814 ( 6.298 6.389 0.570) 8.989 7.182 ( -2.976 6.396 -8.854) 11.321 7.804 ( -2.891 2.263 -3.893) 5.351 8.063 ( 6.124 -8.665 2.176) 10.831 8.284 ( -6.299 0.137 -3.598) 7.256 8.492 ( -2.909 -6.539 -15.141) 16.747 8.797 ( 4.919 -10.576 -6.928) 13.566 8.957 ( 19.710 1.528 -8.316) 21.447 9.138 ( 5.594 -3.364 -9.926) 11.880 9.631 ( -10.696 -1.965 -1.645) 10.998 10.232 ( -15.841 7.609 -4.068) 18.039 10.447 ( 4.194 3.391 4.122) 6.788 10.625 ( -4.091 2.926 -0.589) 5.064 10.900 ( -10.224 -0.906 -8.104) 13.077 11.262 ( -0.647 3.785 -1.874) 4.273 11.628 ( 0.922 -0.054 0.157) 0.936 11.829 ( 4.178 -2.842 4.671) 6.881 12.037 ( -0.540 -2.561 -9.214) 9.578 12.112 ( 8.045 -8.001 9.481) 14.786 13.217 ( 8.753 -0.592 1.936) 8.984 13.544 ( -4.763 -0.202 5.949) 7.623 13.696 ( 0.075 -1.111 3.129) 3.321 14.089 ( 7.402 1.371 4.053) 8.550 14.202 ( 1.026 5.494 7.322) 9.212 14.575 ( 3.856 -2.599 3.521) 5.833 15.684 ( -4.004 2.976 -14.087) 14.945 18.744 ( -8.234 6.931 3.459) 11.305 19.277 ( 8.918 5.664 -2.152) 10.782 19.873 ( -3.220 -4.251 13.648) 14.653 20.358 ( -16.117 -13.285 -0.513) 20.893 22.248 ( 13.148 3.588 -9.838) 16.809 23.938 ( 2.504 2.271 1.825) 3.842 ======================= Grid point 420 (194/433) ======================= q-point: (-0.25 -0.25 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 432 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.931 ( -23.700 0.000 9.019) 25.358 3.007 ( -19.925 0.000 0.218) 19.926 3.920 ( -8.648 0.000 -6.824) 11.017 5.199 ( 5.033 -0.000 0.355) 5.045 6.658 ( 12.444 -0.000 5.126) 13.459 7.537 ( -5.065 0.000 -9.448) 10.720 7.656 ( 4.754 -0.000 4.539) 6.573 8.145 ( 12.223 -0.000 -8.361) 14.809 8.213 ( -16.731 0.000 -8.381) 18.713 8.544 ( -0.336 0.000 -14.742) 14.746 8.678 ( 13.906 -0.000 -8.677) 16.391 8.697 ( -3.542 0.000 -2.764) 4.493 9.104 ( -0.359 0.000 -18.994) 18.997 9.766 ( -6.706 0.000 0.699) 6.742 10.424 ( 5.400 -0.000 9.860) 11.242 10.476 ( -1.707 0.000 -1.240) 2.110 10.955 ( 0.371 -0.000 -3.488) 3.508 10.961 ( -16.360 0.000 -1.580) 16.436 11.322 ( -1.116 0.000 -7.614) 7.695 11.656 ( 2.829 -0.000 6.682) 7.256 11.680 ( -5.002 0.000 5.940) 7.765 11.870 ( 7.823 -0.000 -1.077) 7.897 12.101 ( -6.927 0.000 -11.843) 13.720 13.043 ( 6.792 -0.000 0.772) 6.836 13.521 ( 3.461 -0.000 8.223) 8.922 13.617 ( -5.753 0.000 7.337) 9.323 14.015 ( 4.794 -0.000 1.575) 5.046 14.277 ( 7.218 -0.000 0.774) 7.260 14.449 ( -2.758 0.000 7.634) 8.117 15.797 ( 4.101 -0.000 -10.978) 11.719 18.973 ( -9.503 0.000 8.516) 12.760 19.218 ( 8.743 -0.000 -3.395) 9.379 19.810 ( -4.228 0.000 14.236) 14.851 20.439 ( -17.359 0.000 -3.880) 17.788 22.101 ( 17.094 -0.000 -10.208) 19.910 23.917 ( 3.355 -0.000 1.970) 3.891 ======================= Grid point 421 (195/433) ======================= q-point: (-0.17 -0.25 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.486 ( -26.643 10.729 9.916) 30.386 2.707 ( -24.328 -6.228 4.194) 25.460 3.689 ( -18.640 -7.310 -5.200) 20.687 5.310 ( 8.575 1.742 0.421) 8.760 6.901 ( 12.903 2.356 3.537) 13.585 7.284 ( -12.546 3.456 -14.248) 19.297 7.791 ( 2.950 -1.972 3.847) 5.234 7.991 ( -0.090 -0.058 -0.339) 0.356 8.243 ( 2.830 -3.199 -6.018) 7.380 8.406 ( -4.497 -2.372 -19.444) 20.097 8.655 ( -0.900 -3.253 -2.306) 4.088 8.939 ( 14.374 -1.774 -10.078) 17.644 9.124 ( 18.930 0.611 -10.647) 21.727 9.605 ( -12.436 -0.687 0.797) 12.481 10.355 ( -10.624 3.664 -7.271) 13.385 10.506 ( -1.458 2.165 6.097) 6.632 10.683 ( -9.225 2.748 1.721) 9.778 10.861 ( -6.812 -2.302 -8.229) 10.928 11.322 ( 3.502 1.721 -3.968) 5.565 11.611 ( -6.372 -0.824 1.643) 6.632 11.789 ( 5.686 -1.254 8.494) 10.298 12.006 ( 2.794 -0.661 -7.407) 7.944 12.019 ( 8.048 -2.030 2.586) 8.694 13.188 ( 9.407 -1.538 0.007) 9.532 13.541 ( -6.536 -0.003 6.213) 9.018 13.633 ( 1.464 -2.884 7.604) 8.263 14.119 ( 5.875 1.003 3.068) 6.703 14.352 ( 1.954 8.617 5.796) 10.568 14.496 ( 2.697 -5.848 4.461) 7.834 15.726 ( -2.328 1.237 -15.530) 15.752 18.849 ( -8.536 3.230 5.659) 10.739 19.344 ( 8.607 1.469 -1.910) 8.938 19.827 ( -3.316 -0.698 11.633) 12.117 20.166 ( -17.477 -5.777 0.091) 18.407 22.295 ( 14.656 1.277 -10.679) 18.179 23.971 ( 2.100 0.924 1.971) 3.024 ======================= Grid point 422 (196/433) ======================= q-point: (-0.08 -0.25 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.020 ( -25.547 10.241 15.712) 31.692 2.351 ( -27.958 -5.725 4.123) 28.835 3.408 ( -26.423 -16.933 0.713) 31.391 5.424 ( 7.588 4.617 -0.211) 8.884 6.789 ( -13.911 8.256 -12.699) 20.565 7.230 ( 9.514 -4.303 1.634) 10.569 7.837 ( 5.881 6.059 2.192) 8.723 8.134 ( 5.047 -3.340 -2.672) 6.616 8.212 ( -4.130 0.112 -4.475) 6.090 8.311 ( 6.147 -3.767 -10.420) 12.671 8.718 ( 2.354 -10.964 -2.436) 11.475 9.064 ( 7.464 -4.131 -6.099) 10.487 9.400 ( -14.016 -1.846 1.928) 14.268 9.495 ( 29.779 6.740 -6.990) 31.322 10.007 ( -14.296 8.835 -8.936) 19.034 10.441 ( -7.582 -5.809 -2.901) 9.982 10.602 ( -2.709 6.381 7.343) 10.099 10.723 ( -6.653 0.755 -3.531) 7.570 11.293 ( 0.119 5.700 -2.528) 6.237 11.564 ( -1.285 -6.291 -5.522) 8.469 11.928 ( 6.292 0.632 0.894) 6.386 12.072 ( 8.252 0.821 -2.029) 8.538 12.228 ( 7.534 -6.924 8.653) 13.400 13.368 ( 9.635 -2.042 -0.661) 9.871 13.490 ( -4.713 -1.093 6.467) 8.077 13.703 ( -0.612 -1.409 4.817) 5.056 14.214 ( 2.931 2.471 1.741) 4.211 14.297 ( -1.689 3.771 7.773) 8.803 14.659 ( 7.010 -2.715 5.663) 9.411 15.523 ( -7.243 2.673 -17.103) 18.765 18.702 ( -6.705 6.489 3.834) 10.088 19.432 ( 4.853 2.449 -1.566) 5.657 19.846 ( -3.729 -1.933 7.532) 8.624 19.973 ( -15.644 -11.567 0.900) 19.477 22.444 ( 13.304 3.166 -8.957) 16.348 23.992 ( 0.461 1.377 1.761) 2.283 ======================= Grid point 433 (197/433) ======================= q-point: (-0.17 -0.17 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 433 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.151 ( -29.353 0.000 17.787) 34.321 2.302 ( -25.330 0.000 8.704) 26.784 3.210 ( -30.897 0.000 -2.446) 30.994 5.476 ( 9.478 -0.000 -1.597) 9.612 6.900 ( -19.263 0.000 -16.449) 25.331 7.147 ( 10.526 -0.000 4.049) 11.278 7.950 ( 10.317 -0.000 1.936) 10.497 8.051 ( 9.024 -0.000 5.271) 10.450 8.175 ( -5.578 0.000 -20.273) 21.026 8.318 ( 9.196 -0.000 -1.437) 9.307 8.606 ( -2.247 0.000 1.152) 2.525 9.016 ( 8.078 -0.000 -9.678) 12.607 9.384 ( -15.020 0.000 4.581) 15.703 9.559 ( 30.700 -0.000 -6.824) 31.449 10.139 ( -9.719 0.000 -12.984) 16.219 10.340 ( -12.406 0.000 -1.744) 12.528 10.674 ( -2.515 0.000 9.928) 10.242 10.730 ( -5.633 0.000 -2.968) 6.367 11.395 ( 6.838 -0.000 -6.038) 9.123 11.454 ( -8.474 0.000 -3.141) 9.038 11.934 ( 7.226 -0.000 4.415) 8.468 12.082 ( 7.971 -0.000 -1.785) 8.168 12.162 ( 7.328 -0.000 4.728) 8.721 13.327 ( 7.745 -0.000 -0.711) 7.778 13.483 ( -3.253 0.000 5.742) 6.599 13.683 ( -0.120 0.000 7.413) 7.414 14.224 ( 4.624 -0.000 1.056) 4.743 14.375 ( -7.458 0.000 7.250) 10.401 14.619 ( 9.834 -0.000 6.409) 11.739 15.550 ( -6.880 0.000 -18.620) 19.851 18.773 ( -5.933 0.000 4.107) 7.216 19.457 ( 4.445 -0.000 -0.562) 4.481 19.834 ( -1.859 0.000 5.098) 5.426 19.846 ( -18.664 0.000 2.533) 18.835 22.475 ( 13.829 -0.000 -9.572) 16.818 24.006 ( 0.277 -0.000 1.734) 1.756 ======================= Grid point 434 (198/433) ======================= q-point: (-0.08 -0.17 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.822 ( -23.295 5.208 28.150) 36.908 1.892 ( -29.573 3.063 10.406) 31.500 2.718 ( -37.348 -18.697 7.187) 42.380 5.549 ( 3.106 3.931 -6.499) 8.207 6.510 ( -13.544 2.580 -12.603) 18.680 7.314 ( 3.913 -5.302 0.301) 6.596 7.993 ( -0.731 -0.631 -13.018) 13.053 8.108 ( 10.670 6.324 -3.674) 12.936 8.310 ( 13.104 4.094 8.681) 16.243 8.471 ( 6.999 4.560 0.140) 8.355 8.669 ( 6.488 -11.967 5.972) 14.865 9.126 ( 8.610 -4.041 -5.316) 10.896 9.184 ( -12.424 -0.395 6.162) 13.873 9.756 ( -5.368 1.285 -10.658) 12.003 10.055 ( 13.444 12.253 -3.558) 18.534 10.258 ( 4.316 -8.301 -2.312) 9.638 10.604 ( -7.172 2.475 -0.688) 7.618 10.653 ( -4.994 3.059 9.514) 11.172 11.308 ( -1.913 3.376 -3.090) 4.961 11.503 ( 5.877 -3.925 -5.928) 9.224 12.053 ( 7.616 2.434 -3.562) 8.753 12.216 ( 8.377 -1.004 -0.084) 8.438 12.326 ( 5.685 -4.934 6.659) 10.050 13.393 ( -2.936 -3.453 4.942) 6.706 13.545 ( 8.076 0.205 -1.349) 8.190 13.700 ( -3.176 -0.125 5.913) 6.713 14.237 ( -7.380 5.356 3.973) 9.946 14.308 ( 0.835 -3.370 0.543) 3.514 14.812 ( 6.152 -0.332 3.825) 7.252 15.335 ( -3.296 0.930 -8.490) 9.155 18.701 ( -2.686 5.042 3.451) 6.674 19.439 ( -7.131 4.343 -0.951) 8.403 19.632 ( -11.961 -12.914 2.518) 17.782 19.795 ( -4.631 0.169 -3.427) 5.763 22.646 ( 13.888 2.013 -6.544) 15.484 24.001 ( -1.592 0.620 1.396) 2.207 ======================= Grid point 446 (199/433) ======================= q-point: (-0.08 -0.08 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 432 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.587 ( -26.768 0.000 20.524) 33.731 1.594 ( -27.195 0.000 21.336) 34.566 2.079 ( -30.430 0.000 33.742) 45.437 5.473 ( -7.453 0.000 -13.736) 15.628 6.307 ( -4.601 0.000 -5.726) 7.346 7.248 ( -4.244 0.000 -10.826) 11.629 7.994 ( 7.244 -0.000 0.009) 7.244 8.277 ( 8.479 -0.000 -4.962) 9.824 8.407 ( -7.355 0.000 -1.116) 7.439 8.788 ( 13.391 -0.000 0.964) 13.426 8.791 ( 13.019 -0.000 4.406) 13.744 9.089 ( -2.137 0.000 9.608) 9.843 9.211 ( 6.510 -0.000 -2.697) 7.047 9.633 ( 1.044 -0.000 -8.819) 8.881 10.121 ( 3.123 -0.000 9.670) 10.162 10.396 ( -4.961 0.000 2.091) 5.383 10.587 ( -10.878 0.000 11.658) 15.945 10.697 ( 22.542 -0.000 -4.003) 22.894 11.333 ( 5.815 -0.000 0.055) 5.815 11.569 ( 6.101 -0.000 -3.632) 7.101 12.156 ( 6.626 -0.000 -8.404) 10.702 12.315 ( 5.882 -0.000 -2.634) 6.444 12.416 ( 4.636 -0.000 4.592) 6.525 13.350 ( -4.346 0.000 5.518) 7.024 13.642 ( 4.386 -0.000 -6.153) 7.556 13.654 ( -6.708 0.000 5.283) 8.539 14.134 ( -10.892 0.000 5.574) 12.236 14.265 ( -3.206 0.000 -4.624) 5.627 14.726 ( -6.187 0.000 -19.460) 20.420 15.615 ( 29.646 -0.000 31.702) 43.404 18.746 ( 2.132 -0.000 3.481) 4.082 19.226 ( -19.834 0.000 0.917) 19.855 19.424 ( -5.319 0.000 -7.306) 9.037 19.596 ( -15.281 0.000 -7.240) 16.909 22.861 ( 14.114 -0.000 -3.982) 14.665 23.967 ( -3.735 0.000 0.817) 3.824 ======================= Grid point 447 (200/433) ======================= q-point: ( 0.00 0.00 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 433 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.778 ( -5.357 0.000 24.467) 25.046 1.884 ( 12.385 -0.000 24.432) 27.392 3.234 ( 3.021 -0.000 34.764) 34.895 4.932 ( -1.859 0.000 -3.313) 3.799 6.558 ( -3.773 0.000 -15.068) 15.533 6.812 ( 13.922 -0.000 22.100) 26.120 8.041 ( -8.506 0.000 -1.599) 8.655 8.197 ( 1.883 -0.000 -5.829) 6.125 8.412 ( -8.853 0.000 1.747) 9.024 8.614 ( 3.187 -0.000 6.000) 6.794 8.925 ( -3.050 0.000 5.913) 6.653 9.498 ( 6.921 -0.000 8.304) 10.810 9.577 ( 9.398 -0.000 6.217) 11.268 9.934 ( 13.432 -0.000 -6.356) 14.860 10.089 ( -11.222 0.000 -2.335) 11.462 10.325 ( 7.224 -0.000 -1.840) 7.455 11.030 ( 10.245 -0.000 1.254) 10.321 11.246 ( 4.185 -0.000 2.319) 4.785 11.620 ( 4.088 -0.000 -3.761) 5.555 11.831 ( 3.974 -0.000 4.043) 5.669 12.017 ( -1.554 0.000 0.315) 1.586 12.197 ( 3.225 -0.000 -7.502) 8.166 12.498 ( 0.647 -0.000 -4.235) 4.284 12.910 ( -12.841 0.000 -0.253) 12.844 13.352 ( -13.021 0.000 -2.047) 13.181 13.463 ( -1.231 0.000 -3.709) 3.908 13.990 ( -4.491 0.000 4.321) 6.232 14.002 ( -5.059 0.000 -5.452) 7.438 14.226 ( 7.953 -0.000 -14.558) 16.589 17.895 ( 5.223 -0.000 7.632) 9.248 18.562 ( -18.893 0.000 -0.285) 18.896 18.648 ( 13.643 -0.000 1.757) 13.755 19.063 ( 13.037 -0.000 1.202) 13.093 19.270 ( -6.859 0.000 -0.928) 6.922 23.129 ( 3.872 -0.000 0.794) 3.953 23.828 ( -4.235 0.000 0.465) 4.261 ======================= Grid point 448 (201/433) ======================= q-point: ( 0.08 0.00 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.992 ( 5.016 -12.195 21.487) 25.211 2.363 ( 25.105 -4.864 16.222) 30.283 3.488 ( 4.274 -0.359 28.504) 28.825 4.944 ( 3.572 -0.907 -1.104) 3.847 6.457 ( -0.468 -3.893 -12.490) 13.091 7.189 ( 15.086 0.810 21.714) 26.453 7.844 ( -7.202 9.005 -0.685) 11.551 8.147 ( -8.236 -0.815 -2.939) 8.783 8.400 ( 2.641 -4.381 0.555) 5.146 8.541 ( -9.000 -1.110 3.612) 9.761 9.073 ( 10.449 -1.930 5.068) 11.773 9.612 ( 2.343 4.234 6.042) 7.741 9.726 ( 2.389 -5.653 3.539) 7.085 9.869 ( -5.558 8.678 0.125) 10.306 10.031 ( 4.071 -0.057 -4.386) 5.985 10.528 ( 14.354 -1.132 -6.991) 16.006 11.131 ( -2.919 6.465 1.772) 7.312 11.203 ( -0.576 0.362 -1.020) 1.226 11.637 ( 0.610 4.141 -0.320) 4.198 11.810 ( -3.284 1.079 -1.636) 3.824 12.006 ( -0.951 1.867 5.067) 5.483 12.179 ( 1.692 2.051 -7.383) 7.847 12.535 ( -0.883 -9.367 -7.334) 11.930 12.841 ( 3.794 2.833 4.169) 6.309 13.111 ( -10.581 1.503 -1.429) 10.783 13.454 ( -2.162 -6.855 -2.546) 7.626 13.873 ( -8.806 -2.604 -4.326) 10.151 13.983 ( 0.699 0.288 4.450) 4.514 14.280 ( 8.547 0.061 -13.989) 16.394 17.539 ( -23.645 21.070 11.584) 33.723 18.300 ( -15.172 -4.289 1.155) 15.809 19.020 ( 0.464 -9.953 -5.807) 11.532 19.287 ( 20.662 1.914 -0.612) 20.759 19.410 ( 20.849 -9.463 -0.517) 22.902 23.139 ( -1.019 4.131 1.360) 4.466 23.756 ( -4.524 0.287 -0.061) 4.534 ======================= Grid point 449 (202/433) ======================= q-point: ( 0.17 0.00 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 794 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.348 ( 9.783 -10.395 14.696) 20.487 2.924 ( 21.124 -10.077 11.907) 26.259 3.729 ( 7.040 -1.557 18.211) 19.587 5.022 ( 4.229 -0.184 1.004) 4.351 6.467 ( 2.963 -7.217 -9.429) 12.238 7.507 ( 7.940 1.011 6.253) 10.157 7.654 ( -2.776 10.188 4.615) 11.524 7.927 ( -14.599 -0.296 2.775) 14.864 8.401 ( -1.693 3.488 4.997) 6.325 8.632 ( 9.403 -7.178 -0.767) 11.855 9.213 ( 1.026 -2.510 -4.600) 5.339 9.527 ( -6.686 5.903 1.863) 9.112 9.778 ( 2.590 3.830 3.586) 5.851 9.886 ( 4.766 -4.977 4.718) 8.351 10.051 ( 3.223 2.064 -6.801) 7.804 10.566 ( -6.383 7.148 -5.821) 11.213 10.948 ( -1.901 2.521 -5.737) 6.549 11.241 ( 0.823 -1.277 -0.577) 1.625 11.530 ( -4.703 9.755 -0.354) 10.835 11.703 ( -5.621 2.296 -3.032) 6.786 12.046 ( 3.533 3.434 9.875) 11.035 12.201 ( 5.347 -2.524 -2.300) 6.344 12.531 ( -1.170 -4.981 -8.926) 10.289 12.789 ( -5.521 5.909 -1.130) 8.165 13.129 ( 7.073 -3.637 5.228) 9.517 13.493 ( -2.759 -10.974 0.629) 11.333 13.705 ( -11.664 -2.485 -2.712) 12.230 14.048 ( 4.130 0.532 4.025) 5.791 14.337 ( 8.061 0.180 -12.901) 15.214 17.024 ( -22.204 20.100 11.527) 32.091 18.157 ( -9.355 -6.765 1.770) 11.680 18.989 ( -5.969 -7.757 -4.525) 10.783 19.591 ( 18.029 2.261 -0.556) 18.178 19.903 ( 23.560 -11.146 -1.469) 26.105 23.029 ( -5.589 8.609 -0.257) 10.267 23.675 ( -4.431 -0.011 -0.780) 4.499 ======================= Grid point 450 (203/433) ======================= q-point: ( 0.25 0.00 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.647 ( 9.586 -3.632 5.997) 11.877 3.342 ( 8.081 -9.259 14.065) 18.678 3.974 ( 10.184 -4.364 4.970) 12.143 5.076 ( 0.840 0.798 3.207) 3.410 6.572 ( 5.781 -8.928 -6.278) 12.350 7.338 ( -14.181 7.560 -1.263) 16.120 7.527 ( -9.424 -0.277 -9.707) 13.532 8.008 ( 13.613 1.872 13.969) 19.594 8.395 ( 1.941 4.408 4.120) 6.338 8.843 ( 9.400 -0.966 -0.916) 9.494 9.102 ( -10.856 -5.117 -11.105) 16.351 9.399 ( -2.744 5.352 3.536) 6.977 9.806 ( 3.996 5.903 -1.241) 7.236 9.999 ( 1.185 3.921 -13.136) 13.760 10.032 ( -0.287 0.827 9.845) 9.884 10.242 ( -13.244 2.535 -4.671) 14.271 10.915 ( -1.113 -3.906 -12.897) 13.522 11.203 ( -5.817 0.227 -1.699) 6.064 11.362 ( -0.348 9.678 -1.209) 9.759 11.574 ( -5.008 2.816 0.057) 5.745 12.152 ( 5.604 5.356 11.660) 14.001 12.352 ( 8.197 0.479 2.564) 8.602 12.497 ( -1.045 -4.359 -9.174) 10.210 12.668 ( -4.185 0.387 2.822) 5.062 13.303 ( 7.085 -1.572 -0.757) 7.297 13.505 ( -8.286 0.237 0.741) 8.322 13.601 ( -4.362 -14.464 6.477) 16.437 14.148 ( 5.903 1.437 4.192) 7.381 14.379 ( 5.667 0.541 -11.060) 12.439 16.556 ( -19.640 16.494 6.597) 26.482 18.142 ( -2.827 -8.617 1.755) 9.238 18.947 ( -5.430 -8.420 -3.899) 10.751 19.837 ( 14.922 4.535 2.431) 15.785 20.370 ( 20.269 -10.489 1.211) 22.854 22.781 ( -10.640 12.371 -3.588) 16.707 23.615 ( -2.389 -1.055 -0.705) 2.705 ======================= Grid point 451 (204/433) ======================= q-point: ( 0.33 0.00 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 794 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.779 ( 3.576 2.546 -1.433) 4.617 3.546 ( -0.830 -4.114 13.539) 14.175 4.179 ( 6.982 -5.748 -2.843) 9.480 5.079 ( -2.021 0.415 4.826) 5.248 6.743 ( 7.059 -8.809 -2.595) 11.583 7.005 ( -15.819 5.035 0.004) 16.601 7.342 ( -5.985 -2.608 -13.064) 14.604 8.249 ( 11.788 7.508 -1.876) 14.101 8.452 ( 7.232 0.861 3.836) 8.232 8.795 ( -13.325 -3.427 -8.279) 16.057 8.988 ( 2.341 5.687 -1.047) 6.238 9.332 ( -5.360 4.594 -1.493) 7.215 9.764 ( 2.063 9.075 -3.631) 9.990 9.842 ( -3.594 4.397 -6.839) 8.889 9.885 ( -5.205 4.655 -4.187) 8.142 10.262 ( 2.709 -9.126 0.572) 9.536 10.753 ( -10.066 -2.034 -15.225) 18.365 11.134 ( 0.381 2.796 1.530) 3.210 11.304 ( -0.510 3.004 -0.135) 3.050 11.499 ( -2.450 -0.478 -0.580) 2.563 12.230 ( 1.135 5.014 7.418) 9.026 12.342 ( -1.705 6.437 -6.337) 9.192 12.474 ( -1.117 5.363 5.814) 7.989 12.781 ( 6.929 -10.813 5.925) 14.144 13.301 ( -6.214 -5.088 -4.483) 9.198 13.493 ( 5.749 2.722 4.458) 7.767 13.752 ( -0.239 -12.389 9.570) 15.657 14.255 ( 4.084 2.087 6.518) 7.970 14.378 ( 4.161 1.883 -10.077) 11.064 16.142 ( -15.945 11.455 -0.431) 19.638 18.243 ( 2.682 -9.885 1.692) 10.381 18.920 ( -5.037 -8.336 -3.179) 10.245 20.032 ( 11.027 5.520 7.358) 14.360 20.783 ( 16.815 -7.749 3.435) 18.831 22.408 ( -14.304 13.942 -7.676) 21.398 23.617 ( 1.071 -2.338 -0.003) 2.572 ======================= Grid point 452 (205/433) ======================= q-point: ( 0.42 0.00 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.703 ( -5.357 5.358 -4.412) 8.768 3.555 ( -7.139 1.872 7.292) 10.375 4.269 ( 0.518 -3.784 -2.557) 4.596 5.086 ( -0.444 -1.234 4.681) 4.861 6.734 ( -11.221 1.604 4.200) 12.089 6.929 ( 4.261 -7.033 -7.067) 10.842 7.256 ( 1.266 -7.085 -10.914) 13.073 8.244 ( 5.322 8.423 -12.040) 15.628 8.557 ( -12.854 -3.739 -3.895) 13.942 8.608 ( 7.808 0.803 -4.381) 8.989 8.935 ( 0.321 10.052 0.874) 10.095 9.067 ( -10.011 10.871 -6.520) 16.152 9.556 ( -6.386 12.210 -12.944) 18.905 9.752 ( -1.611 0.709 -7.261) 7.472 9.953 ( 9.339 -6.258 4.884) 12.257 10.403 ( 4.291 -5.640 1.452) 7.233 10.510 ( -9.675 -0.223 -12.031) 15.440 11.128 ( -1.736 1.368 3.248) 3.929 11.272 ( -0.953 0.882 -0.855) 1.555 11.487 ( -0.356 -2.705 -1.428) 3.079 12.124 ( -9.081 5.876 1.673) 10.945 12.194 ( -3.491 2.469 -11.531) 12.298 12.484 ( 3.892 11.646 16.012) 20.178 13.033 ( 6.558 -6.374 5.789) 10.824 13.274 ( -1.692 -8.420 -0.369) 8.596 13.597 ( 2.305 -3.480 3.863) 5.687 13.925 ( 4.838 -4.163 8.227) 10.412 14.258 ( -3.435 1.853 3.275) 5.095 14.434 ( 9.161 2.667 -2.687) 9.912 15.813 ( -11.310 5.476 -6.634) 14.209 18.421 ( 5.129 -10.370 1.194) 11.631 18.904 ( -3.777 -7.490 -1.680) 8.555 20.182 ( 6.452 5.798 11.747) 14.602 21.084 ( 8.700 -1.269 5.970) 10.628 21.993 ( -11.361 10.602 -12.637) 20.029 23.691 ( 3.949 -3.216 0.634) 5.132 ======================= Grid point 453 (206/433) ======================= q-point: (-0.50 0.00 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 794 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.483 ( -12.303 3.428 -2.158) 12.952 3.365 ( -13.954 6.169 1.992) 15.387 4.248 ( -4.395 0.412 1.152) 4.563 5.147 ( 3.025 -1.750 2.937) 4.565 6.636 ( -3.574 -3.251 1.119) 4.959 6.921 ( -3.301 -4.976 -9.807) 11.482 7.416 ( 9.291 -11.046 -3.175) 14.779 8.177 ( 2.093 0.643 -15.430) 15.585 8.395 ( -4.266 2.550 -2.110) 5.399 8.555 ( -3.555 7.796 -10.222) 13.338 8.813 ( -0.730 11.273 -5.855) 12.724 8.883 ( 2.661 6.260 -2.987) 7.429 9.284 ( -3.930 10.579 -6.712) 13.130 9.656 ( -4.374 -1.375 -9.261) 10.334 10.228 ( 6.934 -7.883 -0.790) 10.528 10.291 ( -5.293 2.059 -2.627) 6.258 10.520 ( 2.223 -3.921 1.310) 4.694 11.056 ( -8.772 0.834 2.982) 9.303 11.231 ( -1.828 1.308 -1.183) 2.540 11.517 ( 1.561 -3.202 -1.523) 3.873 11.959 ( -3.846 3.596 0.255) 5.272 12.032 ( -4.791 2.634 -10.155) 11.533 12.537 ( 4.421 12.424 15.964) 20.706 13.165 ( 2.928 -1.210 4.872) 5.812 13.394 ( 2.746 -11.628 -1.503) 12.042 13.654 ( -5.209 -6.916 5.457) 10.234 14.095 ( 11.814 4.564 3.961) 13.270 14.228 ( -2.841 -1.529 6.465) 7.225 14.548 ( 8.166 2.476 -0.233) 8.536 15.573 ( -8.287 0.720 -10.294) 13.235 18.576 ( 0.443 -9.136 -0.874) 9.188 18.955 ( 2.841 -7.234 1.383) 7.894 20.267 ( 1.046 6.077 13.827) 15.140 21.044 ( -12.479 11.779 4.830) 17.827 21.823 ( 7.380 -1.326 -13.140) 15.129 23.802 ( 4.804 -3.197 0.588) 5.801 ======================= Grid point 454 (207/433) ======================= q-point: (-0.42 0.00 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.247 ( -15.334 -2.402 4.040) 16.039 3.027 ( -19.216 8.172 3.341) 21.147 4.121 ( -9.272 6.697 4.265) 12.207 5.246 ( 5.193 -1.490 1.387) 5.578 6.612 ( -6.443 -5.404 -5.615) 10.112 6.921 ( 5.170 -7.805 -6.188) 11.223 7.644 ( 6.037 -8.609 1.312) 10.597 8.091 ( -3.022 -1.109 -9.416) 9.951 8.320 ( 0.658 10.576 -8.213) 13.407 8.380 ( 0.641 5.871 -7.248) 9.350 8.734 ( 10.487 2.412 -9.971) 14.670 8.879 ( 5.591 6.981 -3.368) 9.557 9.177 ( 3.300 6.248 -0.311) 7.073 9.523 ( -6.476 -0.507 -7.849) 10.188 10.047 ( -11.549 0.558 -6.719) 13.373 10.466 ( 4.628 -3.725 4.812) 7.645 10.572 ( -1.611 -4.198 1.979) 4.913 10.863 ( -13.431 1.215 1.902) 13.619 11.196 ( -0.378 0.168 -0.938) 1.025 11.573 ( 2.353 -2.241 -2.749) 4.256 11.886 ( -2.168 2.460 -7.893) 8.547 11.946 ( 3.006 0.667 3.094) 4.365 12.581 ( 4.432 11.774 12.836) 17.973 13.258 ( 4.332 -1.468 2.715) 5.319 13.516 ( 1.447 -8.875 -3.201) 9.545 13.644 ( -6.792 -7.017 4.915) 10.933 14.247 ( -3.263 -4.379 7.307) 9.122 14.281 ( 13.894 8.647 3.292) 16.693 14.651 ( 6.954 1.758 -0.022) 7.173 15.387 ( -7.198 -1.505 -10.648) 12.940 18.601 ( -4.567 -7.104 -1.445) 8.568 19.139 ( 8.313 -6.640 1.382) 10.729 20.255 ( -5.405 6.476 13.405) 15.838 20.650 ( -18.492 13.466 1.134) 22.904 21.986 ( 14.085 -4.097 -9.027) 17.224 23.904 ( 3.725 -2.442 -0.180) 4.457 ======================= Grid point 455 (208/433) ======================= q-point: (-0.33 0.00 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 794 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.064 ( -18.551 -7.894 8.327) 21.813 2.668 ( -18.734 7.972 14.308) 24.884 3.844 ( -16.201 14.870 7.401) 23.203 5.348 ( 4.107 -1.896 -0.632) 4.568 6.462 ( -10.134 -3.515 -6.922) 12.766 7.139 ( 12.300 -9.148 -6.812) 16.774 7.787 ( 4.388 -2.779 1.107) 5.311 8.049 ( -4.175 4.428 -4.797) 7.749 8.085 ( -0.514 0.310 -7.833) 7.856 8.408 ( 10.395 7.929 0.842) 13.101 8.835 ( 7.028 7.675 -6.156) 12.091 9.027 ( 17.470 -4.082 -8.120) 19.693 9.278 ( 11.428 -3.528 1.862) 12.104 9.363 ( -6.508 1.672 -4.291) 7.973 9.810 ( -11.801 1.094 -3.412) 12.333 10.489 ( -5.516 0.794 0.345) 5.583 10.603 ( -4.415 -6.992 6.275) 10.381 10.683 ( -7.516 -2.033 2.564) 8.198 11.203 ( 1.032 -0.960 -0.421) 1.471 11.545 ( -1.521 3.539 -5.406) 6.638 11.861 ( 3.583 -1.284 -4.069) 5.572 12.071 ( 7.920 -1.924 4.615) 9.366 12.611 ( 4.474 11.109 8.662) 14.781 13.364 ( 6.122 -0.735 -0.991) 6.245 13.560 ( -2.964 -3.932 -0.404) 4.940 13.653 ( -3.430 -9.523 1.980) 10.314 14.249 ( -6.045 -3.605 6.615) 9.659 14.408 ( 9.387 9.291 -1.191) 13.261 14.742 ( 5.044 0.940 -3.608) 6.272 15.266 ( -1.757 -1.933 -1.822) 3.185 18.581 ( -4.152 -6.290 -0.878) 7.588 19.312 ( 5.859 -3.006 -3.145) 7.298 20.107 ( -14.352 5.843 10.279) 18.595 20.265 ( -13.535 11.244 2.753) 17.810 22.222 ( 15.026 -4.072 -6.427) 16.842 23.964 ( 1.725 -1.520 -1.215) 2.601 ======================= Grid point 456 (209/433) ======================= q-point: (-0.25 0.00 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.842 ( -24.421 -9.596 10.301) 28.188 2.486 ( -11.130 6.155 28.856) 31.535 3.395 ( -22.649 21.927 12.715) 33.992 5.375 ( -1.855 -1.505 -4.980) 5.524 6.320 ( -5.279 -0.839 -0.863) 5.414 7.256 ( 0.588 1.043 -15.361) 15.407 7.866 ( 5.090 -0.459 -8.215) 9.675 7.932 ( 5.239 0.737 4.831) 7.164 8.269 ( 7.856 -15.203 5.083) 17.852 8.522 ( 11.270 10.739 0.030) 15.568 8.858 ( 5.886 4.068 -0.032) 7.155 9.175 ( -5.666 2.408 -0.688) 6.195 9.239 ( 8.247 -0.203 -2.674) 8.672 9.609 ( -8.495 1.536 -2.403) 8.960 9.703 ( 21.954 -13.895 -2.663) 26.118 10.392 ( -1.175 2.660 2.637) 3.925 10.534 ( -9.088 -4.096 0.454) 9.979 10.747 ( -0.876 -8.735 10.875) 13.977 11.229 ( 1.050 -1.031 -0.623) 1.598 11.466 ( 2.495 4.328 -5.567) 7.480 11.930 ( 3.930 -2.793 -2.480) 5.422 12.255 ( 8.560 -0.443 2.766) 9.007 12.613 ( 3.419 10.588 4.788) 12.113 13.440 ( 2.671 -0.616 -3.864) 4.737 13.516 ( -4.590 -3.392 -0.865) 5.773 13.718 ( -0.607 -6.408 2.631) 6.954 14.192 ( -9.044 -4.260 3.575) 10.618 14.397 ( 3.451 9.892 -5.302) 11.742 14.652 ( -6.375 2.859 -15.169) 16.701 15.475 ( 17.441 -4.466 18.795) 26.027 18.588 ( -1.371 -6.160 -0.654) 6.344 19.311 ( -3.176 1.423 -8.069) 8.788 19.839 ( -15.842 4.758 5.636) 17.474 19.988 ( -11.758 10.580 4.366) 16.408 22.485 ( 15.232 -4.509 -3.457) 16.257 23.977 ( -0.368 -0.866 -1.930) 2.147 ======================= Grid point 457 (210/433) ======================= q-point: (-0.17 0.00 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 794 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.632 ( -21.689 -11.286 19.407) 31.215 2.392 ( -14.223 17.095 25.874) 34.117 2.956 ( -15.503 14.475 27.569) 34.784 5.250 ( -7.860 0.720 -8.402) 11.528 6.321 ( 2.545 0.292 8.445) 8.825 7.027 ( -7.077 6.555 -17.881) 20.317 7.960 ( 2.916 -11.120 -7.092) 13.507 8.107 ( 11.192 1.789 5.332) 12.526 8.527 ( 3.861 12.574 -0.727) 13.173 8.625 ( 7.185 -14.327 6.621) 17.341 8.925 ( 2.530 -0.720 4.829) 5.499 9.062 ( -7.396 -5.420 2.816) 9.592 9.396 ( 11.547 7.200 1.747) 13.720 9.491 ( 2.689 2.172 -6.212) 7.109 10.087 ( 8.975 -12.546 -3.216) 15.758 10.401 ( -5.055 -0.872 -0.295) 5.138 10.569 ( 13.131 -6.701 3.918) 15.254 10.863 ( -0.522 -1.540 12.082) 12.191 11.306 ( 7.599 -4.525 1.502) 8.971 11.492 ( 6.516 1.236 -4.727) 8.144 12.002 ( 2.955 -3.071 -2.761) 5.078 12.342 ( 3.099 5.252 -2.028) 6.426 12.586 ( 2.584 8.925 2.102) 9.526 13.384 ( -8.978 -3.419 -0.551) 9.623 13.492 ( -1.560 -4.397 -6.611) 8.091 13.746 ( -2.136 2.175 2.095) 3.699 14.091 ( -9.321 -6.385 0.906) 11.334 14.290 ( -0.827 8.870 -6.129) 10.813 14.388 ( -6.399 5.312 -16.280) 18.281 16.123 ( 34.313 -10.981 28.166) 45.730 18.652 ( 2.161 -6.676 -0.738) 7.056 19.113 ( -11.629 1.962 -7.412) 13.929 19.529 ( -16.988 9.919 0.522) 19.679 19.710 ( -11.833 10.025 2.312) 15.680 22.762 ( 13.906 -4.726 -1.112) 14.729 23.949 ( -2.329 -0.528 -1.759) 2.966 ======================= Grid point 458 (211/433) ======================= q-point: (-0.08 0.00 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.619 ( -8.336 -10.155 26.385) 29.475 1.994 ( -17.832 24.898 22.558) 38.036 2.993 ( -0.545 1.765 37.321) 37.367 5.052 ( -7.584 1.490 -6.660) 10.202 6.496 ( 9.262 0.092 16.989) 19.350 6.756 ( -6.210 3.734 -16.894) 18.382 8.056 ( -1.768 -14.411 -6.119) 15.756 8.254 ( 4.177 5.493 -1.023) 6.976 8.470 ( 6.450 10.235 6.224) 13.605 8.613 ( -13.131 -0.573 1.448) 13.223 8.998 ( -6.327 -3.554 3.392) 8.010 9.228 ( 10.740 -12.686 9.719) 19.255 9.438 ( 7.037 8.923 5.111) 12.461 9.674 ( 19.519 0.935 -6.648) 20.641 10.194 ( -6.232 -9.888 -2.018) 11.861 10.346 ( -0.720 2.150 -3.593) 4.249 10.842 ( 7.049 -2.335 7.209) 10.349 11.030 ( 15.412 -1.601 3.072) 15.797 11.556 ( 5.876 -3.220 -0.004) 6.700 11.592 ( 12.596 -4.717 2.323) 13.650 12.042 ( 0.945 -0.957 -2.649) 2.971 12.254 ( -2.116 4.710 -6.666) 8.432 12.547 ( 1.641 7.906 -0.848) 8.119 13.187 ( -17.177 -2.576 -3.098) 17.643 13.460 ( -4.168 -6.306 -4.672) 8.886 13.609 ( -7.592 7.103 -0.184) 10.399 14.045 ( -5.358 -4.477 1.785) 7.207 14.132 ( -5.222 5.601 -2.718) 8.126 14.224 ( 4.072 3.121 -17.312) 18.056 17.111 ( 45.567 -17.951 22.518) 53.904 18.747 ( -6.124 -9.673 -0.575) 11.463 18.850 ( -5.557 6.818 -6.185) 10.752 19.090 ( -18.034 15.908 2.259) 24.154 19.451 ( -10.372 5.998 0.265) 11.984 22.999 ( 9.696 -3.266 -0.208) 10.233 23.894 ( -3.817 -0.291 -0.492) 3.859 ======================= Grid point 460 (212/433) ======================= q-point: ( 0.08 0.08 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 432 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.238 ( 14.395 -0.000 19.140) 23.949 2.824 ( 21.898 -0.000 11.091) 24.546 3.716 ( 6.003 -0.000 19.700) 20.594 5.021 ( 5.443 -0.000 0.348) 5.454 6.393 ( 3.224 -0.000 -9.833) 10.348 7.516 ( 8.411 -0.000 6.156) 10.423 7.791 ( -2.209 0.000 11.522) 11.732 7.895 ( -19.134 0.000 -3.167) 19.394 8.460 ( -1.659 0.000 2.131) 2.700 8.522 ( 11.646 -0.000 2.842) 11.988 9.193 ( 2.143 -0.000 -6.312) 6.666 9.628 ( -5.502 0.000 4.180) 6.910 9.699 ( -0.037 0.000 6.336) 6.336 9.915 ( 3.729 -0.000 1.080) 3.883 10.065 ( 3.429 -0.000 -6.884) 7.691 10.625 ( 0.017 -0.000 -8.898) 8.898 11.004 ( -9.245 0.000 -5.274) 10.643 11.209 ( -1.319 0.000 1.204) 1.786 11.645 ( -2.205 0.000 -1.911) 2.918 11.722 ( -5.017 0.000 -1.329) 5.190 12.094 ( 3.049 -0.000 11.659) 12.051 12.153 ( 2.929 -0.000 -7.541) 8.090 12.475 ( 2.565 -0.000 -7.028) 7.482 12.916 ( -11.275 0.000 2.818) 11.622 13.036 ( 9.892 -0.000 7.439) 12.377 13.370 ( -1.138 0.000 -4.270) 4.419 13.683 ( -10.170 0.000 -2.469) 10.465 14.054 ( 3.577 -0.000 5.803) 6.817 14.342 ( 8.739 -0.000 -13.769) 16.308 17.244 ( -28.126 0.000 9.568) 29.709 18.080 ( -8.836 0.000 1.122) 8.907 18.899 ( -4.550 0.000 -4.109) 6.131 19.674 ( 21.488 -0.000 2.382) 21.620 19.736 ( 23.497 -0.000 -3.174) 23.710 23.113 ( -5.383 0.000 -0.280) 5.391 23.675 ( -4.827 0.000 -0.816) 4.895 ======================= Grid point 461 (213/433) ======================= q-point: ( 0.17 0.08 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.612 ( 16.180 -0.554 13.423) 21.031 3.189 ( 10.876 -5.024 11.179) 16.386 3.924 ( 8.299 -1.079 7.494) 11.233 5.094 ( 2.212 0.710 1.936) 3.024 6.444 ( 6.630 -3.702 -6.971) 10.308 7.447 ( -10.091 3.548 -6.840) 12.697 7.520 ( -18.998 -0.565 -3.928) 19.408 8.033 ( 13.881 0.609 16.897) 21.876 8.465 ( 2.273 2.228 0.807) 3.284 8.785 ( 14.057 -3.187 3.720) 14.886 9.035 ( -12.068 -1.333 -14.897) 19.218 9.540 ( -2.190 7.629 4.219) 8.989 9.841 ( 4.896 -5.774 7.002) 10.312 9.956 ( 1.766 0.804 -1.076) 2.219 10.036 ( -0.509 0.158 -11.915) 11.927 10.396 ( -16.801 6.274 -0.911) 17.958 10.859 ( -2.525 -1.428 -15.165) 15.440 11.169 ( -4.400 -2.115 -0.288) 4.890 11.538 ( -3.900 6.274 -2.962) 7.959 11.623 ( -5.830 1.611 0.446) 6.065 12.213 ( 6.215 1.739 6.244) 8.980 12.269 ( 8.257 -5.277 0.866) 9.837 12.477 ( 1.546 0.630 -4.710) 4.997 12.765 ( -5.952 6.286 8.307) 11.997 13.247 ( 5.616 -4.114 3.023) 7.589 13.347 ( -3.436 -7.658 -2.945) 8.895 13.533 ( -5.241 0.903 3.498) 6.366 14.161 ( 4.774 0.114 6.431) 8.010 14.397 ( 7.612 0.833 -12.213) 14.415 16.795 ( -25.997 7.105 4.888) 27.390 18.017 ( -2.434 -3.782 1.900) 4.883 18.825 ( -4.017 -3.560 -3.203) 6.251 19.968 ( 18.487 8.789 2.012) 20.569 20.161 ( 20.645 -10.821 1.763) 23.375 22.944 ( -11.148 4.354 -3.906) 12.589 23.602 ( -3.013 -0.321 -0.778) 3.129 ======================= Grid point 462 (214/433) ======================= q-point: ( 0.25 0.08 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.877 ( 10.866 6.672 5.249) 13.789 3.428 ( 2.172 -7.659 13.597) 15.756 4.084 ( 6.169 -3.366 -2.691) 7.525 5.100 ( -1.870 1.382 3.572) 4.262 6.590 ( 8.855 -6.212 -4.138) 11.581 7.084 ( -21.372 2.905 0.784) 21.583 7.306 ( -6.680 -1.237 -12.517) 14.242 8.342 ( 15.491 2.104 4.402) 16.242 8.493 ( 3.820 2.697 -0.764) 4.738 8.707 ( -18.006 -4.380 -14.545) 23.558 9.051 ( 11.677 0.573 3.851) 12.309 9.455 ( -1.020 9.472 0.566) 9.543 9.842 ( -7.341 1.425 -12.655) 14.699 9.917 ( -1.472 2.787 -1.160) 3.358 10.048 ( -3.096 -2.038 -9.884) 10.556 10.094 ( -2.936 1.943 9.981) 10.584 10.718 ( -5.370 -1.582 -15.486) 16.467 11.134 ( -1.896 -2.338 0.812) 3.118 11.403 ( -2.834 6.222 -1.970) 7.115 11.513 ( -5.465 1.465 1.132) 5.770 12.277 ( 0.022 0.808 -2.075) 2.227 12.438 ( -0.077 2.422 -0.630) 2.504 12.519 ( 10.727 -2.786 3.413) 11.597 12.708 ( -1.008 6.167 14.448) 15.742 13.193 ( -7.620 -5.701 -7.664) 12.219 13.448 ( -3.495 -10.488 7.176) 13.179 13.603 ( 10.327 0.869 6.658) 12.318 14.277 ( 3.844 0.429 7.206) 8.179 14.426 ( 5.909 2.335 -9.507) 11.435 16.328 ( -22.487 7.315 -1.471) 23.692 18.085 ( 3.058 -6.116 2.357) 7.233 18.789 ( -3.421 -4.897 -2.141) 6.346 20.167 ( 12.626 7.977 5.936) 16.071 20.617 ( 19.995 -9.119 3.702) 22.286 22.617 ( -16.634 7.528 -7.865) 19.880 23.585 ( 0.656 -1.071 -0.204) 1.273 ======================= Grid point 463 (215/433) ======================= q-point: ( 0.33 0.08 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.886 ( 0.307 12.809 -0.569) 12.825 3.559 ( -2.222 -2.439 10.019) 10.548 4.159 ( 0.501 -6.562 -5.317) 8.461 5.076 ( -2.050 0.271 4.725) 5.157 6.743 ( -13.877 -1.005 6.619) 15.408 6.797 ( 5.431 -5.728 -7.894) 11.163 7.159 ( -3.118 -2.983 -12.301) 13.036 8.322 ( -12.469 -2.036 -16.972) 21.159 8.505 ( -0.209 0.971 -1.913) 2.155 8.613 ( 10.520 -0.315 -2.225) 10.757 9.144 ( 3.307 10.708 2.375) 11.456 9.267 ( -7.900 10.265 -8.518) 15.503 9.690 ( -1.297 -5.722 -13.734) 14.935 9.781 ( -7.695 9.490 -11.234) 16.598 9.923 ( 4.179 3.359 6.402) 8.350 10.262 ( 3.972 -9.214 4.658) 11.062 10.544 ( -4.732 2.584 -11.589) 12.782 11.141 ( -2.820 -1.105 4.555) 5.470 11.306 ( -1.533 3.453 -1.466) 4.052 11.453 ( -1.760 -1.034 0.304) 2.064 12.197 ( -4.898 1.204 -4.923) 7.048 12.296 ( -6.487 8.887 -5.129) 12.139 12.678 ( 4.697 8.097 13.819) 16.691 12.865 ( 7.732 -9.030 7.320) 13.961 13.125 ( -4.981 -8.080 -1.831) 9.667 13.502 ( -4.003 -6.834 5.621) 9.712 13.854 ( 12.988 -1.912 6.659) 14.720 14.312 ( -1.299 3.673 2.671) 4.723 14.483 ( 7.762 1.565 -1.162) 8.003 15.912 ( -17.195 4.534 -7.220) 19.193 18.247 ( 6.293 -7.401 2.254) 9.973 18.777 ( -2.803 -5.408 -0.549) 6.116 20.309 ( 7.174 6.941 10.307) 14.348 21.021 ( 16.716 -4.728 4.549) 17.958 22.180 ( -18.593 8.132 -11.723) 23.436 23.641 ( 4.083 -1.892 0.488) 4.527 ======================= Grid point 464 (216/433) ======================= q-point: (-0.58 0.08 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.668 ( -8.154 14.924 -2.094) 17.135 3.484 ( -9.170 5.681 1.884) 10.951 4.184 ( -3.092 -6.915 -0.371) 7.584 5.106 ( 1.386 -2.141 4.251) 4.958 6.568 ( -8.983 -3.790 2.386) 10.037 6.851 ( -2.289 -2.283 -8.993) 9.556 7.207 ( 7.618 -10.187 -4.332) 13.438 8.071 ( -11.035 -8.947 -14.266) 20.133 8.482 ( 2.684 4.441 -4.218) 6.687 8.683 ( 0.972 4.803 -7.862) 9.264 9.012 ( -0.603 7.373 -9.548) 12.079 9.043 ( -0.422 12.344 -3.087) 12.731 9.491 ( -7.033 10.163 -9.295) 15.465 9.637 ( -1.146 -0.040 -10.233) 10.297 10.091 ( 8.211 -5.881 0.743) 10.127 10.378 ( -2.857 4.703 -2.998) 6.266 10.428 ( 2.816 -4.829 2.023) 5.945 11.072 ( -10.177 0.463 6.968) 12.343 11.269 ( 0.060 2.240 -0.981) 2.446 11.472 ( 1.925 -1.612 -0.400) 2.543 12.051 ( -5.947 5.478 0.026) 8.086 12.082 ( -3.711 3.633 -12.324) 13.374 12.741 ( 2.660 8.465 13.639) 16.271 13.084 ( 1.643 -7.663 4.531) 9.053 13.167 ( 1.192 -10.816 0.636) 10.900 13.519 ( -5.316 -6.771 4.033) 9.507 14.127 ( 12.021 -1.348 7.111) 14.032 14.255 ( 0.016 5.182 2.031) 5.566 14.601 ( 7.104 1.792 2.150) 7.636 15.591 ( -11.839 1.181 -10.536) 15.892 18.424 ( 4.171 -6.488 0.865) 7.762 18.817 ( 1.123 -6.801 2.342) 7.280 20.389 ( 1.575 6.354 12.995) 14.551 21.227 ( -0.070 6.808 4.147) 7.972 21.810 ( -4.801 0.216 -14.148) 14.942 23.749 ( 5.590 -2.213 0.810) 6.066 ======================= Grid point 465 (217/433) ======================= q-point: (-0.50 0.08 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.354 ( -11.414 13.067 0.252) 17.352 3.202 ( -15.418 9.601 0.485) 18.170 4.169 ( -5.641 -1.821 3.655) 6.964 5.203 ( 4.238 -3.016 2.726) 5.872 6.521 ( -5.029 -4.626 -1.042) 6.912 6.776 ( -1.043 -6.005 -7.834) 9.926 7.437 ( 5.829 -12.287 0.699) 13.617 7.980 ( -2.671 -9.755 -8.717) 13.352 8.426 ( -2.758 2.264 -12.365) 12.869 8.555 ( 5.935 9.775 -6.345) 13.078 8.881 ( 0.353 11.941 -7.429) 14.068 8.996 ( 6.621 4.571 -5.473) 9.731 9.284 ( -2.915 5.110 -5.373) 7.967 9.542 ( -1.938 3.396 -6.049) 7.203 10.105 ( -4.927 3.727 -8.473) 10.486 10.399 ( 4.730 -2.570 4.864) 7.256 10.503 ( -0.964 -3.099 2.453) 4.068 10.883 ( -15.822 0.897 6.252) 17.037 11.236 ( 0.160 3.396 -0.109) 3.402 11.531 ( 4.406 -1.742 -2.387) 5.305 11.934 ( -3.050 2.431 -8.473) 9.327 11.976 ( 1.810 2.815 -0.104) 3.348 12.773 ( 2.239 7.732 10.396) 13.148 13.174 ( -0.268 -7.505 4.531) 8.771 13.315 ( 2.072 -10.932 -2.110) 11.325 13.509 ( -5.704 -6.580 2.392) 9.031 14.200 ( -3.335 -0.502 6.096) 6.966 14.414 ( 16.030 4.736 4.981) 17.442 14.697 ( 5.521 2.425 1.679) 6.260 15.360 ( -8.332 -0.865 -10.841) 13.700 18.491 ( -1.742 -4.029 0.211) 4.395 18.991 ( 7.498 -8.579 3.814) 12.015 20.384 ( -4.663 6.640 13.331) 15.607 20.915 ( -17.805 13.665 -3.718) 22.750 21.895 ( 12.999 -5.291 -7.874) 16.092 23.862 ( 4.760 -1.831 0.435) 5.118 ======================= Grid point 466 (218/433) ======================= q-point: (-0.42 0.08 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.068 ( -12.003 8.786 3.898) 15.377 2.852 ( -16.333 10.774 9.038) 21.553 4.052 ( -9.916 6.329 5.696) 13.070 5.313 ( 4.016 -2.125 0.710) 4.599 6.417 ( -7.587 -1.096 -2.949) 8.214 6.906 ( 7.901 -13.587 -5.805) 16.755 7.619 ( 1.108 -13.203 2.572) 13.497 8.010 ( 2.510 -1.239 -4.053) 4.926 8.281 ( -1.815 5.021 -11.624) 12.791 8.554 ( 6.539 10.336 0.462) 12.240 8.869 ( 13.342 -2.647 -12.325) 18.356 9.025 ( 7.247 5.738 -5.815) 10.921 9.216 ( -2.852 -2.680 -2.355) 4.567 9.460 ( 2.176 6.740 -2.145) 7.401 9.888 ( -9.500 6.855 -2.564) 11.992 10.468 ( -4.605 -2.036 0.195) 5.039 10.505 ( -1.969 -3.163 5.570) 6.701 10.662 ( -12.418 -0.739 3.759) 12.996 11.220 ( 1.079 2.377 0.393) 2.640 11.588 ( 2.545 1.031 -4.988) 5.694 11.859 ( 2.731 0.789 -7.135) 7.680 12.040 ( 5.448 -0.833 4.513) 7.123 12.798 ( 3.452 7.603 6.404) 10.522 13.290 ( 1.744 -8.102 3.389) 8.954 13.410 ( -0.082 -10.545 -4.743) 11.563 13.490 ( -4.830 -5.799 1.211) 7.644 14.182 ( -5.298 -1.883 6.448) 8.555 14.612 ( 10.664 8.746 1.806) 13.909 14.766 ( 4.834 1.511 -1.419) 5.260 15.220 ( -2.573 -2.090 -4.062) 5.243 18.485 ( -2.971 -3.245 1.403) 4.618 19.218 ( 7.638 -6.787 0.995) 10.266 20.243 ( -13.432 7.925 10.225) 18.649 20.490 ( -13.523 11.856 -3.255) 18.277 22.134 ( 14.054 -4.984 -5.941) 16.052 23.938 ( 2.494 -1.161 -0.426) 2.784 ======================= Grid point 467 (219/433) ======================= q-point: (-0.33 0.08 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.811 ( -13.703 7.033 6.329) 16.652 2.631 ( -9.701 9.051 24.216) 27.613 3.773 ( -15.685 16.149 7.975) 23.883 5.358 ( -0.107 -0.449 -2.687) 2.727 6.316 ( -3.584 0.573 2.429) 4.367 7.119 ( 4.715 -13.236 -10.764) 17.700 7.799 ( 3.754 -11.430 1.745) 12.156 8.044 ( 1.689 -1.756 -5.574) 6.083 8.101 ( 2.088 12.627 1.796) 12.924 8.665 ( 10.762 2.558 2.457) 11.331 8.968 ( 5.568 6.254 -9.657) 12.781 9.143 ( -8.055 -2.129 0.632) 8.356 9.200 ( 14.002 -8.350 -6.120) 17.414 9.504 ( 7.470 0.576 -1.038) 7.564 9.698 ( -2.543 4.094 1.141) 4.952 10.384 ( -5.264 -1.996 2.635) 6.216 10.484 ( -8.233 -1.469 3.107) 8.921 10.602 ( -0.663 -5.835 5.613) 8.124 11.225 ( 0.718 0.711 0.673) 1.214 11.543 ( 0.738 3.636 -5.536) 6.664 11.903 ( 5.964 -0.380 -5.693) 8.254 12.217 ( 9.022 -3.017 4.573) 10.555 12.808 ( 3.388 8.574 2.966) 9.685 13.359 ( -5.434 -8.398 -1.623) 10.134 13.442 ( -1.071 -4.581 -7.637) 8.970 13.546 ( 2.609 -9.295 4.645) 10.713 14.124 ( -8.255 -1.817 5.207) 9.928 14.610 ( 0.380 8.873 -1.141) 8.954 14.721 ( -1.120 5.182 -14.122) 15.084 15.374 ( 13.081 -5.374 14.030) 19.920 18.489 ( -1.568 -3.439 2.658) 4.620 19.332 ( 1.777 -0.663 -5.416) 5.738 19.945 ( -16.240 7.139 5.096) 18.458 20.203 ( -9.082 11.028 1.291) 14.345 22.382 ( 13.325 -5.961 -4.208) 15.192 23.961 ( -0.084 -0.700 -1.250) 1.435 ======================= Grid point 468 (220/433) ======================= q-point: (-0.25 0.08 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.601 ( -8.084 8.239 14.526) 18.554 2.619 ( -4.477 8.671 31.532) 33.007 3.346 ( -18.366 22.778 13.143) 32.076 5.278 ( -5.123 2.112 -5.881) 8.080 6.336 ( 2.750 1.322 10.030) 10.484 7.106 ( -4.964 -1.281 -15.608) 16.428 7.809 ( -2.307 -2.093 -7.332) 7.967 8.162 ( 11.590 2.566 6.734) 13.648 8.288 ( 8.881 -16.443 5.636) 19.520 8.789 ( 7.064 6.786 -0.004) 9.795 8.913 ( -3.018 4.563 3.994) 6.774 8.992 ( -10.633 -1.454 2.537) 11.027 9.449 ( 14.276 -2.996 -6.697) 16.051 9.531 ( 0.945 0.990 -1.465) 2.005 9.852 ( 9.968 -8.616 -1.425) 13.252 10.370 ( -6.064 -2.050 0.963) 6.473 10.458 ( 7.284 -4.877 4.866) 10.026 10.750 ( 3.329 -8.594 10.551) 14.009 11.242 ( 1.157 -1.935 0.356) 2.283 11.522 ( 3.641 1.925 -3.925) 5.689 11.974 ( 6.170 -0.222 -5.880) 8.526 12.394 ( 6.859 0.084 0.500) 6.878 12.776 ( 2.188 9.410 0.747) 9.690 13.277 ( -10.810 -7.246 -2.814) 13.314 13.407 ( -2.436 -4.639 -9.470) 10.823 13.724 ( 5.142 -5.244 4.164) 8.443 14.004 ( -10.620 -1.280 3.173) 11.158 14.450 ( -8.622 5.071 -4.363) 10.912 14.545 ( 1.644 11.821 -15.358) 19.450 15.872 ( 21.809 -13.743 23.318) 34.759 18.536 ( 0.279 -4.207 3.824) 5.692 19.220 ( -4.540 6.649 -9.255) 12.267 19.657 ( -14.968 6.091 2.858) 16.410 19.962 ( -6.596 13.284 -0.651) 14.846 22.639 ( 11.701 -7.760 -1.955) 14.175 23.937 ( -2.338 -0.593 -1.448) 2.813 ======================= Grid point 469 (221/433) ======================= q-point: (-0.17 0.08 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.616 ( 7.222 9.615 22.621) 25.619 2.502 ( -14.141 24.626 21.224) 35.452 3.085 ( -4.310 9.177 29.506) 31.199 5.107 ( -6.454 4.060 -5.660) 9.496 6.502 ( 8.568 0.613 17.006) 19.052 6.871 ( -6.263 6.740 -15.882) 18.355 7.794 ( -3.006 -10.755 -5.566) 12.478 8.338 ( 7.609 2.727 1.842) 8.290 8.500 ( -7.154 -6.860 4.518) 10.893 8.779 ( 4.854 14.120 1.658) 15.023 8.891 ( -7.006 -5.084 1.224) 8.742 8.983 ( 7.164 -10.952 14.546) 19.566 9.567 ( 6.730 4.467 0.602) 8.100 9.681 ( 15.302 -2.491 -6.429) 16.784 9.977 ( -5.274 -9.323 1.119) 10.770 10.350 ( 2.353 -1.581 -3.700) 4.661 10.748 ( 13.051 -7.347 4.697) 15.696 10.960 ( 5.740 -5.844 8.277) 11.645 11.364 ( 5.160 -11.303 4.571) 13.240 11.569 ( 5.203 -0.324 -3.377) 6.211 12.034 ( 5.606 0.403 -6.488) 8.584 12.384 ( -2.348 6.979 -5.933) 9.456 12.736 ( 3.757 9.049 -0.260) 9.801 13.110 ( -13.846 -4.437 -4.644) 15.264 13.341 ( -5.140 -5.969 -7.706) 11.019 13.745 ( -5.655 6.688 1.818) 8.946 13.939 ( -2.088 -6.436 3.602) 7.665 14.247 ( -5.338 4.932 -4.742) 8.678 14.357 ( 0.304 10.875 -15.396) 18.852 16.616 ( 23.640 -28.637 24.919) 44.720 18.605 ( -1.552 -4.407 4.755) 6.666 19.034 ( 0.769 9.603 -8.089) 12.579 19.347 ( -13.023 10.693 0.290) 16.853 19.696 ( -6.533 16.996 -4.196) 18.686 22.881 ( 8.251 -8.599 -0.283) 11.921 23.884 ( -3.826 -0.638 -0.649) 3.932 ======================= Grid point 470 (222/433) ======================= q-point: (-0.08 0.08 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.895 ( 19.568 11.287 22.137) 31.628 2.132 ( -9.508 23.584 20.039) 32.375 3.247 ( 2.970 1.602 32.997) 33.169 4.963 ( -2.381 3.193 -3.057) 5.021 6.626 ( -3.703 6.525 -14.612) 16.426 6.806 ( 13.360 -0.472 21.790) 25.564 7.829 ( -3.809 -13.455 -4.029) 14.553 8.297 ( -8.630 2.075 2.203) 9.145 8.441 ( -0.091 3.952 -1.955) 4.410 8.698 ( -7.297 3.674 3.144) 8.754 8.906 ( 5.972 2.358 6.513) 9.146 9.366 ( 11.040 -11.227 11.157) 19.297 9.660 ( 8.193 5.480 3.058) 10.320 9.882 ( 1.224 -9.145 -5.403) 10.692 9.964 ( -0.013 -3.931 2.148) 4.480 10.390 ( 7.104 2.450 -5.417) 9.263 11.001 ( 8.869 -2.708 2.944) 9.730 11.150 ( 3.358 -8.958 1.489) 9.682 11.568 ( 0.944 -7.506 2.667) 8.022 11.702 ( 7.619 -8.525 1.517) 11.534 12.064 ( 1.208 2.384 -3.781) 4.631 12.196 ( -3.205 4.300 -8.375) 9.945 12.695 ( 4.210 13.927 -3.634) 14.996 12.870 ( -13.246 -3.155 -2.562) 13.855 13.253 ( -8.184 -6.225 -5.873) 11.841 13.587 ( -4.749 8.010 1.619) 9.451 13.965 ( -2.864 -2.292 4.065) 5.475 14.082 ( -5.904 7.521 -5.074) 10.825 14.242 ( 6.310 1.937 -15.278) 16.643 17.348 ( 3.332 -39.027 16.879) 42.651 18.555 ( -10.739 0.350 2.860) 11.119 19.039 ( 11.783 6.344 -4.055) 13.983 19.098 ( 6.281 19.861 -1.947) 20.922 19.405 ( -5.189 13.513 -3.014) 14.786 23.058 ( 3.381 -7.240 0.849) 8.036 23.822 ( -4.209 -0.600 0.282) 4.261 ======================= Grid point 473 (223/433) ======================= q-point: ( 0.17 0.17 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 433 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.967 ( 16.255 -0.000 10.287) 19.237 3.325 ( 1.074 -0.000 11.061) 11.113 4.054 ( 5.398 -0.000 -2.266) 5.854 5.116 ( -1.685 0.000 2.853) 3.313 6.528 ( 9.363 -0.000 -4.389) 10.340 7.113 ( -23.982 0.000 0.795) 23.995 7.293 ( -6.169 0.000 -12.255) 13.720 8.357 ( 15.358 -0.000 6.102) 16.525 8.517 ( 2.959 -0.000 -1.203) 3.194 8.666 ( -18.464 0.000 -17.402) 25.373 9.048 ( 14.828 -0.000 5.122) 15.688 9.611 ( 1.197 -0.000 3.117) 3.339 9.823 ( -10.471 0.000 -9.714) 14.283 9.934 ( 1.979 -0.000 -3.799) 4.284 9.949 ( -0.448 0.000 -3.205) 3.237 10.191 ( -11.130 0.000 1.928) 11.296 10.701 ( -3.238 0.000 -15.375) 15.712 11.100 ( -1.900 0.000 -0.295) 1.922 11.475 ( -4.203 0.000 -2.828) 5.066 11.531 ( -7.369 0.000 2.419) 7.756 12.284 ( -0.201 0.000 -5.354) 5.358 12.419 ( 11.724 -0.000 3.703) 12.295 12.517 ( 2.129 -0.000 4.390) 4.879 12.820 ( -1.087 0.000 15.916) 15.953 13.115 ( -10.312 0.000 -12.156) 15.941 13.315 ( -0.174 0.000 8.840) 8.841 13.625 ( 9.138 -0.000 5.619) 10.727 14.280 ( 4.431 -0.000 7.377) 8.605 14.450 ( 5.790 -0.000 -9.208) 10.877 16.402 ( -25.168 0.000 -2.078) 25.253 18.024 ( 3.435 -0.000 2.698) 4.368 18.741 ( -2.700 0.000 -1.573) 3.125 20.281 ( 9.766 -0.000 5.265) 11.095 20.491 ( 24.490 -0.000 3.941) 24.805 22.690 ( -17.393 0.000 -8.047) 19.164 23.575 ( 0.531 -0.000 -0.241) 0.583 ======================= Grid point 474 (224/433) ======================= q-point: ( 0.25 0.17 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.158 ( 6.049 14.312 4.876) 16.285 3.433 ( 0.447 -10.317 10.588) 14.790 4.065 ( -1.513 -2.513 -7.868) 8.397 5.088 ( -3.019 0.564 3.774) 4.866 6.683 ( 6.482 -2.696 1.361) 7.151 6.754 ( -16.504 -0.488 -1.823) 16.611 7.129 ( -4.464 -0.563 -12.809) 13.576 8.247 ( -20.372 -3.065 -15.729) 25.919 8.549 ( 3.619 1.814 -3.176) 5.145 8.603 ( 11.964 -0.458 -2.534) 12.238 9.289 ( 10.768 3.906 2.851) 11.804 9.470 ( -10.131 8.594 -10.010) 16.634 9.591 ( -4.655 -3.059 -15.094) 16.089 9.901 ( -2.500 3.088 -7.884) 8.828 10.010 ( 1.807 2.045 1.850) 3.297 10.082 ( -0.628 -6.344 6.879) 9.379 10.579 ( -1.925 0.888 -10.466) 10.679 11.101 ( -1.143 -1.843 2.929) 3.645 11.385 ( -3.534 3.535 0.119) 5.000 11.436 ( -4.730 -1.016 2.281) 5.349 12.206 ( -3.064 0.122 -8.384) 8.927 12.492 ( -2.699 10.331 2.031) 10.869 12.675 ( 8.191 -7.391 6.205) 12.658 12.838 ( -2.284 4.949 4.527) 7.086 12.966 ( -3.952 -7.333 1.051) 8.396 13.374 ( -2.809 -4.628 9.527) 10.958 13.846 ( 13.537 0.279 4.346) 14.220 14.380 ( 2.516 2.612 6.339) 7.303 14.488 ( 4.593 -0.615 -3.621) 5.881 15.975 ( -20.620 1.784 -7.840) 22.132 18.148 ( 7.360 -2.705 3.140) 8.447 18.705 ( -2.356 -1.953 0.083) 3.061 20.423 ( 5.015 3.909 9.782) 11.667 20.934 ( 22.690 -3.217 3.607) 23.199 22.289 ( -21.472 2.936 -11.441) 24.507 23.618 ( 4.135 -0.563 0.426) 4.195 ======================= Grid point 475 (225/433) ======================= q-point: ( 0.33 0.17 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 794 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.009 ( -4.826 19.018 1.767) 19.700 3.550 ( -2.164 -0.115 3.627) 4.225 4.008 ( -4.989 -9.833 -5.289) 12.229 5.077 ( -0.595 -0.757 4.113) 4.224 6.499 ( -13.074 -3.013 3.510) 13.868 6.826 ( 2.663 -0.699 -5.410) 6.070 7.049 ( 2.458 -5.674 -8.212) 10.280 7.902 ( -15.399 -7.458 -13.220) 21.622 8.545 ( 0.673 2.133 -4.235) 4.789 8.736 ( 6.385 1.209 -5.524) 8.529 9.146 ( -5.921 5.858 -16.729) 18.688 9.270 ( -3.112 9.993 -2.984) 10.883 9.569 ( 4.526 -0.704 -16.790) 17.403 9.740 ( -0.987 9.016 -6.391) 11.095 10.008 ( 1.695 -2.886 0.954) 3.480 10.293 ( 5.972 -6.831 8.819) 12.653 10.478 ( -1.975 3.244 -6.505) 7.532 11.064 ( -10.417 -1.039 8.803) 13.678 11.323 ( 0.114 3.365 0.302) 3.381 11.441 ( 1.528 -1.880 2.126) 3.223 12.094 ( -3.534 0.897 -8.334) 9.097 12.260 ( -6.330 12.948 -5.180) 15.315 12.814 ( -2.480 -6.637 -0.051) 7.085 12.906 ( 4.909 -5.148 7.817) 10.569 13.016 ( -0.738 -3.762 6.847) 7.847 13.411 ( -3.668 -4.221 6.467) 8.549 14.099 ( 11.483 -1.090 5.336) 12.709 14.378 ( 2.029 6.907 3.150) 7.858 14.593 ( 4.959 -2.614 3.125) 6.419 15.616 ( -13.706 1.159 -11.190) 17.732 18.332 ( 7.992 -3.134 2.762) 9.019 18.708 ( -1.061 -4.222 2.415) 4.978 20.496 ( 0.382 4.334 12.776) 13.496 21.304 ( 15.542 1.639 2.746) 15.868 21.829 ( -18.538 1.411 -14.220) 23.406 23.718 ( 6.118 -1.002 1.011) 6.282 ======================= Grid point 476 (226/433) ======================= q-point: (-0.58 0.17 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.704 ( -7.848 21.618 0.313) 23.000 3.378 ( -11.729 8.304 -2.176) 14.535 4.048 ( -2.970 -10.741 1.832) 11.293 5.141 ( 3.147 -3.033 3.351) 5.507 6.417 ( -4.845 -5.925 2.775) 8.141 6.728 ( -5.096 1.105 -8.139) 9.666 7.196 ( 3.798 -12.287 -1.411) 12.938 7.768 ( -2.400 -10.800 -8.268) 13.812 8.461 ( -4.755 1.488 -9.024) 10.308 8.710 ( 2.771 6.322 -7.145) 9.935 9.017 ( 3.760 1.046 -14.246) 14.771 9.121 ( -0.097 7.121 -5.611) 9.067 9.423 ( -2.920 11.011 -8.702) 14.335 9.658 ( 2.768 7.855 -5.592) 10.031 10.107 ( 3.982 -4.343 -6.709) 8.929 10.391 ( -1.291 1.501 -1.418) 2.435 10.457 ( 2.185 -1.822 6.904) 7.467 10.893 ( -17.473 0.023 10.998) 20.646 11.302 ( -0.007 3.082 1.215) 3.312 11.508 ( 3.688 -0.864 0.664) 3.845 11.975 ( -2.835 1.797 -9.017) 9.622 12.075 ( 0.743 8.023 -4.048) 9.017 12.835 ( -1.057 -4.078 -0.058) 4.214 13.027 ( -1.927 -4.858 10.445) 11.679 13.105 ( 0.210 -9.594 0.855) 9.634 13.420 ( -1.987 -2.773 1.938) 3.923 14.212 ( -2.075 1.222 6.496) 6.928 14.481 ( 13.439 2.910 4.585) 14.495 14.709 ( 3.403 -1.675 3.813) 5.378 15.364 ( -7.064 1.194 -11.882) 13.875 18.452 ( 2.311 -0.028 1.997) 3.055 18.822 ( 5.118 -8.626 4.935) 11.178 20.499 ( -4.479 5.050 13.586) 15.171 21.160 ( -17.428 11.543 -8.418) 22.535 21.786 ( 12.990 -6.005 -6.034) 15.531 23.835 ( 5.624 -0.923 1.022) 5.790 ======================= Grid point 477 (227/433) ======================= q-point: (-0.50 0.17 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 794 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.375 ( -6.464 21.598 0.869) 22.561 3.062 ( -13.921 10.556 4.019) 17.927 4.080 ( -4.539 -3.538 3.871) 6.936 5.259 ( 4.619 -3.413 1.657) 5.978 6.410 ( -4.576 -0.581 1.835) 4.965 6.667 ( 1.415 -9.661 -5.835) 11.375 7.344 ( -0.697 -14.623 1.156) 14.685 7.914 ( 9.006 -9.382 -1.393) 13.079 8.286 ( -4.190 0.021 -13.967) 14.581 8.721 ( 7.500 3.756 -3.568) 9.115 8.948 ( 2.027 6.918 -9.624) 12.024 9.101 ( 6.114 1.992 -10.064) 11.943 9.231 ( -3.874 8.223 -0.845) 9.129 9.603 ( 4.194 7.881 -5.443) 10.456 10.039 ( -5.434 7.394 -4.460) 10.202 10.412 ( 0.055 -3.871 0.596) 3.917 10.480 ( -3.560 0.356 4.607) 5.833 10.651 ( -16.566 -0.413 7.888) 18.353 11.275 ( -0.566 2.905 1.704) 3.415 11.597 ( 5.918 0.183 -2.173) 6.307 11.881 ( 1.044 1.297 -8.815) 8.971 12.056 ( 3.301 2.962 1.650) 4.732 12.864 ( 1.136 -2.517 -1.148) 2.991 13.110 ( -1.841 -7.492 8.684) 11.616 13.186 ( -2.378 -11.687 -1.453) 12.014 13.430 ( 0.897 -1.503 -2.211) 2.820 14.178 ( -4.476 1.267 6.783) 8.225 14.704 ( 10.081 1.357 2.252) 10.419 14.773 ( -0.092 -1.651 4.092) 4.413 15.224 ( 1.028 2.775 -8.480) 8.982 18.465 ( -0.752 1.258 3.319) 3.628 19.057 ( 7.700 -9.634 4.131) 13.007 20.393 ( -11.100 7.254 10.844) 17.129 20.708 ( -14.990 10.449 -8.893) 20.322 22.037 ( 13.701 -4.947 -5.382) 15.529 23.922 ( 3.216 -0.484 0.369) 3.273 ======================= Grid point 478 (228/433) ======================= q-point: (-0.42 0.17 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.094 ( -3.731 20.948 2.274) 21.399 2.825 ( -8.752 10.666 17.439) 22.237 3.989 ( -8.434 6.095 4.727) 11.429 5.345 ( 2.018 -1.157 -0.986) 2.527 6.342 ( -2.973 2.037 5.392) 6.486 6.834 ( 5.239 -15.181 -6.659) 17.385 7.510 ( 1.941 -15.840 4.570) 16.600 8.047 ( 2.538 1.598 -6.555) 7.208 8.276 ( 6.270 -3.228 -2.677) 7.543 8.730 ( 1.427 8.825 1.597) 9.081 8.953 ( 6.672 -3.024 -11.387) 13.540 9.069 ( 3.483 -2.912 -13.388) 14.137 9.205 ( 3.197 5.102 7.708) 9.780 9.586 ( 5.242 5.555 -6.979) 10.346 9.817 ( -7.853 8.764 4.222) 12.502 10.365 ( -6.379 0.032 3.032) 7.063 10.452 ( -6.804 -1.954 4.296) 8.281 10.524 ( -2.406 -2.712 2.232) 4.258 11.250 ( -1.204 1.607 1.780) 2.683 11.612 ( 1.216 3.718 -4.471) 5.940 11.903 ( 7.476 0.206 -9.222) 11.873 12.160 ( 7.020 -2.395 5.973) 9.523 12.892 ( 0.695 -1.606 -2.623) 3.153 13.169 ( -5.870 -9.335 1.521) 11.132 13.274 ( 1.009 -10.277 0.441) 10.336 13.459 ( 3.601 -1.386 -3.226) 5.030 14.120 ( -5.948 1.139 5.985) 8.515 14.698 ( -5.102 1.949 -3.220) 6.340 14.817 ( 1.374 1.773 -3.019) 3.761 15.308 ( 11.834 -0.384 5.453) 13.036 18.468 ( -0.130 1.254 5.060) 5.214 19.262 ( 4.705 -6.468 -0.183) 8.000 20.113 ( -15.088 9.665 2.057) 18.036 20.401 ( -8.523 9.377 -0.804) 12.697 22.265 ( 11.583 -6.050 -5.551) 14.198 23.952 ( 0.185 -0.172 -0.542) 0.598 ======================= Grid point 479 (229/433) ======================= q-point: (-0.33 0.17 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 794 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.906 ( 3.672 21.749 8.014) 23.468 2.783 ( -2.218 8.943 27.706) 29.198 3.736 ( -12.642 16.409 6.267) 21.642 5.323 ( -2.309 2.297 -3.457) 4.750 6.367 ( 2.117 1.600 11.207) 11.517 6.972 ( 0.938 -10.566 -8.857) 13.819 7.728 ( 0.576 -11.912 0.210) 11.928 8.048 ( 4.794 -3.562 -1.296) 6.111 8.323 ( 6.998 11.913 2.242) 13.997 8.734 ( -2.337 -5.964 0.694) 6.443 8.905 ( -6.472 -3.607 -4.420) 8.627 9.202 ( 5.959 10.814 4.052) 12.995 9.272 ( 8.065 -8.340 -3.011) 11.986 9.555 ( 3.497 1.740 -6.639) 7.703 9.797 ( 6.201 0.914 3.677) 7.267 10.332 ( -2.970 -1.658 2.243) 4.074 10.383 ( -2.188 -2.930 6.295) 7.280 10.598 ( 3.320 -6.169 4.339) 8.240 11.223 ( -2.332 -0.237 1.332) 2.696 11.571 ( 1.732 3.330 -3.185) 4.923 11.976 ( 7.947 0.117 -9.452) 12.349 12.362 ( 8.812 -2.924 3.398) 9.887 12.875 ( -2.343 -1.352 -3.417) 4.358 13.131 ( -7.538 -7.179 -2.016) 10.604 13.332 ( -0.025 -2.298 -7.278) 7.632 13.584 ( 6.042 -7.469 3.636) 10.272 14.027 ( -6.991 2.672 4.381) 8.672 14.524 ( -8.418 3.033 -6.187) 10.879 14.745 ( -0.243 7.376 -7.914) 10.821 15.637 ( 13.350 -9.754 15.731) 22.821 18.505 ( 1.660 0.961 6.643) 6.915 19.297 ( -1.553 0.524 -6.647) 6.847 19.809 ( -10.841 9.707 0.641) 14.566 20.188 ( -5.634 10.375 0.022) 11.806 22.477 ( 9.181 -8.747 -4.326) 13.398 23.929 ( -2.411 -0.235 -1.110) 2.665 ======================= Grid point 480 (230/433) ======================= q-point: (-0.25 0.17 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.931 ( 16.100 21.327 15.074) 30.680 2.845 ( -2.366 11.680 27.486) 29.958 3.385 ( -10.849 20.293 12.127) 26.011 5.199 ( -4.855 5.227 -3.890) 8.126 6.512 ( 6.446 -0.001 15.546) 16.829 6.952 ( -1.857 0.758 -9.834) 10.036 7.681 ( -5.731 -2.262 -6.113) 8.679 8.286 ( 3.758 -9.511 4.762) 11.281 8.391 ( 7.990 0.519 1.359) 8.122 8.750 ( -4.338 -7.396 10.160) 13.295 8.794 ( -6.965 -4.930 -3.612) 9.266 9.163 ( 4.676 18.652 11.276) 22.292 9.496 ( 6.833 -14.482 -7.874) 17.844 9.623 ( 9.408 1.674 -5.215) 10.887 9.914 ( 3.459 0.002 3.575) 4.975 10.299 ( -1.582 -2.858 1.402) 3.555 10.584 ( 11.922 -8.946 3.879) 15.401 10.803 ( 6.008 -9.673 8.976) 14.500 11.209 ( -1.945 -4.515 1.361) 5.101 11.575 ( 2.894 1.186 -1.734) 3.576 12.043 ( 7.133 0.067 -10.221) 12.464 12.478 ( 2.678 2.448 -3.546) 5.073 12.812 ( -4.444 -2.455 -2.688) 5.745 13.051 ( -5.535 -2.595 -2.614) 6.649 13.261 ( -2.870 -0.142 -9.520) 9.945 13.783 ( 4.734 -6.986 4.831) 9.724 13.885 ( -7.833 5.253 2.656) 9.798 14.328 ( -5.111 3.783 -6.905) 9.386 14.578 ( -2.708 10.552 -10.525) 15.148 16.111 ( 10.605 -22.788 21.791) 33.266 18.575 ( 2.059 1.134 7.925) 8.267 19.167 ( -4.093 4.072 -8.132) 9.973 19.570 ( -3.941 12.833 -1.077) 13.467 19.996 ( -3.583 13.271 -4.091) 14.342 22.684 ( 6.046 -11.545 -2.108) 13.202 23.872 ( -3.910 -0.538 -0.863) 4.041 ======================= Grid point 481 (231/433) ======================= q-point: (-0.17 0.17 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 794 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.184 ( 24.045 17.961 16.873) 34.431 2.658 ( -9.634 27.637 15.158) 32.960 3.315 ( 2.307 6.345 26.190) 27.046 5.050 ( -3.441 5.620 -2.171) 6.938 6.716 ( 2.334 -0.718 0.899) 2.602 6.857 ( 7.124 8.261 7.343) 13.150 7.617 ( -3.881 -8.092 -4.220) 9.917 8.270 ( -9.851 -3.328 1.973) 10.584 8.501 ( 1.830 0.470 0.171) 1.897 8.666 ( -8.247 -2.490 0.222) 8.618 9.011 ( 10.263 -8.086 5.594) 14.212 9.199 ( 8.757 7.818 16.739) 20.445 9.638 ( -2.759 -13.388 -3.941) 14.227 9.747 ( 11.311 2.055 -5.985) 12.961 9.968 ( 2.364 2.229 5.798) 6.646 10.364 ( 4.910 -4.674 -2.320) 7.164 10.905 ( 12.564 -9.204 0.288) 15.578 10.981 ( -1.154 -5.811 5.873) 8.342 11.322 ( 1.925 -14.022 5.942) 15.350 11.621 ( 3.946 -1.700 -1.456) 4.537 12.082 ( 4.281 -0.291 -9.625) 10.538 12.342 ( -6.190 8.851 -7.180) 12.969 12.752 ( -5.558 -5.182 -2.893) 8.131 12.962 ( -0.694 7.338 -4.843) 8.820 13.155 ( -4.503 -1.912 -6.886) 8.446 13.723 ( -5.483 6.249 3.081) 8.866 13.902 ( -0.821 -4.254 4.411) 6.183 14.222 ( 0.404 4.980 -5.495) 7.426 14.344 ( -3.000 9.556 -13.798) 17.050 16.633 ( 1.019 -33.868 21.962) 40.378 18.589 ( -5.548 3.617 6.836) 9.518 19.055 ( 0.087 0.367 -3.764) 3.783 19.479 ( 12.867 16.254 -3.684) 21.055 19.739 ( -4.459 18.135 -8.337) 20.451 22.863 ( 2.054 -12.629 -0.010) 12.795 23.807 ( -4.135 -0.785 -0.159) 4.212 ======================= Grid point 482 (232/433) ======================= q-point: (-0.08 0.17 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.353 ( -2.282 20.492 14.227) 25.051 2.568 ( 26.401 17.790 14.651) 35.045 3.510 ( 5.448 2.279 25.396) 26.074 4.981 ( 1.341 3.035 -0.212) 3.325 6.589 ( -0.328 8.716 -11.346) 14.311 7.164 ( 14.775 -1.196 20.891) 25.616 7.634 ( -3.516 -10.786 -3.241) 11.798 8.130 ( -11.162 -2.483 0.487) 11.445 8.446 ( -8.713 -1.556 4.017) 9.720 8.599 ( 2.922 4.824 -2.389) 6.125 9.163 ( 7.839 6.513 4.555) 11.163 9.496 ( 7.934 -7.760 8.563) 14.018 9.644 ( -6.412 -12.066 0.805) 13.687 9.855 ( 7.906 5.907 -1.890) 10.048 10.012 ( 1.191 -1.130 0.333) 1.675 10.508 ( 7.920 -4.827 -4.617) 10.360 10.989 ( -6.226 -6.268 1.598) 8.978 11.144 ( 8.088 -5.336 -1.623) 9.825 11.488 ( -2.081 -10.792 4.576) 11.905 11.727 ( 3.052 -5.894 -1.471) 6.798 12.022 ( -5.926 2.425 -1.255) 6.525 12.178 ( 1.924 2.596 -6.183) 6.976 12.674 ( -5.069 0.217 -5.644) 7.589 12.842 ( 0.071 5.913 -5.570) 8.124 13.084 ( -1.366 -0.060 -1.066) 1.733 13.618 ( -2.741 7.793 3.395) 8.931 13.912 ( -5.674 -1.361 2.218) 6.242 14.036 ( -3.988 8.440 -4.677) 10.441 14.285 ( 7.560 0.941 -12.814) 14.908 16.981 ( -12.925 -32.378 17.184) 38.867 18.400 ( -12.768 6.206 3.445) 14.608 19.112 ( 2.451 -1.017 -0.762) 2.761 19.464 ( 3.822 16.970 -8.636) 19.421 19.633 ( 23.189 13.357 -2.734) 26.900 22.987 ( -1.743 -11.503 1.014) 11.678 23.746 ( -4.142 -0.624 -0.173) 4.193 ======================= Grid point 486 (233/433) ======================= q-point: ( 0.25 0.25 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 432 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.282 ( -8.898 0.000 8.379) 12.223 3.476 ( 9.767 -0.000 2.547) 10.094 3.898 ( -9.631 0.000 -10.149) 13.991 5.071 ( -1.466 0.000 3.690) 3.971 6.468 ( -14.701 0.000 4.000) 15.236 6.818 ( 7.422 -0.000 -2.258) 7.757 6.997 ( -2.099 0.000 -11.445) 11.636 7.824 ( -16.704 0.000 -12.823) 21.059 8.565 ( -0.213 0.000 -4.066) 4.072 8.746 ( 7.858 -0.000 -4.964) 9.294 9.209 ( -9.698 0.000 -16.936) 19.516 9.370 ( -7.331 0.000 -9.685) 12.146 9.562 ( 15.581 -0.000 -12.043) 19.693 9.849 ( 0.679 -0.000 -11.477) 11.497 9.979 ( -4.183 0.000 -0.478) 4.211 10.206 ( 7.527 -0.000 15.387) 17.129 10.508 ( -1.705 0.000 -7.078) 7.280 11.050 ( -9.553 0.000 8.539) 12.813 11.373 ( -1.964 0.000 2.186) 2.938 11.408 ( 2.123 -0.000 2.959) 3.642 12.103 ( -3.015 0.000 -8.943) 9.437 12.516 ( -9.198 0.000 -9.647) 13.329 12.577 ( -1.697 0.000 2.681) 3.173 12.875 ( 5.805 -0.000 -0.158) 5.807 13.005 ( -1.477 0.000 14.421) 14.496 13.367 ( -2.227 0.000 8.209) 8.505 14.088 ( 11.419 -0.000 4.474) 12.264 14.492 ( 2.369 -0.000 7.950) 8.296 14.521 ( 3.680 -0.000 -0.973) 3.807 15.628 ( -14.163 0.000 -11.450) 18.213 18.302 ( 9.771 -0.000 3.656) 10.433 18.665 ( -2.206 0.000 2.248) 3.150 20.540 ( -0.619 0.000 12.859) 12.874 21.315 ( 21.901 -0.000 1.768) 21.972 21.846 ( -23.608 0.000 -13.920) 27.406 23.709 ( 6.289 -0.000 1.095) 6.384 ======================= Grid point 487 (234/433) ======================= q-point: (-0.67 0.25 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.095 ( -7.724 15.270 4.973) 17.820 3.525 ( -6.630 8.441 -4.547) 11.657 3.776 ( -2.332 -16.180 -2.241) 16.500 5.100 ( 1.987 -1.097 3.329) 4.029 6.325 ( -6.623 -2.815 3.837) 8.156 6.801 ( -4.536 5.644 -4.839) 8.709 6.984 ( 0.988 -9.137 -4.909) 10.420 7.611 ( -2.491 -4.595 -7.554) 9.186 8.481 ( -5.317 0.557 -7.611) 9.301 8.794 ( 1.970 2.304 -3.766) 4.834 9.018 ( -0.183 -0.274 -16.473) 16.476 9.191 ( -2.670 1.268 -13.927) 14.237 9.669 ( 7.608 11.714 -8.805) 16.512 9.795 ( 3.537 4.674 -9.720) 11.351 9.973 ( 2.116 -7.890 -1.979) 8.406 10.405 ( 3.581 -1.044 7.577) 8.445 10.435 ( -1.097 0.305 -2.220) 2.495 10.888 ( -17.655 -0.332 13.201) 22.047 11.349 ( -1.796 1.572 3.223) 4.010 11.492 ( 3.612 -0.675 3.422) 5.021 12.000 ( -2.479 0.716 -8.894) 9.261 12.277 ( -0.831 11.543 -8.978) 14.647 12.629 ( -3.146 -12.882 -2.135) 13.432 12.950 ( 0.727 -3.149 1.669) 3.637 13.039 ( -2.798 0.436 10.980) 11.339 13.388 ( -0.223 -0.808 3.307) 3.412 14.232 ( 0.836 0.659 7.167) 7.245 14.542 ( 5.254 3.370 5.602) 8.387 14.646 ( 5.033 -3.894 2.567) 6.862 15.389 ( -5.387 0.929 -11.957) 13.148 18.480 ( 8.074 2.172 3.593) 9.101 18.680 ( 0.286 -5.228 4.824) 7.119 20.568 ( -4.622 1.908 13.910) 14.782 21.339 ( -20.535 6.091 -13.763) 25.460 21.679 ( 16.650 -4.201 -2.332) 17.330 23.825 ( 6.092 -0.244 1.396) 6.254 ======================= Grid point 488 (235/433) ======================= q-point: (-0.58 0.25 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.824 ( -4.662 22.729 1.897) 23.279 3.239 ( -12.578 7.631 -0.374) 14.716 3.922 ( 0.670 -12.062 1.047) 12.126 5.196 ( 4.855 -2.678 2.454) 6.063 6.343 ( 0.316 -5.389 4.059) 6.755 6.608 ( -7.779 2.883 -3.880) 9.158 7.080 ( 0.307 -12.131 -0.236) 12.137 7.722 ( 9.894 -8.495 -2.237) 13.231 8.307 ( -6.087 1.423 -12.737) 14.189 8.765 ( 1.283 1.689 -2.244) 3.088 8.971 ( 1.508 -1.767 -11.619) 11.849 9.119 ( 4.031 0.299 -11.931) 12.597 9.543 ( 1.290 19.522 -1.672) 19.636 9.742 ( 4.023 5.894 -10.930) 13.053 10.093 ( 3.326 -3.999 -5.185) 7.344 10.363 ( -1.769 0.270 -0.480) 1.852 10.489 ( -2.375 0.063 4.807) 5.362 10.642 ( -20.512 -0.599 12.713) 24.140 11.320 ( -2.394 1.598 3.308) 4.385 11.596 ( 6.900 -0.389 2.718) 7.426 11.904 ( -1.097 1.083 -8.648) 8.784 12.166 ( 2.486 8.451 -3.829) 9.605 12.688 ( -2.185 -13.114 -5.124) 14.248 12.993 ( -1.312 -5.923 0.490) 6.086 13.059 ( -1.700 -1.348 8.828) 9.091 13.412 ( 2.128 -0.545 -2.280) 3.166 14.219 ( -4.508 2.603 8.632) 10.080 14.659 ( 1.440 -4.822 7.276) 8.847 14.752 ( 4.067 0.086 -0.774) 4.141 15.293 ( 4.034 3.310 -8.868) 10.289 18.532 ( 1.688 5.613 4.868) 7.620 18.862 ( 6.584 -10.317 5.574) 13.449 20.507 ( -9.184 4.277 11.534) 15.352 20.874 ( -16.760 6.410 -13.001) 22.159 21.953 ( 14.132 -3.391 -4.658) 15.261 23.917 ( 3.689 -0.052 0.973) 3.816 ======================= Grid point 489 (236/433) ======================= q-point: (-0.50 0.25 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.552 ( -0.535 24.949 0.415) 24.958 3.018 ( -7.663 8.836 11.708) 16.549 4.005 ( -1.648 -4.143 1.627) 4.746 5.312 ( 4.189 -2.032 0.847) 4.733 6.387 ( -3.660 2.166 7.984) 9.046 6.571 ( 3.854 -11.143 -4.437) 12.598 7.234 ( 2.860 -12.190 4.597) 13.338 8.018 ( 13.094 -9.813 1.562) 16.437 8.135 ( -3.294 -1.097 -13.538) 13.976 8.791 ( -0.018 -2.150 2.701) 3.452 8.963 ( 4.909 -1.124 -9.971) 11.171 9.113 ( 3.786 4.028 -15.544) 16.497 9.369 ( 0.016 16.637 7.628) 18.302 9.688 ( 3.876 4.714 -12.886) 14.258 10.007 ( -7.342 9.476 2.828) 12.316 10.343 ( -7.207 -3.596 5.736) 9.888 10.430 ( -5.929 0.339 3.486) 6.886 10.478 ( -3.766 -2.685 1.423) 4.839 11.279 ( -3.130 1.333 3.055) 4.572 11.691 ( 3.315 4.421 -2.026) 5.886 11.898 ( 7.717 -1.229 -8.787) 11.759 12.148 ( 2.932 1.940 3.769) 5.154 12.733 ( -3.497 -12.657 -6.739) 14.759 13.018 ( -2.879 -6.829 -2.102) 7.703 13.138 ( 2.206 -4.129 7.908) 9.190 13.449 ( 5.030 0.045 -5.728) 7.623 14.161 ( -5.133 2.978 7.990) 9.953 14.696 ( -6.533 -3.073 1.923) 7.472 14.790 ( 1.669 -1.894 -1.360) 2.867 15.353 ( 10.340 3.668 -1.522) 11.077 18.535 ( 1.448 5.563 6.797) 8.902 19.100 ( 5.713 -9.824 3.856) 12.001 20.286 ( -13.460 7.754 -0.308) 15.537 20.557 ( -8.755 6.659 -2.235) 11.225 22.159 ( 10.409 -4.692 -6.908) 13.345 23.953 ( 0.330 0.203 0.044) 0.390 ======================= Grid point 490 (237/433) ======================= q-point: (-0.42 0.25 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.369 ( 6.892 24.880 4.031) 26.129 2.962 ( -1.215 9.248 21.485) 23.422 3.952 ( -5.321 5.918 2.047) 8.217 5.357 ( 0.396 1.186 -0.856) 1.515 6.386 ( -0.591 0.198 10.766) 10.784 6.758 ( 6.024 -10.973 -3.192) 12.919 7.460 ( 4.740 -12.709 6.342) 14.973 8.026 ( 0.212 -0.482 -7.232) 7.251 8.361 ( 10.754 -11.099 1.120) 15.495 8.774 ( -6.554 4.408 6.866) 10.466 8.895 ( -4.030 9.969 -13.626) 17.358 9.067 ( 7.192 -6.747 -9.400) 13.623 9.409 ( 7.708 4.973 10.511) 13.951 9.603 ( -0.535 3.374 -8.957) 9.586 9.866 ( -0.552 6.425 4.761) 8.016 10.304 ( -2.269 -1.995 3.552) 4.663 10.349 ( -6.128 -0.232 5.335) 8.129 10.514 ( 2.493 -3.378 0.116) 4.200 11.226 ( -4.107 0.500 2.343) 4.755 11.650 ( 0.992 4.750 -3.081) 5.748 11.979 ( 8.198 0.454 -11.869) 14.432 12.298 ( 8.296 -3.455 6.708) 11.214 12.730 ( -5.475 -11.418 -7.486) 14.710 12.998 ( -5.261 -6.902 -3.611) 9.400 13.293 ( 5.669 -3.735 4.998) 8.430 13.502 ( 5.643 -0.039 -5.077) 7.590 14.089 ( -4.839 3.729 6.241) 8.733 14.567 ( -8.077 1.274 -4.049) 9.124 14.799 ( -1.939 -1.486 -2.251) 3.322 15.523 ( 8.795 -2.176 6.717) 11.279 18.566 ( 3.110 5.174 8.553) 10.468 19.244 ( 0.607 -5.435 -0.872) 5.538 20.000 ( -7.826 9.289 -4.283) 12.880 20.365 ( -6.343 8.071 1.533) 10.379 22.316 ( 6.921 -7.685 -7.531) 12.794 23.929 ( -2.584 0.153 -0.807) 2.711 ======================= Grid point 491 (238/433) ======================= q-point: (-0.33 0.25 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.373 ( 16.499 23.337 9.509) 30.121 3.030 ( 1.735 8.752 25.311) 26.837 3.748 ( -7.664 15.581 3.254) 17.666 5.296 ( -3.167 4.634 -1.441) 5.795 6.489 ( 2.990 -2.479 11.941) 12.557 6.913 ( 5.349 -4.270 -1.157) 6.942 7.600 ( -4.140 -6.761 -1.183) 8.016 8.127 ( 9.734 -7.000 4.234) 12.715 8.526 ( -2.828 14.020 -5.245) 15.234 8.587 ( 1.138 -9.108 0.411) 9.188 8.743 ( -9.992 -1.281 4.726) 11.127 9.220 ( 5.981 -12.396 -8.721) 16.294 9.475 ( 1.878 11.493 10.533) 15.702 9.644 ( 11.500 0.466 -5.245) 12.649 9.890 ( 1.842 -1.694 2.672) 3.661 10.281 ( -3.046 1.254 4.677) 5.720 10.419 ( 5.918 -7.838 6.177) 11.602 10.641 ( 6.597 -6.608 2.483) 9.662 11.165 ( -4.530 -0.743 1.648) 4.877 11.617 ( 1.417 3.113 -1.876) 3.901 12.030 ( 6.214 -1.250 -12.456) 13.976 12.482 ( 5.899 -2.040 -0.105) 6.243 12.693 ( -4.610 -8.084 -7.051) 11.676 12.949 ( -5.576 -6.941 -2.474) 9.241 13.352 ( 2.548 6.757 -5.394) 9.014 13.635 ( 5.960 -7.177 4.567) 10.387 13.994 ( -5.295 5.605 3.310) 8.391 14.392 ( -5.529 2.811 -6.022) 8.645 14.717 ( -4.155 3.164 -5.805) 7.809 15.765 ( 3.949 -12.898 14.634) 19.902 18.639 ( 4.489 5.161 10.285) 12.352 19.203 ( -5.609 0.059 -5.522) 7.871 19.813 ( 0.675 11.610 -4.373) 12.424 20.207 ( -3.558 9.073 -0.654) 9.767 22.455 ( 3.581 -11.793 -5.978) 13.698 23.865 ( -4.108 -0.195 -1.026) 4.238 ======================= Grid point 492 (239/433) ======================= q-point: (-0.25 0.25 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.552 ( 20.496 19.543 11.855) 30.701 3.081 ( -1.432 15.231 19.325) 24.647 3.527 ( -0.949 15.529 10.460) 18.747 5.168 ( -4.185 6.395 -0.545) 7.662 6.652 ( 4.248 -4.641 6.973) 9.392 7.018 ( 7.905 5.526 4.452) 10.623 7.507 ( -7.880 -3.787 -3.135) 9.288 8.246 ( -5.237 3.174 -3.683) 7.146 8.460 ( 0.217 -4.858 3.000) 5.713 8.641 ( -3.631 -1.331 2.858) 4.809 8.750 ( 6.914 -11.470 7.555) 15.377 9.370 ( 1.910 -13.713 -7.552) 15.771 9.477 ( 4.251 13.601 13.210) 19.431 9.767 ( 9.465 1.298 -8.475) 12.770 9.961 ( -0.398 -5.315 3.914) 6.613 10.295 ( 2.243 0.256 5.879) 6.298 10.696 ( 10.953 -11.678 1.032) 16.044 10.861 ( 5.161 -7.890 7.351) 11.955 11.135 ( -1.458 -4.564 1.607) 5.054 11.613 ( 1.420 0.763 -1.208) 2.014 12.049 ( 2.363 -3.048 -12.201) 12.796 12.473 ( -3.823 2.486 -7.881) 9.105 12.654 ( -1.650 -3.275 -5.909) 6.954 12.940 ( -2.366 -5.311 -0.761) 5.864 13.257 ( 1.100 8.773 -5.712) 10.526 13.805 ( 1.786 -5.721 4.933) 7.763 13.838 ( -7.156 5.996 1.070) 9.397 14.297 ( 2.323 3.422 -6.309) 7.544 14.531 ( -6.394 8.011 -8.477) 13.301 16.072 ( -1.557 -24.171 19.868) 31.328 18.699 ( -0.432 7.613 10.840) 13.253 19.058 ( -4.140 -0.016 -5.460) 6.852 19.764 ( 11.821 13.527 -4.812) 18.597 20.034 ( -3.336 12.371 -6.015) 14.154 22.590 ( 0.155 -15.310 -3.026) 15.607 23.794 ( -4.071 -0.569 -0.619) 4.157 ======================= Grid point 493 (240/433) ======================= q-point: (-0.17 0.25 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.695 ( 3.865 16.519 8.936) 19.175 2.999 ( 12.188 22.652 12.387) 28.550 3.593 ( 7.816 6.775 17.908) 20.681 5.060 ( -1.639 5.105 1.169) 5.488 6.722 ( 1.696 3.162 -5.559) 6.617 7.191 ( 13.419 5.078 15.182) 20.889 7.444 ( -5.412 -9.206 -1.728) 10.818 8.082 ( -9.422 -0.920 -4.089) 10.312 8.397 ( -9.952 -2.376 6.268) 11.999 8.669 ( 5.354 1.891 -3.811) 6.839 9.106 ( 9.362 -13.569 8.542) 18.566 9.435 ( -3.889 -10.672 -4.678) 12.284 9.512 ( 5.843 11.147 12.721) 17.894 9.866 ( 8.096 -3.679 -10.343) 13.640 10.003 ( -2.766 -3.831 3.329) 5.780 10.398 ( 3.377 -2.128 4.460) 5.985 10.897 ( 1.905 -5.406 -4.918) 7.552 11.025 ( 5.895 -5.975 6.865) 10.844 11.264 ( 2.679 -11.100 3.002) 11.807 11.641 ( 1.554 -2.691 -1.101) 3.297 12.011 ( -3.995 -3.552 -8.269) 9.846 12.282 ( -5.020 6.090 -5.532) 9.639 12.641 ( 1.368 -1.300 -6.416) 6.687 12.906 ( -3.574 0.235 -4.054) 5.410 13.174 ( 1.863 8.285 -2.663) 8.900 13.715 ( -3.216 2.583 2.857) 5.018 13.855 ( -3.197 -3.604 2.478) 5.418 14.247 ( -6.049 11.239 -4.141) 13.418 14.325 ( 5.274 3.452 -11.204) 12.856 16.380 ( -7.732 -29.175 19.396) 35.878 18.551 ( -10.317 9.668 4.855) 14.950 19.081 ( 4.824 -1.693 1.162) 5.243 19.783 ( -2.576 15.658 -8.506) 18.004 19.891 ( 19.967 12.442 -5.146) 24.082 22.711 ( -2.991 -16.691 -0.608) 16.968 23.734 ( -3.527 -0.541 -0.374) 3.587 ======================= Grid point 494 (241/433) ======================= q-point: (-0.08 0.25 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.592 ( 2.567 14.355 6.584) 16.000 3.173 ( 15.519 14.174 13.272) 24.857 3.790 ( 10.306 5.053 13.316) 17.580 5.038 ( 1.330 1.788 2.510) 3.356 6.639 ( 2.523 9.448 -7.789) 12.502 7.435 ( -7.012 -9.643 -1.332) 11.997 7.503 ( 12.964 -1.761 10.419) 16.726 7.907 ( -10.020 -1.173 0.429) 10.098 8.336 ( -4.215 -3.204 6.536) 8.412 8.732 ( 7.788 2.650 -3.470) 8.929 9.278 ( 0.224 1.741 -0.356) 1.791 9.405 ( -6.771 -7.547 -0.693) 10.163 9.650 ( 7.042 -3.334 6.285) 10.010 9.964 ( 5.803 -5.310 -11.589) 14.007 10.000 ( -2.703 -1.533 5.105) 5.977 10.416 ( -7.320 -3.466 -0.590) 8.120 10.936 ( 4.307 -0.131 -4.522) 6.246 11.208 ( 5.416 -5.081 1.404) 7.558 11.348 ( -5.215 -7.832 -3.025) 9.884 11.641 ( -5.070 -3.461 -3.586) 7.109 11.967 ( -0.231 -4.922 7.745) 9.180 12.232 ( 4.320 0.844 -0.256) 4.409 12.609 ( -0.324 2.211 -8.607) 8.893 12.775 ( -4.467 4.601 -5.412) 8.391 13.177 ( 5.591 2.444 2.928) 6.768 13.655 ( -4.161 3.772 0.637) 5.652 13.792 ( -8.529 4.297 3.227) 10.080 14.062 ( 1.602 4.291 -2.024) 5.007 14.351 ( 6.440 1.846 -10.088) 12.110 16.570 ( -14.028 -25.478 14.205) 32.368 18.314 ( -8.474 9.466 2.315) 12.915 19.121 ( -2.390 4.673 -0.924) 5.329 19.635 ( 8.013 7.106 -4.706) 11.698 20.120 ( 22.209 10.948 -1.880) 24.832 22.792 ( -6.088 -15.655 -0.640) 16.809 23.676 ( -3.395 0.204 -0.651) 3.463 ======================= Grid point 499 (242/433) ======================= q-point: (-0.67 0.33 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 433 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.090 ( -5.701 0.000 6.034) 8.301 3.342 ( -14.760 0.000 -3.951) 15.279 3.735 ( 6.767 -0.000 -1.677) 6.972 5.169 ( 4.770 -0.000 2.804) 5.533 6.282 ( 0.347 -0.000 3.836) 3.851 6.669 ( -12.563 0.000 -1.074) 12.608 6.936 ( 3.915 -0.000 -1.634) 4.242 7.635 ( 9.414 -0.000 -2.626) 9.773 8.323 ( -5.968 0.000 -12.116) 13.506 8.785 ( -2.601 0.000 -0.546) 2.657 8.947 ( 2.891 -0.000 -13.397) 13.706 9.121 ( 3.244 -0.000 -12.152) 12.578 9.803 ( 3.636 -0.000 -14.091) 14.553 9.857 ( 9.409 -0.000 -11.577) 14.918 9.924 ( -0.222 0.000 5.593) 5.597 10.385 ( -0.451 0.000 -4.339) 4.362 10.485 ( -1.164 0.000 5.525) 5.646 10.634 ( -23.178 0.000 15.803) 28.053 11.335 ( -3.083 0.000 4.072) 5.108 11.589 ( 6.447 -0.000 5.247) 8.312 11.917 ( -1.832 0.000 -8.495) 8.690 12.319 ( 3.785 -0.000 -9.873) 10.574 12.485 ( -4.303 0.000 -1.021) 4.423 12.937 ( 0.055 -0.000 -0.741) 0.743 13.048 ( -2.895 0.000 8.517) 8.995 13.407 ( 2.356 -0.000 -2.149) 3.189 14.252 ( -4.573 0.000 10.293) 11.263 14.600 ( -1.518 0.000 6.585) 6.758 14.755 ( 5.941 -0.000 -1.357) 6.094 15.327 ( 4.602 -0.000 -8.537) 9.698 18.665 ( -0.754 0.000 7.030) 7.070 18.683 ( 9.456 -0.000 4.389) 10.424 20.549 ( -8.503 0.000 11.813) 14.555 20.938 ( -17.657 0.000 -14.604) 22.914 21.919 ( 14.577 -0.000 -4.227) 15.178 23.917 ( 3.847 -0.000 1.200) 4.030 ======================= Grid point 501 (243/433) ======================= q-point: (-0.58 0.33 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.965 ( -3.365 14.649 1.038) 15.066 3.141 ( -6.644 3.477 8.628) 11.431 3.873 ( 5.128 -6.995 -1.859) 8.871 5.280 ( 5.493 -1.007 2.421) 6.087 6.373 ( 4.450 -3.019 5.511) 7.700 6.470 ( -8.523 0.168 0.460) 8.537 7.064 ( 6.479 -4.891 5.294) 9.691 7.837 ( 12.023 -5.707 -1.681) 13.414 8.159 ( -3.527 1.199 -12.466) 13.011 8.751 ( -2.108 -1.356 2.580) 3.597 8.938 ( 3.981 -0.845 -10.343) 11.115 9.132 ( 4.473 -0.169 -8.161) 9.308 9.734 ( -1.345 9.419 -3.577) 10.165 9.776 ( 5.169 12.118 -13.641) 18.964 10.063 ( 1.788 -7.719 -1.859) 8.139 10.302 ( -15.692 2.893 12.146) 20.053 10.407 ( -5.144 -4.539 2.006) 7.148 10.443 ( -5.352 0.461 2.318) 5.851 11.301 ( -3.540 0.784 3.786) 5.242 11.767 ( 8.504 3.035 3.010) 9.518 11.856 ( 2.803 -2.444 -6.248) 7.271 12.250 ( 0.197 8.328 -2.935) 8.832 12.479 ( -3.699 -12.552 -5.854) 14.335 12.932 ( -1.089 -1.956 -3.557) 4.203 13.078 ( 0.526 -2.019 7.147) 7.446 13.452 ( 6.529 0.140 -5.910) 8.808 14.220 ( -5.301 2.331 10.763) 12.222 14.609 ( -4.454 -3.724 5.620) 8.080 14.780 ( 0.228 0.077 -4.887) 4.893 15.409 ( 8.994 1.666 -2.993) 9.624 18.667 ( 1.724 7.228 8.057) 10.961 18.910 ( 6.715 -8.835 5.505) 12.388 20.392 ( -12.614 2.891 -1.532) 13.032 20.647 ( -9.037 2.479 -2.847) 9.794 22.094 ( 9.896 -1.816 -7.734) 12.690 23.957 ( 0.366 0.143 0.376) 0.544 ======================= Grid point 502 (244/433) ======================= q-point: (-0.50 0.33 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 794 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.802 ( 3.289 18.304 3.270) 18.882 3.122 ( 0.329 7.020 15.973) 17.450 3.975 ( 2.020 -2.512 -1.382) 3.507 5.371 ( 2.690 0.344 1.865) 3.292 6.375 ( -4.522 -1.095 8.924) 10.064 6.575 ( 8.369 -7.412 0.942) 11.218 7.287 ( 8.423 -5.167 9.657) 13.816 7.981 ( -1.665 -5.404 -11.985) 13.252 8.165 ( 11.342 -5.075 1.168) 12.480 8.754 ( -4.290 -2.004 7.118) 8.549 8.979 ( 5.392 -2.799 -8.232) 10.231 9.127 ( 2.012 5.302 -11.459) 12.786 9.570 ( -1.299 15.131 7.307) 16.853 9.661 ( -0.553 2.483 -13.894) 14.125 9.998 ( -6.374 5.609 6.706) 10.820 10.234 ( -2.729 -5.897 4.028) 7.645 10.363 ( -4.121 1.092 3.111) 5.278 10.441 ( 1.469 -4.133 -0.215) 4.392 11.244 ( -4.462 1.335 2.913) 5.494 11.739 ( 0.107 3.887 -5.054) 6.377 12.004 ( 9.533 2.192 -9.515) 13.646 12.242 ( 4.109 -1.632 7.467) 8.677 12.496 ( -3.595 -11.939 -6.523) 14.072 12.888 ( -3.918 -3.965 -5.888) 8.108 13.201 ( 5.408 -4.530 6.939) 9.896 13.536 ( 8.473 2.035 -7.135) 11.262 14.167 ( -4.342 4.041 8.743) 10.565 14.563 ( -7.568 -1.867 1.536) 7.945 14.740 ( -2.571 -2.911 -4.239) 5.749 15.522 ( 6.123 0.994 1.789) 6.456 18.690 ( 3.347 7.194 9.279) 12.209 19.112 ( 3.493 -7.646 4.098) 9.352 20.141 ( -7.240 5.054 -8.249) 12.084 20.493 ( -6.775 4.933 3.085) 8.931 22.195 ( 5.363 -4.596 -10.263) 12.458 23.933 ( -2.783 0.232 -0.594) 2.855 ======================= Grid point 503 (245/433) ======================= q-point: (-0.42 0.33 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.785 ( 12.081 18.508 7.144) 23.228 3.191 ( 3.270 7.830 19.654) 21.407 3.955 ( -1.543 6.015 -0.949) 6.282 5.372 ( -1.641 3.226 1.441) 3.895 6.425 ( 0.513 -3.745 9.629) 10.344 6.795 ( 7.459 -7.517 3.265) 11.082 7.500 ( 4.306 -2.012 5.198) 7.043 7.986 ( 3.779 -8.150 -1.238) 9.068 8.410 ( 6.816 -7.954 0.022) 10.475 8.703 ( -9.976 -0.144 11.687) 15.366 8.892 ( -2.865 17.417 -16.541) 24.190 9.057 ( 4.634 -4.132 -6.634) 9.087 9.575 ( 0.337 0.459 -5.898) 5.926 9.611 ( 4.735 -2.303 10.265) 11.537 9.933 ( -0.258 5.144 4.380) 6.761 10.293 ( 2.657 -4.591 1.986) 5.664 10.330 ( -1.388 2.084 6.394) 6.867 10.534 ( 4.972 -4.998 0.509) 7.068 11.168 ( -4.728 0.988 1.728) 5.130 11.680 ( 0.187 2.851 -4.367) 5.218 12.015 ( 3.626 0.426 -12.504) 13.026 12.386 ( 0.839 -8.119 -4.583) 9.361 12.561 ( 5.211 -4.592 1.984) 7.223 12.827 ( -4.033 -5.123 -4.701) 8.038 13.400 ( 7.097 -3.326 5.189) 9.400 13.581 ( 5.059 2.865 -5.105) 7.737 14.100 ( -3.845 5.484 5.141) 8.443 14.433 ( -6.192 1.205 -3.328) 7.132 14.696 ( -5.117 -4.558 -3.014) 7.486 15.614 ( 0.469 -3.586 7.449) 8.281 18.756 ( 5.232 6.408 10.693) 13.520 19.183 ( -2.555 -1.809 -0.326) 3.148 19.989 ( 1.447 6.293 -7.554) 9.937 20.357 ( -4.708 6.665 2.490) 8.532 22.250 ( 1.348 -9.019 -10.604) 13.987 23.864 ( -4.360 0.056 -1.108) 4.499 ======================= Grid point 504 (246/433) ======================= q-point: (-0.33 0.33 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 794 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.906 ( 15.634 16.572 8.456) 24.301 3.294 ( 3.340 8.560 19.682) 21.721 3.823 ( -1.359 12.980 0.414) 13.057 5.284 ( -4.364 5.461 1.644) 7.181 6.559 ( 3.867 -4.836 7.400) 9.649 6.999 ( 5.502 -6.980 5.931) 10.685 7.495 ( -2.971 3.040 -1.358) 4.462 8.262 ( 10.497 -11.537 7.841) 17.458 8.417 ( -7.081 7.974 -3.632) 11.266 8.612 ( -7.851 -1.015 8.473) 11.596 8.672 ( 3.399 3.984 -6.846) 8.619 9.147 ( 3.544 -8.483 -7.424) 11.817 9.591 ( 2.485 -1.192 1.917) 3.357 9.772 ( 1.067 -8.476 2.889) 9.018 9.901 ( 0.547 7.757 2.451) 8.153 10.357 ( 4.345 4.387 7.812) 9.958 10.477 ( 7.667 -10.115 4.219) 13.376 10.713 ( 7.945 -7.051 2.069) 10.822 11.103 ( -3.010 -0.009 1.023) 3.179 11.639 ( 0.104 1.336 -3.361) 3.618 11.982 ( -0.228 -3.126 -12.315) 12.707 12.387 ( -3.500 -8.905 -10.842) 14.460 12.668 ( 4.969 2.455 -6.853) 8.813 12.850 ( 2.107 -3.496 6.004) 7.260 13.420 ( -0.103 7.667 -4.205) 8.745 13.690 ( 3.817 -5.761 4.482) 8.237 13.959 ( -7.922 6.587 -0.222) 10.305 14.355 ( 2.315 2.427 -4.411) 5.541 14.606 ( -6.453 -0.848 -4.424) 7.870 15.717 ( -4.387 -12.488 14.151) 19.376 18.859 ( 5.315 7.696 13.372) 16.318 19.068 ( -7.171 2.034 -5.157) 9.064 19.976 ( 10.114 7.704 -6.500) 14.279 20.231 ( -2.856 8.844 -0.913) 9.338 22.298 ( -2.034 -14.391 -8.135) 16.656 23.786 ( -4.069 -0.244 -0.940) 4.183 ======================= Grid point 505 (247/433) ======================= q-point: (-0.25 0.33 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.006 ( 6.400 15.462 5.860) 17.731 3.342 ( 3.956 12.848 13.955) 19.377 3.769 ( 8.042 10.503 6.409) 14.699 5.168 ( -3.899 5.794 2.627) 7.462 6.709 ( 5.145 -3.109 1.984) 6.330 7.171 ( -0.924 -10.949 6.192) 12.613 7.419 ( 3.170 8.092 1.496) 8.819 8.158 ( -6.621 9.537 -8.762) 14.545 8.359 ( -8.835 -1.702 6.723) 11.232 8.675 ( 4.847 -1.121 -3.052) 5.837 8.833 ( 10.405 -12.585 12.423) 20.518 9.226 ( -0.293 -10.304 -7.026) 12.474 9.682 ( 3.367 -2.254 4.498) 6.054 9.813 ( -6.769 -3.393 2.690) 8.035 9.858 ( 2.743 0.774 -3.973) 4.890 10.457 ( 6.186 5.398 7.484) 11.109 10.731 ( 7.594 -10.777 -2.329) 13.388 10.916 ( 4.515 -6.478 7.349) 10.787 11.118 ( 3.310 -3.702 0.364) 4.980 11.620 ( 0.341 -0.089 -2.065) 2.095 11.920 ( -3.475 -4.750 -10.492) 12.030 12.310 ( -5.848 -4.027 -9.561) 11.909 12.659 ( 4.234 2.791 -8.355) 9.773 12.937 ( 2.609 3.797 4.770) 6.631 13.321 ( -0.299 6.398 -3.059) 7.098 13.730 ( -5.994 -1.558 -0.664) 6.228 13.804 ( -3.724 -0.104 1.439) 3.994 14.378 ( 6.089 3.842 -5.126) 8.838 14.443 ( -6.222 5.955 -5.085) 10.002 15.888 ( -6.554 -21.338 17.751) 28.520 18.769 ( -8.918 12.569 3.542) 15.813 19.053 ( 5.457 -0.961 4.549) 7.169 20.040 ( -2.095 8.617 -6.328) 10.894 20.109 ( 15.773 12.323 -4.834) 20.591 22.366 ( -4.558 -18.671 -4.286) 19.691 23.727 ( -2.892 -0.249 -0.533) 2.951 ======================= Grid point 506 (248/433) ======================= q-point: (-0.17 0.33 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 794 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.886 ( -1.270 15.964 1.049) 16.049 3.411 ( 6.737 10.049 13.465) 18.102 3.915 ( 12.717 7.108 6.536) 15.968 5.093 ( -1.677 3.839 3.846) 5.687 6.777 ( 3.785 3.970 -3.237) 6.369 7.217 ( -8.294 -12.440 1.320) 15.009 7.519 ( 9.689 2.732 3.892) 10.793 7.943 ( -3.791 6.331 -4.739) 8.770 8.284 ( -5.764 -1.921 7.696) 9.805 8.740 ( 4.766 -1.449 -3.811) 6.272 9.187 ( 7.990 -9.580 9.270) 15.542 9.236 ( -5.211 -9.261 -5.758) 12.086 9.722 ( -4.260 2.285 1.241) 4.990 9.786 ( 0.098 -7.569 2.788) 8.067 9.880 ( 0.646 -5.949 -8.212) 10.161 10.485 ( -0.118 6.753 1.800) 6.990 10.891 ( 6.147 -5.155 -2.932) 8.542 11.093 ( 4.279 -5.753 6.109) 9.419 11.228 ( 2.331 -4.969 -4.601) 7.162 11.603 ( -2.722 -0.091 -2.437) 3.655 11.855 ( -3.410 -6.315 -0.175) 7.179 12.222 ( -1.302 -2.391 -2.860) 3.949 12.643 ( 1.616 1.943 -9.047) 9.393 12.921 ( 1.318 9.937 0.782) 10.054 13.241 ( 0.008 3.997 0.045) 3.998 13.678 ( -5.029 -0.528 -2.328) 5.567 13.765 ( -1.774 -5.109 3.315) 6.344 14.239 ( -4.422 11.141 -1.169) 12.043 14.404 ( 5.030 3.454 -7.570) 9.723 16.090 ( -8.332 -23.632 14.983) 29.196 18.520 ( -7.369 11.764 1.049) 13.921 19.171 ( 2.958 1.341 5.410) 6.310 19.830 ( -1.244 11.620 -7.234) 13.744 20.312 ( 20.349 9.004 -2.384) 22.380 22.444 ( -6.631 -20.089 -2.256) 21.275 23.683 ( -2.067 0.495 -0.404) 2.163 ======================= Grid point 507 (249/433) ======================= q-point: (-0.08 0.33 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.764 ( 2.037 8.680 -0.982) 8.970 3.498 ( 2.797 6.533 14.314) 15.981 4.083 ( 11.399 6.124 1.697) 13.050 5.077 ( -0.989 1.124 4.594) 4.832 6.753 ( 4.632 8.748 -4.025) 10.686 7.166 ( -11.983 -9.969 0.126) 15.588 7.535 ( -4.698 0.550 -10.920) 11.901 7.980 ( 11.500 -0.334 5.855) 12.909 8.320 ( 1.555 -2.807 7.525) 8.181 8.819 ( 4.439 -2.810 -2.197) 5.695 9.130 ( -10.087 -3.676 -8.646) 13.784 9.355 ( 0.060 -1.028 5.141) 5.243 9.680 ( -2.914 -9.302 -1.876) 9.927 9.865 ( -0.004 -8.123 -5.372) 9.739 9.891 ( -1.131 -4.739 -2.848) 5.643 10.370 ( -2.506 9.183 -2.823) 9.929 10.989 ( 1.898 2.846 -5.605) 6.566 11.115 ( -7.086 -6.271 -10.394) 14.056 11.249 ( 2.291 -2.870 2.963) 4.719 11.540 ( -2.563 -0.461 -0.028) 2.604 12.001 ( 4.634 -9.940 12.973) 16.987 12.277 ( 2.532 -5.543 -0.013) 6.094 12.551 ( -3.891 1.507 -7.763) 8.814 12.814 ( 1.339 12.880 -0.354) 12.954 13.307 ( 7.237 -0.588 3.180) 7.926 13.511 ( -10.144 0.764 -3.474) 10.750 13.826 ( -0.878 5.192 8.912) 10.352 14.138 ( 3.599 3.133 0.413) 4.790 14.392 ( 2.591 1.859 -8.410) 8.994 16.204 ( -11.915 -19.181 7.875) 23.914 18.333 ( -2.465 11.029 1.091) 11.354 19.115 ( -4.917 8.245 -1.863) 9.779 19.805 ( 8.529 1.504 1.677) 8.822 20.554 ( 18.994 8.466 0.673) 20.806 22.482 ( -9.666 -18.358 -3.735) 21.080 23.642 ( -1.175 1.730 -0.359) 2.122 ======================= Grid point 513 (250/433) ======================= q-point: (-0.58 0.42 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 432 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.990 ( -1.212 0.000 5.018) 5.162 3.204 ( 1.799 -0.000 12.640) 12.767 3.929 ( 6.553 -0.000 -3.362) 7.365 5.374 ( 3.665 -0.000 3.209) 4.872 6.361 ( -6.243 0.000 7.913) 10.079 6.499 ( 8.497 -0.000 2.260) 8.793 7.243 ( 10.637 -0.000 11.901) 15.962 7.903 ( 1.306 -0.000 -11.620) 11.693 8.136 ( 7.764 -0.000 -1.761) 7.961 8.733 ( -3.190 0.000 7.458) 8.112 8.951 ( 5.011 -0.000 -8.634) 9.983 9.155 ( 2.799 -0.000 -5.237) 5.938 9.677 ( -1.116 0.000 -11.857) 11.910 9.837 ( -5.981 0.000 -8.016) 10.002 10.024 ( 0.660 -0.000 4.860) 4.904 10.128 ( -10.095 0.000 12.397) 15.988 10.377 ( -3.654 0.000 2.404) 4.374 10.393 ( 2.338 -0.000 -0.417) 2.375 11.262 ( -4.223 0.000 2.878) 5.111 11.779 ( -0.482 0.000 -8.215) 8.229 12.033 ( 13.312 -0.000 0.095) 13.313 12.259 ( -6.004 0.000 -7.244) 9.409 12.331 ( 2.276 -0.000 3.484) 4.161 12.851 ( -3.454 0.000 -7.036) 7.838 13.153 ( 5.353 -0.000 6.293) 8.261 13.557 ( 9.669 -0.000 -6.937) 11.901 14.215 ( -4.349 0.000 10.514) 11.378 14.529 ( -6.738 0.000 4.313) 8.001 14.714 ( -3.317 0.000 -7.241) 7.965 15.534 ( 5.265 -0.000 0.753) 5.319 18.789 ( 1.916 -0.000 8.943) 9.146 19.008 ( 6.160 -0.000 6.516) 8.967 20.190 ( -7.408 0.000 -9.742) 12.239 20.543 ( -6.782 0.000 3.741) 7.746 22.149 ( 4.811 -0.000 -11.345) 12.323 23.935 ( -2.872 0.000 -0.518) 2.919 ======================= Grid point 515 (251/433) ======================= q-point: (-0.50 0.42 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.040 ( 6.701 7.008 8.144) 12.663 3.314 ( 4.125 4.128 14.165) 15.320 4.005 ( 3.924 0.279 -3.248) 5.101 5.417 ( -0.648 1.342 3.813) 4.094 6.365 ( -0.802 -1.945 9.694) 9.920 6.671 ( 7.333 -3.947 3.386) 8.990 7.517 ( 11.884 2.400 13.359) 18.040 7.830 ( -1.568 -6.311 -9.623) 11.615 8.312 ( 10.149 -2.285 -0.079) 10.403 8.699 ( -8.727 -0.013 12.180) 14.984 8.995 ( 4.877 -0.637 -7.741) 9.171 9.138 ( 1.725 4.028 -11.136) 11.967 9.578 ( -2.057 0.560 -10.830) 11.038 9.646 ( -6.617 5.230 5.273) 9.947 10.020 ( -1.203 4.122 8.290) 9.336 10.173 ( 1.060 -7.834 3.616) 8.693 10.367 ( 0.554 1.124 4.709) 4.873 10.461 ( 5.012 -1.964 -0.210) 5.387 11.194 ( -4.546 1.152 1.195) 4.839 11.714 ( -0.805 0.737 -8.648) 8.717 12.068 ( 0.228 5.160 -10.781) 11.954 12.211 ( -0.175 -8.823 -10.268) 13.539 12.507 ( 9.510 -1.423 14.999) 17.817 12.763 ( -1.622 -1.526 -8.002) 8.306 13.325 ( 8.587 -2.643 6.181) 10.906 13.645 ( 5.964 2.136 -6.886) 9.357 14.199 ( -2.369 3.954 7.508) 8.810 14.431 ( -7.779 -1.173 2.185) 8.165 14.604 ( -5.685 -3.181 -7.442) 9.891 15.585 ( -0.966 -0.278 4.350) 4.465 18.858 ( 3.140 3.360 8.024) 9.248 19.147 ( 3.029 -1.412 6.637) 7.431 20.060 ( 0.027 1.558 -9.442) 9.570 20.453 ( -4.964 2.793 3.768) 6.829 22.127 ( -0.009 -3.431 -13.855) 14.273 23.865 ( -4.539 0.060 -1.136) 4.679 ======================= Grid point 516 (252/433) ======================= q-point: (-0.42 0.42 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.163 ( 11.341 9.595 7.150) 16.486 3.430 ( 4.431 5.431 15.659) 17.157 3.995 ( 0.556 5.171 -2.765) 5.890 5.372 ( -4.405 3.500 3.946) 6.872 6.474 ( 3.329 -3.676 9.162) 10.418 6.839 ( 2.884 -7.456 4.512) 9.179 7.592 ( 1.532 6.136 -3.212) 7.093 8.028 ( 11.553 -11.241 9.763) 18.845 8.466 ( 5.159 -1.217 -0.042) 5.301 8.600 ( -11.072 -0.079 13.387) 17.373 8.905 ( -1.668 14.649 -17.097) 22.577 9.058 ( 2.091 -1.050 -6.724) 7.120 9.529 ( -0.148 -4.267 -6.672) 7.921 9.614 ( -4.155 -5.807 7.461) 10.327 10.038 ( 1.605 4.952 8.608) 10.059 10.319 ( 6.002 -6.874 3.158) 9.656 10.429 ( 4.791 2.763 7.518) 9.333 10.596 ( 7.452 -4.522 0.056) 8.717 11.115 ( -3.373 1.071 -0.477) 3.571 11.644 ( -1.122 -0.679 -7.913) 8.021 11.963 ( -1.095 1.496 -10.412) 10.576 12.204 ( -2.252 -9.096 -12.034) 15.252 12.702 ( 6.297 1.024 -10.212) 12.041 12.811 ( 7.351 -0.737 15.595) 17.257 13.505 ( 3.778 -0.430 2.925) 4.797 13.630 ( 0.715 1.067 -3.030) 3.291 14.095 ( -7.313 7.699 0.335) 10.624 14.380 ( 1.329 -0.567 -0.406) 1.501 14.515 ( -6.268 -6.704 -4.586) 10.260 15.576 ( -6.326 -3.294 9.171) 11.618 18.938 ( 3.802 1.015 5.941) 7.126 19.169 ( -1.873 7.067 5.369) 9.071 20.050 ( 5.239 0.693 -5.678) 7.757 20.381 ( -0.142 6.239 1.417) 6.400 22.066 ( -3.995 -9.047 -13.682) 16.883 23.784 ( -4.111 -0.047 -1.107) 4.258 ======================= Grid point 517 (253/433) ======================= q-point: (-0.33 0.42 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.269 ( 7.547 11.324 3.749) 14.116 3.527 ( 2.982 7.238 13.945) 15.992 3.939 ( 3.090 6.284 -0.442) 7.017 5.271 ( -5.195 4.718 4.015) 8.085 6.637 ( 5.455 -4.052 6.630) 9.493 6.949 ( -3.193 -10.279 3.823) 11.423 7.550 ( 3.301 4.541 -3.622) 6.681 8.277 ( -2.343 -2.441 0.358) 3.402 8.450 ( -3.396 11.933 7.593) 14.546 8.625 ( 6.207 -3.947 5.012) 8.901 8.695 ( 3.088 1.491 -4.579) 5.721 9.069 ( -0.632 -5.679 -6.337) 8.533 9.536 ( -3.952 -8.092 -1.311) 9.101 9.653 ( -2.266 -8.657 -1.772) 9.122 10.047 ( 1.611 9.780 8.007) 12.742 10.523 ( 4.907 -4.294 5.913) 8.802 10.561 ( 10.401 -0.813 1.708) 10.571 10.777 ( 5.671 -7.361 2.846) 9.718 11.083 ( 1.042 -0.853 -0.616) 1.481 11.604 ( -0.128 -1.888 -5.613) 5.923 11.874 ( -1.337 0.526 -9.725) 9.830 12.179 ( -2.787 -8.086 -10.431) 13.489 12.709 ( 4.681 2.088 -10.471) 11.658 13.026 ( 8.335 4.338 12.938) 15.990 13.429 ( -4.018 5.319 -2.718) 7.198 13.660 ( -3.929 -4.598 1.289) 6.184 13.869 ( -8.307 5.918 -4.130) 11.004 14.439 ( 6.432 2.226 -3.527) 7.666 14.465 ( -4.041 -3.810 -1.866) 5.859 15.584 ( -7.888 -10.109 14.196) 19.129 18.959 ( -4.538 3.325 -6.080) 8.283 19.104 ( 3.053 9.491 15.302) 18.263 20.109 ( 1.547 -0.200 -0.782) 1.744 20.355 ( 10.295 11.794 -5.010) 16.437 22.024 ( -6.442 -15.962 -10.007) 19.911 23.724 ( -2.401 -0.027 -0.594) 2.473 ======================= Grid point 518 (254/433) ======================= q-point: (-0.25 0.42 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.191 ( -1.638 15.269 -1.373) 15.418 3.567 ( 1.915 6.730 11.344) 13.329 4.016 ( 9.209 2.492 2.272) 9.807 5.176 ( -3.752 4.384 4.343) 7.222 6.785 ( 2.934 -3.193 4.825) 6.487 6.989 ( -3.822 -9.646 -0.402) 10.383 7.567 ( 3.719 1.454 -4.091) 5.717 8.116 ( -5.923 6.296 -7.016) 11.133 8.319 ( -1.463 10.156 7.711) 12.835 8.687 ( 2.739 -3.758 -4.303) 6.336 9.006 ( 12.350 -8.240 13.104) 19.802 9.060 ( -4.337 -8.444 -5.882) 11.167 9.516 ( -9.467 -11.025 0.135) 14.532 9.677 ( -0.852 -9.063 -10.368) 13.797 10.010 ( 1.833 12.176 6.729) 14.032 10.578 ( -0.292 1.844 -0.641) 1.974 10.779 ( 10.025 -4.701 -1.089) 11.126 10.963 ( 4.272 -8.604 7.083) 11.935 11.160 ( 5.235 -2.407 -1.635) 5.989 11.608 ( 1.077 -1.173 -2.576) 3.028 11.777 ( -3.854 0.136 -7.193) 8.162 12.143 ( -2.418 -5.203 -5.420) 7.893 12.685 ( 1.354 2.303 -8.702) 9.103 13.132 ( 5.504 10.729 7.401) 14.148 13.310 ( -4.376 2.800 -1.237) 5.340 13.628 ( -1.227 -4.987 -0.470) 5.157 13.692 ( -7.863 -0.540 -3.353) 8.565 14.406 ( -2.865 4.977 1.100) 5.847 14.470 ( 3.652 3.201 -5.882) 7.627 15.693 ( -5.426 -16.813 14.270) 22.710 18.749 ( -5.765 11.199 -3.233) 13.004 19.204 ( 3.576 2.882 11.540) 12.420 20.025 ( -4.562 7.324 -2.807) 9.073 20.479 ( 18.669 8.988 -4.551) 21.214 22.043 ( -7.229 -20.907 -5.678) 22.839 23.694 ( -0.811 0.626 -0.087) 1.028 ======================= Grid point 519 (255/433) ======================= q-point: (-0.17 0.42 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.978 ( -3.473 13.260 -4.619) 14.465 3.598 ( -0.644 4.210 11.615) 12.371 4.164 ( 8.848 1.333 -0.036) 8.948 5.118 ( -2.435 2.857 4.671) 5.993 6.839 ( -3.310 -3.199 6.125) 7.661 7.008 ( 0.360 -2.826 -6.436) 7.038 7.544 ( -1.348 0.370 -9.990) 10.088 7.996 ( 1.468 0.754 -4.360) 4.662 8.324 ( 4.520 4.537 8.352) 10.525 8.750 ( 2.119 -4.239 -1.557) 4.988 9.004 ( -7.821 -8.198 -6.216) 12.924 9.291 ( 1.905 -5.139 6.371) 8.404 9.458 ( -5.600 -10.676 1.060) 12.102 9.671 ( -2.355 -11.187 -14.938) 18.810 9.972 ( 2.550 9.326 3.456) 10.268 10.503 ( -2.425 4.045 -4.009) 6.190 10.955 ( 7.132 -3.501 -1.342) 8.057 11.096 ( -1.203 0.050 -7.210) 7.310 11.208 ( 1.488 -0.974 0.704) 1.913 11.558 ( -2.235 2.661 -0.770) 3.559 11.800 ( 2.787 -9.882 7.657) 12.808 12.164 ( 0.529 -5.824 -1.589) 6.060 12.583 ( -5.544 1.844 -7.349) 9.389 13.063 ( -0.956 10.776 -1.319) 10.898 13.313 ( 5.772 2.315 6.763) 9.187 13.524 ( -6.868 0.862 -5.378) 8.765 13.770 ( 4.966 -7.932 4.954) 10.588 14.289 ( -3.497 9.445 3.506) 10.664 14.439 ( 0.819 2.647 -6.639) 7.194 15.851 ( -4.898 -16.899 8.141) 19.387 18.557 ( -1.859 11.978 -1.009) 12.163 19.242 ( -2.137 4.905 4.067) 6.720 19.890 ( 0.580 6.619 0.643) 6.675 20.695 ( 17.203 6.462 -0.424) 18.381 22.095 ( -8.010 -21.344 -5.008) 23.341 23.679 ( 0.305 1.982 0.208) 2.016 ======================= Grid point 520 (256/433) ======================= q-point: (-0.08 0.42 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.801 ( -3.256 5.072 -5.496) 8.157 3.596 ( -4.366 1.597 10.770) 11.730 4.262 ( 5.413 1.920 -2.460) 6.248 5.090 ( -1.866 1.469 4.743) 5.304 6.829 ( -7.800 -4.614 7.510) 11.769 6.969 ( 3.325 5.774 -9.078) 11.261 7.407 ( -2.987 4.053 -13.039) 13.977 8.087 ( 6.753 -8.512 -5.536) 12.194 8.453 ( 8.403 0.745 4.185) 9.417 8.805 ( -3.482 -2.734 0.819) 4.502 8.875 ( -6.934 -5.406 -7.766) 11.731 9.202 ( -13.478 -9.081 -3.747) 16.678 9.596 ( 2.203 -7.651 -8.776) 11.849 9.666 ( 0.509 -9.705 -0.705) 9.744 9.945 ( 1.981 6.339 -1.567) 6.823 10.413 ( 0.906 6.170 -2.190) 6.609 10.815 ( -12.050 5.234 -16.295) 20.932 11.080 ( 3.817 -1.565 1.254) 4.312 11.268 ( 0.436 -1.407 2.026) 2.505 11.527 ( -0.097 1.988 -1.209) 2.329 12.066 ( 4.884 -11.661 14.689) 19.381 12.206 ( -2.178 -7.031 -2.984) 7.942 12.415 ( -7.667 -1.070 -4.816) 9.117 12.984 ( 2.999 8.173 3.041) 9.222 13.386 ( -3.474 4.502 -3.101) 6.477 13.467 ( 8.981 0.903 5.532) 10.586 13.912 ( 0.239 1.513 8.810) 8.942 14.222 ( 0.812 0.638 4.716) 4.828 14.381 ( 1.357 2.416 -7.717) 8.199 15.913 ( -7.930 -11.838 0.080) 14.248 18.451 ( 2.725 11.510 0.692) 11.848 19.090 ( -6.233 8.750 -2.961) 11.143 19.965 ( 6.677 -1.321 8.744) 11.081 20.904 ( 13.181 4.670 3.409) 14.394 22.099 ( -9.957 -17.602 -8.215) 21.827 23.672 ( 1.809 3.173 0.435) 3.679 ======================= Grid point 527 (257/433) ======================= q-point: ( 0.50 -0.50 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 433 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.258 ( 9.612 0.000 7.226) 12.026 3.486 ( 4.337 0.000 13.345) 14.032 4.041 ( 1.738 -0.000 -3.559) 3.961 5.408 ( -4.492 0.000 5.078) 6.780 6.435 ( 2.900 0.000 10.269) 10.671 6.763 ( 3.048 -0.000 3.607) 4.723 7.681 ( -2.171 0.000 -10.619) 10.839 7.889 ( 16.768 0.000 16.970) 23.857 8.447 ( 8.132 0.000 -2.642) 8.550 8.601 ( -12.553 0.000 15.336) 19.819 9.027 ( 3.391 -0.000 -7.437) 8.174 9.102 ( -0.293 0.000 -14.570) 14.573 9.469 ( -3.160 0.000 -10.212) 10.690 9.570 ( -7.599 0.000 7.304) 10.540 10.092 ( -0.189 0.000 11.498) 11.499 10.228 ( 7.836 -0.000 3.875) 8.742 10.456 ( 4.556 0.000 7.537) 8.807 10.554 ( 7.523 0.000 -1.773) 7.730 11.129 ( -3.742 0.000 -1.494) 4.029 11.633 ( -1.671 0.000 -10.000) 10.139 12.009 ( -1.930 0.000 -8.371) 8.590 12.084 ( -0.833 0.000 -13.538) 13.563 12.711 ( 6.214 0.000 -11.940) 13.460 12.808 ( 9.457 0.000 20.528) 22.602 13.481 ( 6.414 -0.000 5.150) 8.226 13.659 ( -1.275 0.000 -5.961) 6.095 14.225 ( -4.138 -0.000 1.728) 4.485 14.309 ( -6.938 0.000 3.554) 7.796 14.452 ( -1.508 0.000 -8.537) 8.669 15.550 ( -6.845 0.000 7.676) 10.285 18.942 ( 1.834 -0.000 3.092) 3.595 19.251 ( 2.417 0.000 9.931) 10.221 20.047 ( 2.320 -0.000 -5.001) 5.513 20.445 ( 1.221 0.000 1.837) 2.206 21.975 ( -4.846 0.000 -16.279) 16.985 23.783 ( -4.135 0.000 -1.157) 4.294 ======================= Grid point 529 (258/433) ======================= q-point: (-0.42 0.50 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.421 ( 7.996 4.133 2.404) 9.317 3.627 ( 4.442 2.900 13.355) 14.370 4.008 ( -1.682 1.383 -3.074) 3.767 5.339 ( -5.946 1.981 5.104) 8.082 6.568 ( 3.396 -2.457 10.237) 11.062 6.814 ( -0.245 -3.446 1.664) 3.835 7.599 ( 0.584 0.992 -8.610) 8.687 8.225 ( 5.760 -1.695 6.192) 8.625 8.532 ( 1.828 0.733 11.396) 11.564 8.561 ( 3.190 -2.512 6.807) 7.926 8.914 ( -2.734 12.848 -14.330) 19.439 9.000 ( -2.728 -1.757 -6.235) 7.029 9.407 ( -1.775 -5.741 -7.779) 9.830 9.510 ( -6.543 -4.488 4.868) 9.308 10.173 ( 2.743 3.072 11.715) 12.418 10.421 ( 9.477 -3.173 2.863) 10.396 10.584 ( 5.721 0.520 6.238) 8.480 10.671 ( 5.532 -2.840 -2.028) 6.540 11.072 ( -0.559 -0.359 -2.735) 2.815 11.568 ( -0.178 -1.222 -7.354) 7.457 11.922 ( 0.439 3.645 -9.073) 9.787 12.036 ( -0.095 -6.088 -10.444) 12.089 12.737 ( 5.602 0.753 -11.010) 12.377 13.083 ( 9.176 1.556 17.447) 19.774 13.520 ( -5.076 3.636 -1.432) 6.406 13.580 ( -3.874 -3.401 0.373) 5.169 14.008 ( -10.258 7.367 -6.933) 14.407 14.319 ( -1.626 -8.321 3.144) 9.042 14.476 ( 6.604 0.911 -4.570) 8.083 15.477 ( -9.110 -2.066 11.594) 14.890 18.969 ( 0.558 -0.242 -2.566) 2.638 19.301 ( 0.023 7.178 11.705) 13.730 20.070 ( -0.649 -2.400 3.553) 4.336 20.526 ( 11.615 5.109 -3.305) 13.112 21.794 ( -8.398 -6.787 -15.623) 18.991 23.725 ( -2.138 0.020 -0.602) 2.221 ======================= Grid point 530 (259/433) ======================= q-point: (-0.33 0.50 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 794 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.443 ( 1.150 9.781 -1.143) 9.915 3.691 ( 0.232 6.686 8.441) 10.770 4.000 ( 2.355 -3.930 0.133) 4.584 5.249 ( -5.014 2.997 4.368) 7.294 6.671 ( -5.062 -6.558 11.061) 13.820 6.885 ( 7.393 -2.256 -3.609) 8.531 7.573 ( 1.852 -0.470 -7.830) 8.060 8.145 ( -10.954 -0.133 -0.104) 10.955 8.614 ( 3.818 -2.730 -5.308) 7.085 8.647 ( -0.873 17.773 -5.422) 18.602 8.888 ( 14.167 -3.463 17.487) 22.770 8.928 ( -4.851 -5.304 -5.011) 8.762 9.362 ( -6.980 -4.880 -1.020) 8.577 9.496 ( -3.361 -9.356 -7.077) 12.203 10.223 ( 2.103 9.109 7.994) 12.300 10.562 ( 1.287 -2.088 -0.155) 2.457 10.731 ( 10.403 -1.407 -0.747) 10.524 10.780 ( 2.462 -8.687 3.965) 9.862 11.118 ( 5.565 -2.111 -1.390) 6.112 11.564 ( 1.819 -2.096 -4.194) 5.029 11.842 ( -0.065 4.740 -8.414) 9.658 12.048 ( 0.972 -4.297 -6.193) 7.600 12.726 ( 0.700 1.782 -7.665) 7.900 13.254 ( 1.558 1.184 5.933) 6.248 13.376 ( -3.542 4.581 3.525) 6.778 13.534 ( -5.179 -4.219 1.389) 6.823 13.745 ( -6.796 5.642 -8.820) 12.482 14.407 ( 1.311 -3.986 3.369) 5.382 14.524 ( 2.778 2.050 -4.612) 5.761 15.467 ( -5.199 -6.808 12.853) 15.446 18.909 ( -1.699 4.902 -6.855) 8.597 19.301 ( -0.107 6.712 13.873) 15.411 20.086 ( -4.060 -0.456 6.717) 7.862 20.668 ( 17.489 9.963 -7.262) 21.398 21.674 ( -8.884 -16.250 -10.837) 21.458 23.705 ( 0.077 0.438 0.184) 0.481 ======================= Grid point 531 (260/433) ======================= q-point: (-0.25 0.50 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.255 ( -5.496 14.954 -4.735) 16.621 3.668 ( -2.645 3.223 8.079) 9.092 4.119 ( 4.685 -5.859 -0.664) 7.531 5.174 ( -3.533 2.715 3.531) 5.685 6.683 ( -8.357 -8.905 8.942) 15.136 7.030 ( 11.740 1.946 -6.422) 13.522 7.551 ( 0.915 0.279 -9.191) 9.241 7.975 ( -7.580 -2.342 -3.902) 8.841 8.484 ( 1.299 9.486 -3.026) 10.041 8.673 ( 2.592 -2.828 -3.063) 4.909 8.847 ( -7.237 -7.479 -4.944) 11.521 9.188 ( -3.551 -4.334 5.001) 7.511 9.327 ( 5.761 -3.021 8.836) 10.972 9.465 ( -3.720 -9.737 -14.352) 17.738 10.169 ( -0.173 10.427 2.679) 10.767 10.535 ( -2.105 0.070 -4.022) 4.540 10.918 ( 9.990 -0.896 -2.135) 10.255 10.977 ( 4.148 -10.941 6.547) 13.408 11.217 ( 4.488 0.171 -3.445) 5.660 11.615 ( 2.868 -1.296 -1.534) 3.501 11.699 ( -4.668 3.682 -3.043) 6.679 12.073 ( 0.855 -3.210 -2.726) 4.297 12.618 ( -7.113 1.698 -5.576) 9.196 13.154 ( -8.217 -0.287 -2.191) 8.508 13.399 ( 3.233 3.617 5.963) 7.687 13.589 ( 2.740 3.878 -5.693) 7.414 13.602 ( 2.026 -4.912 4.778) 7.146 14.431 ( -4.241 4.829 4.094) 7.621 14.475 ( -0.060 0.704 -3.450) 3.521 15.582 ( 0.134 -10.519 7.574) 12.962 18.773 ( -0.571 9.870 -4.612) 10.909 19.317 ( -1.960 3.388 9.065) 9.874 20.018 ( -4.087 5.561 5.360) 8.738 20.821 ( 14.781 7.386 -3.697) 16.933 21.684 ( -5.626 -20.825 -7.479) 22.831 23.714 ( 1.607 1.587 0.773) 2.387 ======================= Grid point 532 (261/433) ======================= q-point: (-0.17 0.50 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 794 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.972 ( -7.931 12.409 -5.797) 15.827 3.621 ( -6.804 1.097 7.966) 10.534 4.230 ( 2.926 -5.355 -2.474) 6.584 5.124 ( -2.074 1.795 2.873) 3.972 6.688 ( -6.569 -7.866 6.812) 12.305 7.112 ( 7.846 7.449 -7.224) 13.009 7.486 ( 1.790 3.818 -11.926) 12.650 7.935 ( 1.144 -7.354 -6.107) 9.627 8.468 ( 3.637 0.490 -1.816) 4.094 8.717 ( -0.102 -5.242 -2.061) 5.633 8.767 ( -7.364 -6.529 -5.247) 11.153 9.039 ( -15.020 -6.292 -2.543) 16.482 9.388 ( -5.824 -12.168 -16.262) 21.129 9.596 ( 11.993 1.080 9.304) 15.218 10.081 ( 0.107 7.511 -0.802) 7.555 10.487 ( 0.526 1.900 -2.242) 2.985 10.949 ( -5.856 6.853 -15.408) 17.852 11.074 ( 3.537 -0.028 -0.225) 3.544 11.241 ( 1.362 -1.097 3.693) 4.086 11.568 ( 0.380 2.596 0.021) 2.624 11.830 ( 5.780 -11.345 11.621) 17.238 12.086 ( -2.808 -5.267 -3.128) 6.739 12.412 ( -10.966 0.472 -5.834) 12.430 13.049 ( -3.587 -0.585 1.750) 4.034 13.450 ( 3.652 1.153 -2.984) 4.854 13.578 ( 7.277 10.435 6.254) 14.176 13.812 ( 6.128 -9.284 5.140) 12.254 14.280 ( -8.512 3.647 3.604) 9.937 14.458 ( 1.594 4.550 -1.554) 5.066 15.707 ( -0.514 -9.174 -0.285) 9.193 18.673 ( 3.013 11.171 -1.239) 11.637 19.233 ( -6.294 5.710 -0.090) 8.498 19.984 ( 0.853 3.075 10.018) 10.513 20.961 ( 6.844 1.264 3.171) 7.648 21.759 ( -1.965 -16.924 -9.911) 19.710 23.733 ( 2.691 3.029 0.984) 4.170 ======================= Grid point 533 (262/433) ======================= q-point: (-0.08 -0.50 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.703 ( -10.118 5.489 -4.703) 12.435 3.514 ( -11.166 -1.931 5.481) 12.587 4.278 ( -0.785 -3.128 -1.611) 3.605 5.112 ( 0.467 1.177 2.726) 3.006 6.686 ( -4.508 -3.181 4.079) 6.862 7.064 ( 0.685 7.323 -7.741) 10.678 7.418 ( 6.487 9.226 -10.025) 15.089 8.058 ( 7.523 -10.335 -9.454) 15.899 8.534 ( 1.869 -5.084 -4.223) 6.869 8.618 ( -10.646 0.071 -6.720) 12.590 8.757 ( -1.055 -9.253 -4.080) 10.168 8.874 ( -8.951 -7.737 -1.573) 11.936 9.317 ( -5.769 -12.441 -13.653) 19.351 9.743 ( 1.797 0.597 -2.242) 2.934 10.078 ( 8.340 6.270 4.651) 11.424 10.495 ( 3.404 3.008 0.431) 4.563 10.585 ( -12.473 8.467 -14.881) 21.183 11.116 ( -0.434 -0.114 0.996) 1.093 11.260 ( -1.128 0.016 0.140) 1.137 11.549 ( 0.392 3.408 -1.450) 3.724 12.014 ( -7.023 -5.634 1.585) 9.142 12.126 ( 0.582 -6.512 -0.980) 6.611 12.263 ( -2.138 -9.058 6.389) 11.289 13.076 ( 2.577 -1.023 5.097) 5.802 13.449 ( 3.604 7.887 -2.376) 8.991 13.676 ( 6.469 5.923 6.768) 11.079 13.949 ( -0.522 -2.469 5.569) 6.114 14.214 ( -1.477 -2.707 5.839) 6.604 14.443 ( 4.747 3.997 -2.463) 6.676 15.711 ( -4.682 -4.887 -6.815) 9.605 18.633 ( 4.581 11.293 0.279) 12.190 19.050 ( -5.046 7.191 -2.597) 9.161 20.097 ( 3.234 -2.857 13.454) 14.129 21.049 ( -2.767 -5.300 7.284) 9.423 21.805 ( 1.570 -8.150 -13.754) 16.064 23.759 ( 3.850 3.743 0.861) 5.438 ======================= Grid point 541 (263/433) ======================= q-point: ( 0.58 -0.42 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 432 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.536 ( 2.911 -0.000 0.388) 2.936 3.800 ( 5.635 -0.000 8.717) 10.380 3.917 ( -6.792 0.000 -3.172) 7.497 5.280 ( -5.519 0.000 4.352) 7.029 6.601 ( -6.245 0.000 11.548) 13.128 6.866 ( 9.827 -0.000 -3.139) 10.316 7.565 ( 1.658 -0.000 -8.849) 9.003 8.144 ( -11.918 0.000 1.436) 12.004 8.582 ( 3.732 -0.000 -8.135) 8.951 8.815 ( 2.787 -0.000 -3.880) 4.777 8.868 ( -7.033 0.000 -5.018) 8.640 8.913 ( 11.456 -0.000 15.303) 19.116 9.319 ( 0.410 -0.000 -10.271) 10.280 9.373 ( -9.899 0.000 4.055) 10.697 10.321 ( 4.411 -0.000 10.496) 11.385 10.532 ( 0.443 -0.000 2.630) 2.667 10.687 ( 1.017 -0.000 -3.162) 3.322 10.718 ( 10.421 -0.000 -0.034) 10.421 11.092 ( 5.308 -0.000 -1.788) 5.601 11.544 ( 1.990 -0.000 -4.134) 4.588 11.906 ( 0.159 -0.000 -8.955) 8.957 11.993 ( 4.833 -0.000 -6.062) 7.753 12.745 ( 0.537 -0.000 -7.197) 7.217 13.254 ( -2.266 0.000 4.445) 4.989 13.430 ( -3.361 0.000 4.040) 5.255 13.485 ( -6.049 0.000 2.449) 6.526 13.828 ( -6.313 0.000 -10.011) 11.836 14.341 ( 3.825 -0.000 5.955) 7.078 14.544 ( 2.949 -0.000 -4.642) 5.499 15.408 ( -5.579 0.000 12.093) 13.318 18.951 ( 0.555 -0.000 -6.277) 6.302 19.386 ( -2.445 0.000 11.158) 11.422 20.066 ( -3.575 0.000 12.180) 12.694 20.788 ( 19.186 -0.000 -6.643) 20.303 21.494 ( -11.630 0.000 -14.697) 18.742 23.710 ( 0.397 -0.000 0.291) 0.492 ======================= Grid point 543 (264/433) ======================= q-point: (-0.33 0.58 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.508 ( -2.955 9.133 -0.503) 9.612 3.730 ( -6.908 3.629 1.614) 7.968 3.965 ( 2.462 -8.551 0.004) 8.899 5.213 ( -4.277 1.120 2.500) 5.079 6.558 ( -7.169 -3.576 9.111) 12.132 7.054 ( 14.850 0.565 -5.208) 15.747 7.554 ( 3.208 0.098 -8.561) 9.143 7.937 ( -12.207 -1.194 -1.683) 12.381 8.569 ( -0.043 0.081 -8.538) 8.538 8.685 ( -2.521 2.510 -9.299) 9.956 8.737 ( -7.111 -3.501 -6.052) 9.972 9.174 ( -7.405 2.976 1.458) 8.113 9.277 ( -3.726 -5.242 -5.671) 8.575 9.340 ( 14.397 -1.167 11.563) 18.502 10.361 ( -0.895 9.403 2.806) 9.854 10.512 ( -2.626 -3.633 -1.597) 4.758 10.759 ( 3.998 -8.076 6.122) 10.894 10.915 ( 12.261 -0.082 -2.299) 12.475 11.199 ( 7.014 -1.185 -2.337) 7.487 11.577 ( 3.414 -1.019 -1.613) 3.911 11.809 ( -3.746 4.101 -8.040) 9.773 12.041 ( 1.962 -0.504 -3.715) 4.232 12.643 ( -8.624 0.751 -3.401) 9.300 13.124 ( -9.577 -1.509 -1.794) 9.859 13.424 ( -1.640 -0.084 2.694) 3.154 13.474 ( 2.522 -3.360 1.063) 4.333 13.753 ( 4.192 5.999 -1.607) 7.493 14.450 ( 2.963 -1.546 5.630) 6.548 14.495 ( -5.756 1.215 -1.418) 6.051 15.454 ( 2.071 -3.031 6.702) 7.642 18.908 ( 1.519 3.688 -7.186) 8.218 19.374 ( -4.675 2.051 9.620) 10.891 20.081 ( -4.511 1.202 14.469) 15.204 21.001 ( 13.778 11.230 -8.323) 19.627 21.318 ( -5.237 -16.351 -9.805) 19.772 23.736 ( 2.360 0.608 1.119) 2.682 ======================= Grid point 544 (265/433) ======================= q-point: (-0.25 -0.42 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.253 ( -9.597 15.883 -2.848) 18.774 3.630 ( -8.614 -0.857 5.706) 10.368 4.072 ( 1.203 -9.997 -3.769) 10.752 5.153 ( -2.575 1.104 0.776) 2.907 6.560 ( -3.189 -4.987 6.828) 9.037 7.238 ( 12.616 5.268 -6.521) 15.147 7.551 ( 5.083 3.169 -9.661) 11.367 7.801 ( -4.565 -6.600 -4.821) 9.362 8.477 ( -2.508 1.095 -7.393) 7.883 8.616 ( -3.291 -5.283 -8.433) 10.481 8.639 ( -4.732 -5.827 -6.682) 10.050 8.984 ( -12.794 0.230 1.163) 12.849 9.182 ( -6.312 -8.682 -14.420) 17.977 9.653 ( 12.920 3.665 10.426) 17.002 10.238 ( -1.512 8.937 0.335) 9.070 10.501 ( 0.256 -0.543 -1.449) 1.568 10.959 ( 1.945 -7.322 1.090) 7.654 11.066 ( 8.105 1.140 -2.915) 8.689 11.257 ( 1.351 1.963 -3.398) 4.150 11.645 ( -1.767 5.101 -1.803) 5.692 11.675 ( 3.872 -4.310 4.598) 7.397 12.006 ( -4.722 -3.145 -4.088) 6.994 12.425 ( -13.166 0.705 -4.247) 13.852 13.015 ( -4.695 -1.988 1.518) 5.319 13.455 ( 3.612 -0.419 0.643) 3.692 13.633 ( 7.906 -7.829 2.570) 11.419 13.777 ( 6.212 8.641 2.446) 10.919 14.340 ( -9.922 2.564 2.415) 10.529 14.517 ( 1.335 1.250 4.347) 4.716 15.572 ( 4.324 -4.629 -1.339) 6.474 18.860 ( 3.901 7.668 -4.169) 9.560 19.304 ( -6.825 1.920 3.795) 8.041 20.062 ( -3.732 4.257 13.659) 14.786 20.959 ( -5.098 -1.137 0.301) 5.232 21.486 ( 11.683 -10.527 -11.395) 19.421 23.781 ( 3.399 1.844 1.426) 4.122 ======================= Grid point 545 (266/433) ======================= q-point: (-0.17 -0.42 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.902 ( -12.743 14.432 -1.782) 19.335 3.485 ( -14.003 -1.333 4.775) 14.854 4.148 ( -1.638 -9.987 -2.575) 10.443 5.128 ( 0.547 0.523 0.099) 0.763 6.622 ( 1.413 -3.167 4.292) 5.519 7.220 ( -0.172 9.029 -7.566) 11.781 7.589 ( 11.628 7.890 -10.178) 17.350 7.857 ( 4.887 -10.312 -6.743) 13.255 8.412 ( -2.584 -6.650 -9.339) 11.753 8.569 ( -6.733 -4.735 -7.691) 11.265 8.577 ( -2.735 -8.684 -7.268) 11.650 8.801 ( -8.413 -0.400 2.141) 8.691 9.094 ( -4.793 -10.144 -12.078) 16.485 9.769 ( 0.803 1.611 -2.503) 3.083 10.220 ( 7.841 8.950 7.266) 13.943 10.516 ( 1.132 -0.231 -0.088) 1.159 10.784 ( -10.890 9.852 -15.168) 21.113 11.117 ( 0.078 0.349 -1.906) 1.939 11.268 ( 0.103 0.119 2.695) 2.699 11.615 ( 1.559 3.580 0.223) 3.911 11.888 ( 0.998 -8.133 9.897) 12.849 11.951 ( 0.418 -7.811 0.719) 7.856 12.180 ( -11.637 -1.676 -5.897) 13.153 13.034 ( 2.016 -2.570 4.133) 5.268 13.533 ( 5.094 1.519 -0.424) 5.333 13.824 ( 5.182 6.284 6.658) 10.520 13.841 ( 4.132 -5.960 2.095) 7.549 14.202 ( -3.864 1.813 4.639) 6.303 14.530 ( 1.066 3.746 2.595) 4.679 15.631 ( 0.795 -3.339 -7.988) 8.694 18.841 ( 4.952 9.955 -0.941) 11.158 19.161 ( -6.259 3.925 -2.004) 7.655 20.078 ( -1.387 0.818 14.868) 14.955 20.893 ( -12.123 -9.805 6.244) 16.796 21.694 ( 13.686 -3.580 -13.218) 19.361 23.826 ( 3.864 2.999 1.094) 5.012 ======================= Grid point 546 (267/433) ======================= q-point: (-0.08 -0.42 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.549 ( -15.058 9.847 1.154) 18.028 3.263 ( -17.957 -4.190 2.758) 18.644 4.166 ( -6.141 -8.025 1.038) 10.158 5.167 ( 4.129 0.443 0.702) 4.211 6.691 ( 3.049 2.299 0.864) 3.915 7.040 ( -3.859 7.282 -10.279) 13.175 7.619 ( 8.227 9.995 -3.859) 13.508 8.037 ( 8.307 -10.958 -9.247) 16.571 8.357 ( -7.417 -7.060 -10.817) 14.895 8.436 ( -3.841 -1.386 -6.916) 8.032 8.617 ( 2.840 -9.035 -7.970) 12.378 8.773 ( 0.844 -4.597 -0.497) 4.701 9.089 ( -0.797 -9.551 -5.316) 10.959 9.678 ( -4.853 0.769 -7.988) 9.378 10.340 ( -4.981 7.078 0.909) 8.702 10.364 ( -0.044 5.110 -3.538) 6.215 10.586 ( 2.845 3.935 -0.289) 4.864 11.038 ( -8.822 -1.151 -0.461) 8.909 11.240 ( -2.039 2.130 -0.806) 3.057 11.591 ( 0.798 4.425 -0.453) 4.519 11.899 ( -1.252 -2.977 1.424) 3.530 11.977 ( -6.194 -3.075 -8.427) 10.902 12.279 ( 6.150 -13.837 15.397) 21.595 13.151 ( 5.078 -2.141 4.273) 6.973 13.562 ( 2.958 5.138 -1.698) 6.167 13.788 ( -6.503 6.174 6.691) 11.188 13.997 ( 10.023 -4.364 2.138) 11.139 14.249 ( 1.585 0.784 7.896) 8.092 14.544 ( 4.373 1.867 0.179) 4.758 15.561 ( -4.258 -0.660 -11.446) 12.231 18.764 ( -2.357 9.979 -1.915) 10.430 19.080 ( 3.943 5.383 -0.338) 6.681 20.167 ( -1.357 -4.061 14.876) 15.480 20.800 ( -16.975 -12.914 5.855) 22.118 21.851 ( 13.601 1.430 -12.369) 18.440 23.866 ( 4.042 3.246 0.406) 5.200 ======================= Grid point 555 (268/433) ======================= q-point: (-0.33 -0.33 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 433 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.514 ( -6.641 0.000 5.499) 8.622 3.547 ( -13.170 0.000 -1.246) 13.229 3.944 ( 1.285 -0.000 -5.108) 5.268 5.164 ( -2.801 0.000 -0.094) 2.802 6.510 ( -1.907 0.000 6.873) 7.133 7.293 ( 17.041 -0.000 -6.699) 18.311 7.599 ( 8.114 -0.000 -7.613) 11.126 7.714 ( -10.792 0.000 -4.553) 11.713 8.519 ( -0.900 0.000 -6.937) 6.995 8.535 ( -7.251 0.000 -12.078) 14.087 8.572 ( -5.740 0.000 -8.160) 9.977 9.011 ( -13.051 0.000 3.682) 13.560 9.078 ( -4.867 0.000 -16.230) 16.944 9.695 ( 11.971 -0.000 10.192) 15.722 10.376 ( -2.649 0.000 1.415) 3.004 10.465 ( 0.839 -0.000 -0.194) 0.861 10.848 ( 5.651 -0.000 6.493) 8.608 11.082 ( 8.441 -0.000 -3.092) 8.989 11.275 ( 4.339 -0.000 -5.456) 6.971 11.635 ( 4.446 -0.000 1.687) 4.755 11.718 ( -3.870 0.000 -3.952) 5.531 11.969 ( -7.385 0.000 -4.427) 8.611 12.433 ( -13.943 0.000 -3.189) 14.303 12.994 ( -4.093 0.000 1.432) 4.336 13.444 ( 2.418 -0.000 3.788) 4.494 13.555 ( 8.968 -0.000 -0.213) 8.970 13.867 ( 4.961 -0.000 0.389) 4.976 14.369 ( -9.438 0.000 2.953) 9.890 14.521 ( 1.592 -0.000 6.523) 6.715 15.529 ( 5.807 -0.000 -1.945) 6.124 18.939 ( 4.835 -0.000 -6.010) 7.714 19.320 ( -7.866 0.000 5.587) 9.648 20.110 ( -5.070 0.000 17.333) 18.059 20.941 ( -14.020 0.000 -3.697) 14.500 21.382 ( 21.187 -0.000 -10.935) 23.843 23.800 ( 3.669 -0.000 1.593) 3.999 ======================= Grid point 556 (269/433) ======================= q-point: (-0.25 -0.33 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.206 ( -14.291 15.139 2.020) 20.916 3.435 ( -15.281 -5.238 6.178) 17.295 3.947 ( -1.419 -8.232 -6.365) 10.502 5.135 ( 0.571 0.203 -1.655) 1.763 6.576 ( 4.699 -1.329 4.378) 6.559 7.411 ( 1.157 10.693 -7.034) 12.852 7.615 ( 5.599 -9.111 -8.507) 13.665 7.746 ( 13.406 1.871 -6.548) 15.037 8.317 ( -9.673 -2.575 -11.755) 15.440 8.443 ( -5.030 -4.504 -10.765) 12.707 8.484 ( -0.681 -2.778 -6.889) 7.459 8.826 ( -9.170 2.260 2.888) 9.876 8.942 ( -4.058 -5.339 -11.132) 12.996 9.792 ( -1.019 0.661 -3.466) 3.672 10.399 ( 5.953 8.171 7.539) 12.611 10.494 ( 0.943 -2.228 1.262) 2.729 10.896 ( -3.395 1.484 -8.810) 9.558 11.122 ( -2.157 -0.176 -2.483) 3.294 11.269 ( 0.329 0.601 -0.134) 0.698 11.683 ( 2.009 2.903 2.428) 4.285 11.767 ( 6.435 -2.928 6.813) 9.818 11.839 ( -4.954 -4.305 -1.801) 6.806 12.163 ( -14.801 -0.328 -5.495) 15.792 12.998 ( 1.886 -0.931 3.042) 3.699 13.536 ( 4.938 -0.579 3.337) 5.988 13.721 ( 5.215 -3.455 2.332) 6.676 13.930 ( 5.121 2.605 1.536) 5.947 14.258 ( -3.909 2.619 4.630) 6.601 14.569 ( -0.192 0.576 6.058) 6.088 15.587 ( 3.764 -1.161 -9.254) 10.058 18.993 ( 7.080 4.944 -3.070) 9.165 19.196 ( -8.437 0.133 0.464) 8.451 20.112 ( -5.307 1.835 16.344) 17.282 20.729 ( -14.687 -5.575 3.598) 16.116 21.654 ( 18.787 -0.908 -12.147) 22.390 23.867 ( 3.921 1.145 1.239) 4.269 ======================= Grid point 557 (270/433) ======================= q-point: (-0.17 -0.33 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 794 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.817 ( -16.570 16.219 5.269) 23.777 3.200 ( -20.572 -2.893 4.461) 21.248 3.959 ( -7.122 -12.187 -0.876) 14.143 5.172 ( 5.270 0.241 -1.372) 5.450 6.721 ( 9.093 0.881 1.536) 9.264 7.194 ( -6.492 8.304 -11.979) 15.956 7.768 ( 5.385 -1.202 -7.315) 9.163 7.861 ( 8.550 0.497 -2.717) 8.985 8.196 ( -2.716 -7.975 -12.706) 15.245 8.350 ( -6.427 -8.943 -10.674) 15.336 8.519 ( 9.616 -0.688 -6.599) 11.683 8.727 ( -2.238 -0.162 1.318) 2.602 8.927 ( 0.894 -6.941 -4.323) 8.226 9.688 ( -5.419 0.392 -7.223) 9.038 10.397 ( -7.214 -0.507 -7.978) 10.768 10.521 ( 1.745 9.619 7.708) 12.449 10.699 ( -0.328 7.092 -4.237) 8.268 11.008 ( -10.440 -2.211 -1.343) 10.756 11.277 ( -0.909 0.772 0.850) 1.465 11.688 ( 0.397 5.626 1.723) 5.898 11.844 ( 2.021 -2.608 2.238) 3.987 11.918 ( -7.982 -2.925 -6.893) 10.945 12.041 ( 7.177 -9.868 11.740) 16.933 13.100 ( 5.628 -2.628 3.274) 7.022 13.617 ( 2.567 1.663 1.074) 3.242 13.778 ( -3.415 -5.312 3.745) 7.342 14.017 ( 6.172 4.188 2.959) 8.024 14.284 ( 6.078 2.947 5.894) 8.965 14.581 ( -0.420 1.209 4.023) 4.221 15.548 ( -1.230 -0.549 -13.565) 13.632 18.942 ( -4.965 8.069 -2.262) 9.741 19.148 ( 5.667 1.439 -2.006) 6.181 20.118 ( -4.788 -1.034 15.487) 16.243 20.577 ( -17.062 -9.401 7.163) 20.756 21.873 ( 16.471 0.805 -12.032) 20.414 23.919 ( 3.543 2.057 0.280) 4.106 ======================= Grid point 558 (271/433) ======================= q-point: (-0.08 -0.33 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.424 ( -17.742 14.465 8.845) 24.541 2.900 ( -22.486 -4.850 5.876) 23.742 3.922 ( -13.250 -13.402 4.310) 19.332 5.270 ( 6.987 1.207 -0.304) 7.097 6.736 ( -6.153 7.460 -8.044) 12.578 7.036 ( 7.331 3.170 -6.458) 10.271 7.752 ( 1.996 2.910 -1.269) 3.750 8.044 ( 8.732 -4.134 -3.849) 10.400 8.139 ( -3.535 -7.600 -13.704) 16.064 8.274 ( -3.982 -5.471 -3.622) 7.675 8.686 ( 9.006 -3.526 -5.750) 11.252 8.812 ( 14.038 0.192 -4.997) 14.903 9.053 ( 8.027 -5.883 0.733) 9.979 9.537 ( -7.145 0.790 -6.722) 9.842 10.089 ( -15.033 3.731 -9.032) 17.930 10.522 ( 0.672 2.183 1.947) 3.001 10.678 ( 0.124 6.656 5.440) 8.597 10.835 ( -11.309 -1.420 0.532) 11.410 11.231 ( -1.209 3.090 -0.958) 3.454 11.604 ( -4.450 0.773 -2.060) 4.964 11.852 ( 1.491 -0.607 -5.982) 6.195 11.941 ( 5.334 -0.056 4.399) 6.914 12.345 ( 6.349 -11.895 12.561) 18.427 13.248 ( 6.650 -2.125 1.707) 7.187 13.610 ( -0.779 1.787 0.348) 1.980 13.762 ( -3.866 2.985 4.226) 6.459 14.136 ( 8.488 -4.036 0.473) 9.411 14.360 ( 0.518 6.707 8.333) 10.709 14.628 ( 5.558 -1.068 0.941) 5.737 15.407 ( -5.368 0.499 -12.853) 13.938 18.747 ( -6.187 7.514 -2.867) 10.147 19.239 ( 8.226 3.595 -1.731) 9.143 20.147 ( -6.511 -4.539 13.749) 15.876 20.415 ( -18.705 -10.530 5.963) 22.278 22.051 ( 15.345 2.637 -9.851) 18.425 23.950 ( 2.843 2.159 -0.696) 3.637 ======================= Grid point 568 (272/433) ======================= q-point: (-0.25 -0.25 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 432 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.053 ( -17.344 0.000 4.454) 17.907 3.132 ( -21.705 0.000 9.918) 23.864 3.806 ( -6.850 0.000 -3.990) 7.928 5.175 ( 5.868 -0.000 -2.223) 6.275 6.729 ( 11.422 -0.000 1.921) 11.582 7.300 ( -10.655 0.000 -14.451) 17.955 7.673 ( 10.326 -0.000 -3.684) 10.963 7.997 ( 13.669 -0.000 -5.685) 14.805 8.057 ( -9.754 0.000 -5.804) 11.351 8.236 ( -6.160 0.000 -17.029) 18.108 8.518 ( 12.578 -0.000 -7.124) 14.455 8.741 ( -5.862 0.000 4.826) 7.593 8.848 ( 2.809 -0.000 -6.207) 6.813 9.693 ( -5.592 0.000 -6.875) 8.863 10.386 ( -6.683 0.000 -8.207) 10.583 10.630 ( 2.840 -0.000 9.848) 10.250 10.791 ( -2.486 0.000 -10.048) 10.351 10.971 ( -12.185 0.000 2.936) 12.534 11.275 ( -0.263 0.000 1.230) 1.258 11.783 ( 4.935 -0.000 3.235) 5.901 11.795 ( 0.327 -0.000 4.724) 4.735 11.882 ( -11.170 0.000 -9.374) 14.582 11.936 ( 8.702 -0.000 9.425) 12.828 13.071 ( 5.177 -0.000 2.672) 5.826 13.640 ( 4.783 -0.000 4.016) 6.245 13.708 ( -4.428 0.000 1.039) 4.548 14.060 ( 5.801 -0.000 3.714) 6.888 14.325 ( 7.061 -0.000 3.928) 8.080 14.589 ( -2.396 0.000 6.457) 6.887 15.543 ( -0.124 0.000 -14.694) 14.695 19.036 ( -9.150 0.000 -2.146) 9.399 19.149 ( 9.669 -0.000 -2.793) 10.065 20.114 ( -6.776 0.000 15.572) 16.982 20.478 ( -16.289 0.000 7.787) 18.055 21.881 ( 17.347 -0.000 -11.940) 21.059 23.939 ( 3.378 -0.000 0.233) 3.386 ======================= Grid point 569 (273/433) ======================= q-point: (-0.17 -0.25 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.713 ( -19.274 12.315 11.415) 25.562 2.835 ( -23.727 -2.467 8.691) 25.388 3.665 ( -15.977 -10.268 3.161) 19.254 5.291 ( 8.942 0.792 -1.584) 9.116 6.889 ( -1.873 7.967 -7.946) 11.407 7.020 ( 0.327 -4.497 -9.078) 10.136 7.799 ( 5.290 2.439 -3.733) 6.918 7.980 ( 5.346 -2.320 -0.977) 5.909 8.022 ( -3.589 -4.118 -16.281) 17.173 8.176 ( 3.731 -3.533 -1.583) 5.376 8.678 ( 0.902 2.508 1.560) 3.089 8.781 ( 13.018 -3.753 -5.179) 14.504 8.989 ( 18.701 -0.853 -2.545) 18.893 9.551 ( -6.768 0.501 -5.012) 8.436 10.145 ( -12.837 1.505 -12.563) 18.025 10.561 ( -9.608 1.715 1.435) 9.864 10.743 ( -0.751 -0.744 -3.016) 3.196 10.865 ( -4.814 4.055 11.272) 12.910 11.273 ( 0.155 0.705 -0.810) 1.085 11.607 ( -12.438 -0.114 -2.675) 12.723 11.871 ( 5.213 2.113 -0.511) 5.648 11.933 ( 7.866 -0.938 2.279) 8.243 12.164 ( 7.657 -5.713 10.593) 14.265 13.199 ( 7.103 -2.037 1.801) 7.605 13.630 ( -3.907 0.680 2.154) 4.513 13.743 ( 1.769 -2.402 3.722) 4.770 14.133 ( 3.700 1.345 -0.882) 4.035 14.487 ( 5.769 5.890 7.423) 11.094 14.591 ( 1.216 -3.016 4.212) 5.321 15.409 ( -4.309 -0.076 -15.683) 16.264 18.861 ( -7.059 3.526 -3.888) 8.797 19.280 ( 8.359 0.872 -3.990) 9.303 20.089 ( -7.633 -1.408 13.969) 15.980 20.266 ( -18.564 -4.344 9.435) 21.273 22.086 ( 16.194 0.921 -10.305) 19.217 23.980 ( 2.359 0.868 -1.006) 2.707 ======================= Grid point 570 (274/433) ======================= q-point: (-0.08 -0.25 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.313 ( -22.056 15.625 10.655) 29.054 2.555 ( -20.427 -3.769 18.338) 27.709 3.516 ( -22.360 -17.675 9.445) 30.027 5.392 ( 5.233 2.396 -2.383) 6.229 6.543 ( -13.448 4.430 -10.914) 17.877 7.201 ( 11.047 -2.459 -6.110) 12.861 7.810 ( 4.130 1.109 -7.353) 8.506 7.917 ( -0.703 -1.779 -6.689) 6.957 8.226 ( 11.520 -9.724 0.181) 15.077 8.247 ( 6.996 7.992 1.658) 10.750 8.717 ( 3.566 -3.466 1.416) 5.170 8.985 ( 10.153 -6.310 -3.272) 12.394 9.358 ( 17.338 4.121 -4.764) 18.447 9.405 ( 2.042 3.272 -1.197) 4.038 9.841 ( -11.781 4.001 -7.247) 14.398 10.426 ( -8.794 -5.145 1.136) 10.251 10.685 ( -4.753 1.558 -1.100) 5.121 10.807 ( -3.115 9.191 11.461) 15.018 11.251 ( 0.375 3.416 -1.563) 3.775 11.458 ( -4.960 -5.228 -4.568) 8.532 11.912 ( 4.041 3.898 -1.294) 5.762 12.094 ( 8.725 0.049 3.401) 9.364 12.405 ( 5.232 -9.185 8.835) 13.777 13.347 ( 7.204 -2.096 -0.780) 7.543 13.588 ( -3.348 -0.001 3.056) 4.533 13.773 ( -1.102 2.168 2.665) 3.608 14.195 ( 4.715 -3.836 -3.731) 7.132 14.428 ( -5.858 6.080 5.281) 9.959 14.728 ( 5.171 -0.579 -3.300) 6.161 15.283 ( 0.015 -0.062 -2.712) 2.713 18.702 ( -4.055 5.422 -3.419) 7.585 19.347 ( 4.199 1.107 -6.312) 7.661 20.025 ( -14.615 -2.954 10.270) 18.105 20.074 ( -14.859 -7.825 8.115) 18.651 22.285 ( 16.079 2.353 -6.882) 17.648 23.991 ( 1.165 1.099 -1.828) 2.431 ======================= Grid point 581 (275/433) ======================= q-point: (-0.17 -0.17 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 433 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.517 ( -21.936 0.000 17.646) 28.152 2.517 ( -21.104 0.000 12.848) 24.707 3.296 ( -25.909 0.000 10.878) 28.100 5.420 ( 6.059 -0.000 -3.307) 6.903 6.596 ( -15.870 0.000 -13.470) 20.816 7.150 ( 9.187 -0.000 -4.663) 10.303 7.804 ( 0.186 -0.000 -15.161) 15.162 7.964 ( 6.723 -0.000 -0.748) 6.764 8.091 ( 12.142 -0.000 0.350) 12.147 8.331 ( 13.185 -0.000 2.094) 13.350 8.698 ( -0.947 0.000 6.034) 6.108 8.899 ( 8.977 -0.000 -3.222) 9.538 9.418 ( 28.027 -0.000 -6.756) 28.830 9.420 ( -7.668 0.000 0.304) 7.674 9.904 ( -5.871 0.000 -9.769) 11.398 10.355 ( -12.919 0.000 2.235) 13.111 10.699 ( -3.185 0.000 -1.343) 3.456 10.916 ( -3.087 0.000 13.615) 13.961 11.302 ( 4.275 -0.000 -3.099) 5.280 11.383 ( -10.358 0.000 -3.869) 11.057 11.972 ( 4.319 -0.000 0.713) 4.378 12.080 ( 8.405 -0.000 1.568) 8.550 12.306 ( 5.696 -0.000 8.578) 10.297 13.317 ( 7.208 -0.000 0.511) 7.226 13.586 ( -3.247 0.000 4.109) 5.237 13.778 ( 0.521 -0.000 2.398) 2.454 14.169 ( 2.920 -0.000 -5.422) 6.158 14.498 ( -7.570 0.000 5.243) 9.208 14.721 ( 5.956 -0.000 -2.158) 6.336 15.279 ( 0.791 -0.000 -3.774) 3.856 18.759 ( -3.815 0.000 -4.797) 6.129 19.360 ( 4.636 -0.000 -7.556) 8.865 19.977 ( -21.055 0.000 9.979) 23.300 20.010 ( -10.295 0.000 10.889) 14.985 22.308 ( 16.546 -0.000 -7.091) 18.002 24.002 ( 0.967 -0.000 -2.070) 2.285 ======================= Grid point 582 (276/433) ======================= q-point: (-0.08 -0.17 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.115 ( -26.189 16.281 13.771) 33.773 2.366 ( -16.635 -8.029 24.644) 30.798 3.015 ( -26.076 -13.932 21.051) 36.294 5.408 ( -3.017 1.324 -7.440) 8.137 6.339 ( -6.906 0.777 -3.392) 7.733 7.163 ( -2.706 -4.518 -14.590) 15.512 7.844 ( 10.094 -1.735 -3.348) 10.775 8.042 ( 7.169 7.623 -1.596) 10.585 8.330 ( 10.242 -7.063 -2.640) 12.718 8.544 ( 13.163 10.943 5.450) 17.964 8.781 ( 5.998 -4.282 5.268) 9.059 9.066 ( 8.935 -5.070 -1.210) 10.344 9.291 ( -7.297 2.715 4.571) 9.029 9.546 ( -3.539 -2.788 -9.353) 10.382 10.005 ( 20.525 14.408 -1.573) 25.126 10.276 ( 1.727 -8.903 1.812) 9.248 10.604 ( -6.385 2.262 0.186) 6.777 10.897 ( -6.138 5.209 13.885) 16.050 11.252 ( 0.072 0.901 -2.471) 2.631 11.392 ( 6.223 -2.637 -4.658) 8.209 12.008 ( 2.926 4.357 -0.913) 5.328 12.224 ( 6.174 -3.028 0.780) 6.921 12.450 ( 3.286 -5.102 5.731) 8.347 13.423 ( 3.778 -1.287 -0.734) 4.058 13.563 ( -2.046 1.493 2.488) 3.550 13.773 ( -2.447 0.194 1.568) 2.913 14.188 ( 2.543 -2.468 -7.208) 8.032 14.362 ( -9.498 3.165 2.960) 10.440 14.604 ( -9.068 -1.876 -18.608) 20.784 15.534 ( 21.996 1.570 21.644) 30.899 18.687 ( 0.327 3.067 -4.252) 5.253 19.322 ( -2.886 2.396 -9.599) 10.306 19.706 ( -20.378 -7.443 6.959) 22.783 19.867 ( -14.351 -1.992 6.748) 15.983 22.547 ( 16.584 1.722 -3.340) 17.005 23.990 ( -0.530 0.398 -2.386) 2.477 ======================= Grid point 594 (277/433) ======================= q-point: (-0.08 -0.08 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 432 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.965 ( -28.240 0.000 20.271) 34.763 1.994 ( -21.165 0.000 20.609) 29.541 2.829 ( -9.923 0.000 36.574) 37.896 5.245 ( -9.181 0.000 -9.760) 13.400 6.319 ( 2.400 -0.000 7.728) 8.092 6.952 ( -6.714 0.000 -17.478) 18.723 8.027 ( 11.973 -0.000 0.096) 11.973 8.219 ( 8.355 -0.000 1.071) 8.423 8.316 ( -1.943 0.000 -6.601) 6.881 8.804 ( -5.258 0.000 3.386) 6.254 8.912 ( 13.326 -0.000 8.152) 15.621 9.186 ( 6.742 -0.000 0.209) 6.745 9.246 ( -1.733 0.000 7.553) 7.750 9.468 ( 6.478 -0.000 -8.377) 10.590 10.229 ( 5.666 -0.000 -0.774) 5.718 10.404 ( 0.181 -0.000 -2.213) 2.220 10.672 ( 19.999 -0.000 1.965) 20.095 10.835 ( -9.491 0.000 11.883) 15.208 11.365 ( 11.409 -0.000 3.822) 12.032 11.479 ( 7.687 -0.000 -4.880) 9.105 12.059 ( 1.044 -0.000 -1.808) 2.088 12.258 ( 1.654 -0.000 -2.972) 3.401 12.488 ( 1.296 -0.000 2.766) 3.054 13.412 ( -5.875 0.000 0.897) 5.943 13.555 ( -1.329 0.000 -2.849) 3.144 13.702 ( -6.258 0.000 -0.347) 6.268 14.156 ( -0.101 0.000 -7.289) 7.289 14.227 ( -10.999 0.000 3.908) 11.673 14.313 ( -5.676 0.000 -20.481) 21.253 16.239 ( 41.583 -0.000 29.755) 51.133 18.723 ( 5.460 -0.000 -4.960) 7.376 19.178 ( -11.041 0.000 -11.783) 16.148 19.316 ( -24.279 0.000 7.223) 25.331 19.631 ( -15.515 0.000 3.849) 15.985 22.810 ( 14.859 -0.000 -1.108) 14.900 23.955 ( -2.330 0.000 -1.903) 3.008 ======================= Grid point 595 (278/433) ======================= q-point: ( 0.00 0.00 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 433 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.180 ( -3.301 0.000 16.550) 16.876 2.267 ( 7.196 -0.000 14.765) 16.425 3.753 ( 3.624 -0.000 19.620) 19.951 4.876 ( -0.176 0.000 -2.552) 2.558 6.301 ( -2.186 0.000 -10.940) 11.156 7.252 ( 12.991 -0.000 20.218) 24.032 8.028 ( -4.496 0.000 0.543) 4.529 8.103 ( 0.939 -0.000 -3.613) 3.733 8.526 ( -13.245 0.000 10.725) 17.043 8.767 ( 1.196 -0.000 9.919) 9.991 9.019 ( -4.451 0.000 3.405) 5.604 9.640 ( 8.323 -0.000 5.368) 9.904 9.681 ( 5.313 -0.000 2.618) 5.923 9.813 ( 15.556 -0.000 -4.858) 16.297 9.927 ( -4.796 0.000 -13.318) 14.156 10.181 ( 5.785 -0.000 -10.821) 12.270 11.079 ( 5.724 -0.000 3.655) 6.791 11.274 ( 1.460 -0.000 0.118) 1.464 11.591 ( 5.234 -0.000 1.333) 5.401 11.921 ( -7.452 0.000 2.666) 7.915 12.066 ( 7.566 -0.000 -3.845) 8.487 12.097 ( 0.391 -0.000 6.012) 6.025 12.430 ( -2.094 0.000 -2.490) 3.253 12.872 ( -5.137 0.000 -3.539) 6.238 13.282 ( -10.272 0.000 -4.649) 11.275 13.376 ( -1.240 0.000 -4.733) 4.893 13.903 ( -3.193 0.000 -4.060) 5.165 14.007 ( 4.998 -0.000 -8.144) 9.555 14.061 ( -3.040 0.000 2.945) 4.233 18.019 ( 2.453 -0.000 5.022) 5.589 18.553 ( -13.864 0.000 -0.548) 13.875 18.687 ( 9.263 -0.000 2.170) 9.513 19.086 ( 9.397 -0.000 1.071) 9.457 19.247 ( -5.919 0.000 -1.318) 6.064 23.147 ( 3.728 -0.000 0.928) 3.842 23.830 ( -3.215 0.000 -0.204) 3.222 ======================= Grid point 596 (279/433) ======================= q-point: ( 0.08 0.00 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.337 ( 4.390 -7.265 13.291) 15.770 2.594 ( 20.673 -5.141 7.791) 22.682 3.895 ( 1.523 0.713 13.872) 13.973 4.916 ( 5.327 -1.328 -1.818) 5.783 6.257 ( 1.238 -4.215 -7.702) 8.867 7.501 ( 4.596 0.296 6.627) 8.071 7.872 ( -1.030 15.783 3.030) 16.105 8.158 ( -6.406 -11.204 4.355) 13.621 8.486 ( 1.599 -0.284 10.980) 11.099 8.675 ( -14.247 0.634 9.870) 17.344 9.069 ( 4.246 -2.499 -4.600) 6.741 9.691 ( -4.277 6.325 -1.636) 7.808 9.746 ( 3.208 0.334 -1.711) 3.652 9.804 ( 6.177 4.276 -5.144) 9.105 9.961 ( 1.783 -5.303 -1.505) 5.794 10.296 ( 13.158 -2.464 -15.121) 20.195 11.138 ( -9.914 6.843 -1.184) 12.104 11.198 ( 3.661 -0.046 0.975) 3.789 11.631 ( -0.294 2.599 -0.683) 2.704 11.790 ( -8.120 1.599 -0.482) 8.290 12.037 ( 1.245 4.082 -3.507) 5.524 12.173 ( 2.418 -0.601 6.110) 6.598 12.436 ( -2.042 -6.259 -1.934) 6.862 12.903 ( 6.666 7.219 2.421) 10.120 13.074 ( -2.036 3.810 -2.023) 4.770 13.417 ( -2.321 -13.916 -0.865) 14.135 13.811 ( -7.043 -2.060 -1.739) 7.541 14.027 ( 4.129 3.019 -6.223) 8.056 14.087 ( 3.686 -1.932 0.445) 4.185 17.705 ( -21.932 16.882 5.664) 28.250 18.345 ( -15.153 -5.794 3.419) 16.579 18.919 ( 1.637 -7.506 -4.644) 8.977 19.292 ( 17.920 2.780 0.877) 18.155 19.401 ( 20.027 -8.101 -0.654) 21.613 23.146 ( -1.821 4.019 -0.699) 4.468 23.761 ( -4.866 0.376 0.712) 4.932 ======================= Grid point 597 (280/433) ======================= q-point: ( 0.17 0.00 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 794 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.550 ( 8.271 -1.824 5.551) 10.127 3.098 ( 21.855 -13.137 6.381) 26.286 3.959 ( 0.327 0.601 5.531) 5.573 5.026 ( 6.272 -1.163 -0.609) 6.408 6.327 ( 4.474 -7.659 -4.501) 9.947 7.444 ( -6.964 1.189 -7.282) 10.146 7.728 ( -6.387 10.932 1.284) 12.726 8.161 ( -4.883 -0.317 14.623) 15.420 8.525 ( -7.029 1.195 4.624) 8.498 8.680 ( 10.817 -1.196 10.402) 15.054 9.047 ( -6.637 -6.405 -10.343) 13.859 9.518 ( -3.473 7.711 -5.300) 9.980 9.768 ( 2.306 4.086 -3.823) 6.052 9.840 ( 5.667 4.082 -7.035) 9.913 10.028 ( 0.306 -7.798 1.786) 8.006 10.389 ( 3.200 -0.130 -11.743) 12.172 10.813 ( -13.236 7.202 -5.971) 16.209 11.253 ( -0.545 -1.992 0.619) 2.156 11.484 ( -7.333 9.960 -3.637) 12.892 11.655 ( -2.710 3.234 -2.140) 4.731 12.106 ( 7.128 -3.264 -0.772) 7.878 12.251 ( 2.947 -2.284 1.291) 3.946 12.445 ( -0.317 -0.478 1.722) 1.814 12.825 ( -0.320 11.496 5.809) 12.884 13.196 ( 8.073 -1.962 1.513) 8.444 13.537 ( -1.905 -15.143 3.909) 15.755 13.699 ( -8.237 -3.104 2.192) 9.071 14.038 ( 7.201 4.423 -8.273) 11.826 14.191 ( 5.084 -2.363 1.307) 5.756 17.175 ( -24.980 16.961 3.682) 30.418 18.217 ( -9.874 -6.683 4.437) 12.721 18.913 ( -4.720 -7.152 -3.102) 9.113 19.596 ( 19.919 2.877 1.136) 20.158 19.879 ( 24.963 -10.238 -1.455) 27.020 22.995 ( -7.961 8.176 -3.106) 11.827 23.681 ( -4.887 0.039 1.543) 5.125 ======================= Grid point 598 (281/433) ======================= q-point: ( 0.25 0.00 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.692 ( 8.163 4.029 -1.402) 9.210 3.570 ( 12.366 -12.112 9.382) 19.689 3.980 ( 2.242 -1.642 -4.429) 5.228 5.113 ( 2.966 -0.316 0.747) 3.075 6.484 ( 6.709 -9.019 -2.304) 11.475 7.257 ( -7.670 -0.309 -9.544) 12.248 7.434 ( -17.798 7.393 2.259) 19.404 8.191 ( 3.721 6.493 5.294) 9.166 8.446 ( -2.789 1.259 -1.412) 3.370 8.859 ( -9.583 -4.860 -4.178) 11.529 8.941 ( 6.185 -0.582 2.605) 6.737 9.377 ( -2.321 5.613 -6.308) 8.757 9.690 ( -0.635 4.958 -9.415) 10.660 9.837 ( 3.657 4.159 -3.391) 6.494 10.090 ( -9.923 -4.008 -9.277) 14.162 10.212 ( -2.350 8.489 7.388) 11.496 10.620 ( -4.595 -5.443 -15.334) 16.908 11.184 ( -4.758 3.688 -1.104) 6.120 11.323 ( 0.091 4.546 -2.697) 5.287 11.572 ( -3.186 2.926 -0.467) 4.351 12.184 ( 2.408 1.599 -6.341) 6.969 12.398 ( 7.355 -2.079 0.590) 7.666 12.458 ( 1.589 -1.201 4.654) 5.062 12.814 ( 3.170 6.909 11.751) 13.995 13.287 ( -1.798 -4.952 1.194) 5.402 13.583 ( -1.663 2.598 5.332) 6.160 13.755 ( -1.694 -16.314 8.983) 18.700 14.087 ( 10.648 4.346 -11.078) 15.968 14.299 ( 3.916 -0.766 3.615) 5.384 16.611 ( -24.943 14.561 -1.356) 28.914 18.206 ( -3.324 -7.743 4.933) 9.764 18.891 ( -4.419 -7.213 -1.605) 8.610 19.900 ( 18.142 3.214 3.882) 18.829 20.372 ( 23.390 -9.652 -1.246) 25.334 22.689 ( -14.107 11.528 -5.649) 19.075 23.632 ( -2.719 -1.063 2.474) 3.826 ======================= Grid point 599 (282/433) ======================= q-point: ( 0.33 0.00 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 794 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.717 ( 3.726 7.512 -4.983) 9.754 3.746 ( -4.189 -0.521 5.227) 6.719 4.090 ( 8.184 -8.851 -4.741) 12.953 5.140 ( -0.316 0.139 1.915) 1.946 6.672 ( 6.884 -7.790 -3.347) 10.921 7.075 ( -15.102 2.758 -5.208) 16.211 7.118 ( -7.435 -1.024 1.074) 7.582 8.146 ( 0.248 9.561 -8.044) 12.497 8.444 ( 4.000 -2.658 -2.813) 5.566 8.658 ( -12.516 -4.393 -6.150) 14.621 9.005 ( 2.070 9.695 -1.586) 10.039 9.208 ( -7.617 5.396 -8.736) 12.785 9.583 ( -0.625 3.580 -7.746) 8.556 9.724 ( -12.841 5.041 -9.411) 16.699 9.899 ( 4.982 1.503 3.683) 6.375 10.312 ( 5.006 -3.299 3.852) 7.126 10.474 ( -6.901 -2.531 -11.711) 13.827 11.134 ( 3.818 4.111 -1.766) 5.881 11.281 ( -1.729 -0.133 -2.075) 2.705 11.499 ( -2.988 0.719 0.438) 3.105 12.116 ( -2.096 2.235 -9.947) 10.409 12.340 ( -5.866 6.305 0.855) 8.655 12.642 ( 8.797 2.750 7.365) 11.798 12.945 ( 6.476 -3.207 10.465) 12.717 13.294 ( -5.244 -6.749 4.454) 9.638 13.600 ( 2.694 1.934 5.923) 6.789 13.943 ( -0.166 -11.972 9.913) 15.544 14.155 ( 9.434 2.661 -12.021) 15.511 14.380 ( 3.887 2.564 5.703) 7.362 16.079 ( -21.150 10.231 -6.229) 24.306 18.305 ( 1.713 -8.694 4.502) 9.939 18.887 ( -3.470 -6.563 0.071) 7.424 20.174 ( 14.476 3.314 6.981) 16.409 20.813 ( 20.351 -7.526 -0.838) 21.714 22.253 ( -18.678 13.237 -7.703) 24.154 23.646 ( 0.495 -2.328 2.914) 3.763 ======================= Grid point 600 (283/433) ======================= q-point: (-0.58 0.00 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.620 ( -2.869 7.057 -4.374) 8.784 3.611 ( -9.707 3.245 -2.009) 10.430 4.255 ( 3.010 -5.592 1.314) 6.485 5.145 ( 0.112 -0.101 2.109) 2.115 6.731 ( -4.583 -1.179 -3.875) 6.116 6.822 ( -7.267 -1.382 -6.432) 9.803 7.169 ( 5.980 -8.711 4.034) 11.310 7.987 ( -1.490 4.822 -12.977) 13.924 8.461 ( -7.032 -2.024 -4.938) 8.828 8.536 ( 1.931 2.945 -3.528) 4.985 8.786 ( -6.805 10.799 -15.634) 20.183 8.988 ( -4.929 7.249 -2.231) 9.045 9.389 ( -6.155 10.967 -5.706) 13.810 9.570 ( -2.914 -4.260 -8.163) 9.657 10.042 ( 5.463 -5.856 0.028) 8.009 10.338 ( -1.492 2.683 -0.744) 3.158 10.459 ( 3.989 -4.123 2.579) 6.290 11.152 ( 2.359 3.758 -1.850) 4.807 11.242 ( -1.510 0.027 -2.087) 2.576 11.473 ( -1.385 -2.413 0.267) 2.795 11.957 ( -4.922 4.420 -10.743) 12.617 12.168 ( -8.428 3.309 1.548) 9.186 12.758 ( 5.962 9.291 11.062) 15.628 13.158 ( 5.747 -5.765 6.331) 10.313 13.304 ( -3.271 -5.721 4.060) 7.741 13.697 ( 1.210 -5.527 6.241) 8.424 14.051 ( 2.914 2.018 2.080) 4.109 14.232 ( 4.189 -5.683 -1.951) 7.325 14.455 ( 6.476 5.572 3.404) 9.196 15.663 ( -14.639 4.773 -8.633) 17.653 18.455 ( 2.924 -8.556 1.950) 9.249 18.914 ( -0.902 -5.776 2.889) 6.521 20.387 ( 8.978 3.775 9.008) 13.266 21.170 ( 14.729 -4.084 1.382) 15.347 21.754 ( -18.515 11.951 -10.433) 24.382 23.719 ( 2.971 -2.913 2.233) 4.723 ======================= Grid point 601 (284/433) ======================= q-point: (-0.50 0.00 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 794 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.465 ( -8.058 1.749 -0.337) 8.253 3.374 ( -12.459 4.560 -0.579) 13.280 4.302 ( -2.311 0.079 3.739) 4.397 5.183 ( 2.946 -0.337 1.359) 3.262 6.618 ( -5.820 -1.750 -2.746) 6.669 6.740 ( -1.455 -4.332 -8.123) 9.320 7.458 ( 11.065 -10.721 6.806) 16.843 7.888 ( 2.133 -0.662 -13.316) 13.502 8.306 ( -9.221 10.313 -12.870) 18.895 8.360 ( -1.349 2.668 -3.531) 4.627 8.626 ( 2.061 6.629 -9.051) 11.407 8.868 ( -0.764 5.468 -1.642) 5.761 9.213 ( -1.511 6.466 -1.629) 6.837 9.502 ( -3.405 -1.085 -5.796) 6.809 10.065 ( -4.167 -2.751 -7.531) 9.036 10.420 ( 5.742 -2.609 7.134) 9.522 10.561 ( 2.541 -2.832 3.755) 5.346 11.075 ( -5.842 4.591 -2.717) 7.911 11.200 ( -1.097 1.092 -1.651) 2.263 11.498 ( 0.095 -4.348 0.393) 4.367 11.797 ( -1.412 3.300 -9.662) 10.307 12.049 ( -4.732 1.161 4.262) 6.473 12.802 ( 2.772 10.260 10.904) 15.226 13.267 ( 0.419 -0.785 5.449) 5.521 13.377 ( 1.150 -8.949 -0.235) 9.026 13.756 ( -7.263 -9.028 4.954) 12.601 14.123 ( 12.126 6.487 -0.929) 13.783 14.341 ( 0.616 -4.668 4.661) 6.625 14.524 ( 7.474 4.988 -1.906) 9.185 15.396 ( -8.823 0.697 -7.391) 11.531 18.552 ( -0.532 -6.510 -1.437) 6.688 19.018 ( 4.089 -5.297 4.530) 8.081 20.496 ( 2.123 4.684 9.405) 10.719 21.141 ( -20.946 10.147 4.615) 23.727 21.571 ( 14.902 -2.876 -11.873) 19.270 23.812 ( 3.685 -2.477 0.407) 4.458 ======================= Grid point 602 (285/433) ======================= q-point: (-0.42 0.00 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.334 ( -11.701 -5.689 4.375) 13.726 3.138 ( -12.067 4.681 8.050) 15.242 4.220 ( -7.458 6.193 5.071) 10.940 5.257 ( 4.434 -0.693 -0.027) 4.488 6.512 ( -7.027 -2.085 -3.329) 8.051 6.799 ( 6.880 -7.071 -6.108) 11.603 7.716 ( 3.415 -4.311 3.030) 6.279 7.896 ( 4.114 -2.514 -9.563) 10.709 8.078 ( 1.959 5.461 -9.660) 11.268 8.350 ( 5.241 4.726 0.380) 7.067 8.562 ( 5.916 2.804 -7.068) 9.634 8.834 ( 3.222 3.828 -1.791) 5.314 9.198 ( 4.427 2.491 2.343) 5.594 9.413 ( -3.995 0.831 -3.253) 5.218 9.938 ( -7.134 1.407 -3.680) 8.150 10.513 ( 0.234 -1.720 0.273) 1.757 10.669 ( 0.048 -5.548 7.056) 8.976 10.868 ( -10.370 3.007 -2.501) 11.083 11.182 ( 0.306 0.007 -0.405) 0.507 11.544 ( -0.883 -2.694 0.333) 2.854 11.731 ( 2.475 0.556 -6.434) 6.916 12.056 ( 2.084 -0.303 6.076) 6.431 12.788 ( 0.480 9.747 8.262) 12.787 13.308 ( 1.294 -0.135 2.806) 3.093 13.467 ( 0.649 -8.277 -2.171) 8.582 13.728 ( -8.300 -8.476 3.831) 12.467 14.265 ( 11.764 6.805 -4.366) 14.275 14.378 ( -2.372 -0.626 4.293) 4.945 14.588 ( 6.415 1.541 -5.468) 8.569 15.273 ( -2.347 -1.131 -0.509) 2.655 18.561 ( -2.531 -4.273 -2.411) 5.521 19.164 ( 5.415 -2.951 0.299) 6.174 20.474 ( -5.169 5.681 8.432) 11.406 20.701 ( -22.560 7.599 4.792) 24.283 21.828 ( 17.243 -3.666 -7.033) 18.979 23.883 ( 2.966 -1.456 -1.910) 3.817 ======================= Grid point 603 (286/433) ======================= q-point: (-0.33 0.00 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 794 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.215 ( -16.823 -10.212 8.304) 21.360 3.015 ( -7.580 3.802 19.446) 21.214 3.988 ( -13.737 12.705 6.515) 19.813 5.315 ( 1.438 -1.141 -2.729) 3.289 6.414 ( -4.554 0.073 2.519) 5.205 6.964 ( 7.703 -6.264 -9.953) 14.059 7.702 ( 2.859 3.972 -9.225) 10.443 7.972 ( 4.529 3.419 -3.151) 6.491 8.072 ( 2.844 -6.892 5.610) 9.330 8.439 ( 10.866 7.738 2.353) 13.545 8.739 ( 11.860 -5.013 -3.089) 13.241 8.899 ( 9.892 -0.356 -3.818) 10.609 9.321 ( -4.621 -1.501 1.901) 5.217 9.354 ( 12.526 -0.412 3.695) 13.067 9.774 ( -8.027 3.445 0.165) 8.737 10.486 ( -4.648 -0.146 -1.055) 4.769 10.634 ( -6.423 1.122 -2.983) 7.171 10.798 ( -3.039 -9.399 7.695) 12.522 11.200 ( 1.501 -0.273 0.093) 1.528 11.487 ( -4.028 2.814 -0.323) 4.924 11.804 ( 4.837 -4.309 -1.361) 6.619 12.174 ( 6.313 -1.122 5.280) 8.306 12.740 ( 0.306 9.231 4.465) 10.258 13.342 ( 1.581 -0.509 -0.753) 1.824 13.525 ( -1.246 -5.954 -2.237) 6.482 13.711 ( -5.792 -9.291 3.060) 11.368 14.275 ( 7.358 12.703 -12.547) 19.312 14.336 ( -7.166 -3.041 1.140) 7.868 14.597 ( -0.562 1.373 -6.747) 6.908 15.397 ( 11.899 -3.510 12.118) 17.342 18.542 ( -1.375 -2.637 -2.785) 4.074 19.220 ( 1.833 0.780 -6.500) 6.798 20.316 ( -17.503 4.897 11.279) 21.391 20.326 ( -15.003 6.121 2.945) 16.469 22.124 ( 17.594 -4.518 -3.526) 18.504 23.914 ( 1.783 -0.564 -3.809) 4.243 ======================= Grid point 604 (287/433) ======================= q-point: (-0.25 0.00 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.087 ( -18.853 -12.190 14.589) 26.775 3.008 ( -5.804 6.946 24.389) 26.014 3.625 ( -17.076 15.389 9.786) 24.983 5.269 ( -4.753 0.020 -5.448) 7.229 6.424 ( 2.153 1.227 10.891) 11.169 6.942 ( -2.795 3.945 -15.466) 16.204 7.727 ( 5.934 -3.792 -5.886) 9.178 8.031 ( 8.008 2.966 5.016) 9.904 8.347 ( 11.463 -15.194 2.197) 19.159 8.542 ( 9.812 11.477 2.497) 15.304 8.908 ( 5.666 -1.796 6.005) 8.449 9.088 ( 13.711 -0.857 -7.740) 15.768 9.269 ( -5.249 -1.417 6.688) 8.619 9.616 ( -6.517 5.403 3.089) 9.012 9.711 ( 15.444 -12.508 2.302) 20.007 10.404 ( 1.655 3.642 -1.692) 4.343 10.514 ( -7.217 -2.999 -2.875) 8.327 10.950 ( 2.003 -11.930 8.980) 15.066 11.216 ( 0.769 1.031 -0.506) 1.382 11.418 ( 0.229 2.775 1.194) 3.030 11.913 ( 2.965 -4.839 0.558) 5.702 12.305 ( 5.026 1.187 2.253) 5.635 12.676 ( 0.393 8.785 1.492) 8.919 13.358 ( 0.363 -2.606 -4.421) 5.145 13.492 ( -8.333 -6.335 -1.198) 10.536 13.754 ( -0.063 -5.107 0.844) 5.176 14.146 ( 0.885 8.453 -17.945) 19.856 14.209 ( -6.555 3.212 -2.201) 7.624 14.476 ( -6.835 2.603 -3.491) 8.104 15.868 ( 25.425 -8.033 20.350) 33.542 18.545 ( 2.006 -1.329 -3.499) 4.247 19.138 ( -3.724 1.962 -9.213) 10.129 19.982 ( -20.145 6.282 7.339) 22.342 20.058 ( -15.946 6.097 3.501) 17.427 22.451 ( 16.893 -5.517 0.034) 17.771 23.913 ( 0.764 -0.233 -4.495) 4.565 ======================= Grid point 605 (288/433) ======================= q-point: (-0.17 0.00 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 794 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.026 ( -14.819 -12.333 20.000) 27.780 2.810 ( -18.048 22.415 17.889) 33.885 3.430 ( -3.503 3.399 19.989) 20.576 5.116 ( -7.725 1.720 -5.196) 9.468 6.589 ( 7.779 0.284 15.326) 17.190 6.703 ( -5.722 7.348 -12.533) 15.614 7.848 ( 2.579 -11.103 -4.350) 12.200 8.194 ( 8.180 1.755 4.119) 9.325 8.531 ( 7.872 14.200 1.683) 16.322 8.731 ( 6.206 -14.172 5.039) 16.271 9.055 ( 4.124 -3.521 6.718) 8.634 9.204 ( -3.557 0.143 8.209) 8.948 9.308 ( 10.584 -3.043 -2.723) 11.344 9.504 ( -0.274 5.739 3.084) 6.521 9.996 ( 6.830 -7.481 -5.822) 11.684 10.350 ( -5.087 1.907 -5.150) 7.485 10.627 ( 15.472 -8.906 2.788) 18.069 11.067 ( -2.706 1.487 8.099) 8.667 11.329 ( 11.635 -7.653 0.315) 13.929 11.463 ( 4.954 -0.486 2.908) 5.765 11.999 ( 1.112 -4.480 1.726) 4.928 12.300 ( -1.744 6.105 -2.020) 6.663 12.608 ( 0.249 7.678 0.023) 7.682 13.339 ( -7.083 -3.044 -4.974) 9.174 13.367 ( -9.263 -9.513 -6.038) 14.586 13.754 ( -2.194 4.952 -1.129) 5.533 13.985 ( 0.649 2.861 -13.529) 13.844 14.068 ( -2.153 4.598 -5.491) 7.479 14.303 ( -8.997 2.593 -0.620) 9.384 16.607 ( 34.877 -13.017 21.653) 43.066 18.598 ( 6.562 0.099 -4.693) 8.068 18.972 ( -8.884 0.269 -6.314) 10.902 19.596 ( -21.309 10.238 4.660) 24.095 19.739 ( -16.570 5.515 0.976) 17.490 22.770 ( 13.910 -5.232 1.847) 14.976 23.895 ( -0.143 -0.354 -3.638) 3.658 ======================= Grid point 606 (289/433) ======================= q-point: (-0.08 0.00 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.078 ( -6.221 -9.462 20.263) 23.213 2.381 ( -15.624 20.929 16.672) 30.986 3.562 ( 3.167 -0.070 22.199) 22.424 4.954 ( -5.734 1.623 -3.504) 6.913 6.455 ( -4.953 3.921 -13.667) 15.056 6.897 ( 12.714 -0.077 22.267) 25.641 7.961 ( -0.945 -14.603 -3.465) 15.039 8.217 ( 0.451 10.159 -1.280) 10.249 8.608 ( 11.584 8.059 7.890) 16.168 8.730 ( -17.336 -2.854 9.804) 20.119 9.103 ( -8.313 -4.396 6.482) 11.422 9.388 ( 13.217 -9.433 3.333) 16.577 9.522 ( 11.216 -1.582 0.715) 11.349 9.574 ( 14.740 8.089 1.613) 16.890 10.041 ( -0.132 -2.453 -11.958) 12.207 10.229 ( -2.588 0.519 -8.050) 8.471 10.961 ( 5.586 -5.567 5.571) 9.656 11.111 ( 10.806 0.915 4.313) 11.671 11.499 ( 5.627 -0.106 -1.219) 5.759 11.731 ( 13.636 -9.743 7.250) 18.260 12.055 ( -0.106 -2.768 2.054) 3.449 12.144 ( -6.091 5.892 -3.668) 9.234 12.524 ( -1.228 7.516 -1.440) 7.751 13.093 ( -16.178 -2.571 -6.593) 17.659 13.338 ( -4.537 -10.775 -7.612) 13.950 13.578 ( -5.929 12.016 -2.987) 13.728 13.947 ( 3.999 2.388 -9.291) 10.393 14.002 ( 0.156 0.216 -4.925) 4.932 14.142 ( -7.967 0.791 1.453) 8.137 17.463 ( 35.601 -15.160 14.342) 41.267 18.682 ( 7.482 3.837 -6.273) 10.490 18.775 ( -11.841 -0.183 -0.717) 11.864 19.173 ( -18.481 8.912 5.061) 21.132 19.442 ( -12.991 3.840 -1.168) 13.597 23.016 ( 9.077 -3.244 1.826) 9.811 23.871 ( -1.397 -0.391 -1.803) 2.314 ======================= Grid point 608 (290/433) ======================= q-point: ( 0.08 0.08 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 432 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.541 ( 12.629 -0.000 11.590) 17.141 2.956 ( 21.905 -0.000 2.801) 22.083 3.967 ( -0.340 0.000 6.123) 6.133 5.016 ( 7.318 -0.000 -0.970) 7.382 6.250 ( 4.743 -0.000 -4.557) 6.577 7.455 ( -7.083 0.000 -7.624) 10.406 7.875 ( -15.922 0.000 0.766) 15.940 8.115 ( 5.251 -0.000 13.239) 14.243 8.533 ( -7.881 0.000 5.373) 9.538 8.668 ( 9.832 -0.000 15.002) 17.936 8.988 ( -6.250 0.000 -12.885) 14.321 9.623 ( -2.289 0.000 -5.326) 5.797 9.797 ( 3.344 -0.000 -0.125) 3.346 9.901 ( 3.258 -0.000 -2.445) 4.074 9.918 ( -0.911 0.000 -5.908) 5.978 10.370 ( 8.267 -0.000 -15.676) 17.722 10.919 ( -17.996 0.000 -2.867) 18.223 11.215 ( -2.148 0.000 -0.817) 2.298 11.591 ( -4.088 0.000 -3.734) 5.537 11.690 ( -4.291 0.000 -1.603) 4.580 12.053 ( 5.144 -0.000 -1.826) 5.458 12.231 ( 1.775 -0.000 0.328) 1.805 12.445 ( 3.293 -0.000 3.705) 4.957 13.021 ( -4.549 0.000 8.781) 9.889 13.160 ( 10.295 -0.000 3.948) 11.026 13.311 ( -0.668 0.000 -0.681) 0.954 13.681 ( -6.894 0.000 2.245) 7.250 14.089 ( 7.435 -0.000 -11.773) 13.924 14.162 ( 4.931 -0.000 5.098) 7.093 17.355 ( -29.678 0.000 1.745) 29.729 18.142 ( -8.937 0.000 5.072) 10.276 18.840 ( -3.338 0.000 -1.893) 3.837 19.696 ( 23.472 -0.000 -0.094) 23.472 19.707 ( 23.470 -0.000 -0.239) 23.471 23.074 ( -7.854 0.000 -3.560) 8.623 23.682 ( -5.323 0.000 1.642) 5.570 ======================= Grid point 609 (291/433) ======================= q-point: ( 0.17 0.08 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.803 ( 13.834 5.539 5.862) 16.014 3.342 ( 15.878 -8.961 4.611) 18.806 3.969 ( -0.234 -0.016 -2.783) 2.793 5.114 ( 4.219 0.155 0.202) 4.227 6.354 ( 7.644 -3.786 -1.864) 8.732 7.255 ( -8.634 0.019 -11.652) 14.502 7.544 ( -22.205 3.294 4.466) 22.888 8.265 ( 5.684 1.561 6.488) 8.766 8.470 ( -2.364 0.598 -1.431) 2.827 8.745 ( -13.706 -3.859 -13.452) 19.588 8.933 ( 10.726 -0.463 10.942) 15.329 9.551 ( 0.329 9.748 -2.774) 10.140 9.769 ( -2.185 2.493 -11.917) 12.370 9.877 ( 2.203 -0.785 -4.928) 5.455 9.928 ( -2.535 -7.315 -3.886) 8.663 10.378 ( -1.127 3.729 -1.303) 4.108 10.571 ( -13.325 0.923 -11.872) 17.871 11.155 ( -4.701 -2.822 -0.822) 5.544 11.463 ( -3.402 5.918 -4.305) 8.071 11.619 ( -3.197 1.314 -1.116) 3.632 12.207 ( 3.336 1.005 -3.956) 5.271 12.259 ( 9.456 -5.942 0.155) 11.169 12.517 ( 2.719 2.521 3.990) 5.447 12.996 ( -0.181 9.808 13.826) 16.953 13.196 ( -6.098 -4.234 -2.257) 7.759 13.458 ( 4.438 -11.207 9.565) 15.387 13.633 ( -1.384 1.181 6.074) 6.341 14.149 ( 9.805 1.727 -12.311) 15.833 14.288 ( 5.579 -0.306 5.676) 7.964 16.815 ( -30.207 5.821 -3.085) 30.917 18.095 ( -2.964 -3.274 5.951) 7.411 18.795 ( -3.082 -2.620 0.274) 4.054 20.005 ( 21.023 7.436 1.721) 22.366 20.181 ( 23.666 -9.726 -0.012) 25.587 22.838 ( -14.513 3.905 -6.700) 16.454 23.620 ( -3.412 -0.253 2.636) 4.319 ======================= Grid point 610 (292/433) ======================= q-point: ( 0.25 0.08 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.928 ( 9.451 13.113 -0.051) 16.164 3.659 ( 3.349 -9.428 9.914) 14.085 3.951 ( 2.961 -3.806 -10.955) 11.969 5.149 ( 0.013 0.600 1.723) 1.825 6.535 ( 8.825 -5.692 -0.892) 10.539 7.056 ( -6.782 -1.187 -13.052) 14.757 7.171 ( -21.829 2.775 7.487) 23.244 8.290 ( -7.091 4.443 -12.162) 14.763 8.398 ( 4.278 -1.310 -3.253) 5.532 8.557 ( -6.638 -4.905 -2.777) 8.708 9.114 ( 6.148 1.474 -1.599) 6.521 9.380 ( -3.963 12.825 -4.618) 14.195 9.577 ( -8.814 -0.669 -13.643) 16.257 9.831 ( -8.495 0.982 -9.743) 12.964 9.956 ( 5.837 2.775 1.877) 6.730 10.238 ( -5.239 -3.008 2.481) 6.530 10.451 ( 0.863 0.098 -8.444) 8.488 11.138 ( -0.242 -3.116 0.021) 3.125 11.349 ( -0.496 6.107 -3.349) 6.983 11.535 ( -4.350 2.265 0.540) 4.934 12.145 ( -2.373 0.845 -7.421) 7.837 12.483 ( -2.312 7.856 -0.835) 8.231 12.568 ( 13.513 -6.425 3.647) 15.401 12.974 ( -3.097 1.812 9.493) 10.149 13.160 ( -4.080 -4.613 7.535) 9.732 13.614 ( -3.975 -3.768 8.312) 9.955 13.738 ( 8.941 -5.115 7.872) 12.964 14.223 ( 9.502 3.226 -10.773) 14.723 14.413 ( 5.522 0.821 6.319) 8.432 16.241 ( -27.023 6.165 -7.678) 28.761 18.168 ( 2.175 -5.169 5.948) 8.175 18.787 ( -2.406 -3.641 2.056) 4.824 20.272 ( 16.693 6.475 4.591) 18.484 20.654 ( 22.154 -8.689 -0.103) 23.798 22.448 ( -20.072 6.890 -9.070) 23.079 23.615 ( 0.031 -0.997 3.224) 3.375 ======================= Grid point 611 (293/433) ======================= q-point: ( 0.33 0.08 -0.64) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.863 ( 1.361 17.072 -2.029) 17.246 3.665 ( -7.277 1.764 -0.856) 7.536 4.076 ( 4.050 -12.352 -1.482) 13.083 5.143 ( -1.167 0.019 2.591) 2.841 6.677 ( 0.888 -3.356 -3.795) 5.143 6.832 ( -11.585 1.462 -4.205) 12.411 7.017 ( -0.783 -6.665 3.945) 7.784 8.004 ( -12.481 -2.660 -14.994) 19.689 8.456 ( 0.911 1.606 -3.054) 3.568 8.549 ( 5.550 -0.733 -3.861) 6.800 8.974 ( -9.255 8.399 -16.573) 20.758 9.165 ( -4.042 10.800 -6.002) 13.001 9.436 ( -4.597 -6.115 -9.805) 12.437 9.605 ( -3.694 7.786 -6.944) 11.067 9.989 ( 1.685 -0.348 -1.850) 2.527 10.349 ( 5.700 -6.106 4.545) 9.509 10.414 ( 0.138 3.465 -0.101) 3.469 11.192 ( 2.563 -1.853 0.765) 3.254 11.278 ( 0.073 5.665 -1.646) 5.900 11.460 ( -2.507 0.866 0.311) 2.670 12.030 ( -3.972 2.488 -8.744) 9.921 12.273 ( -9.952 8.319 -0.830) 12.997 12.825 ( 7.548 -3.117 1.776) 8.357 13.035 ( 0.838 -7.407 9.076) 11.745 13.201 ( -2.645 -2.549 10.248) 10.886 13.612 ( -4.631 -3.709 4.812) 7.639 13.999 ( 10.241 -4.603 8.396) 14.020 14.254 ( 5.720 5.358 -6.586) 10.238 14.533 ( 6.552 2.157 4.343) 8.151 15.743 ( -20.255 3.426 -10.056) 22.872 18.317 ( 4.786 -5.631 4.636) 8.724 18.813 ( -1.101 -4.454 4.240) 6.247 20.480 ( 10.941 5.696 6.966) 14.166 21.068 ( 18.981 -6.091 -0.263) 19.936 21.953 ( -22.791 8.273 -10.703) 26.503 23.675 ( 3.213 -1.627 2.953) 4.657 ======================= Grid point 612 (294/433) ======================= q-point: (-0.58 0.08 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.647 ( -5.830 16.407 -0.575) 17.421 3.468 ( -9.957 4.837 -2.992) 11.467 4.218 ( -0.696 -8.997 3.181) 9.568 5.161 ( 1.089 -1.613 1.898) 2.719 6.588 ( -7.896 -1.947 0.019) 8.132 6.687 ( -3.027 -0.428 -7.457) 8.059 7.235 ( 8.755 -11.906 6.799) 16.268 7.800 ( -6.810 -7.376 -12.703) 16.191 8.410 ( -1.526 3.769 -3.269) 5.218 8.517 ( -5.700 9.277 -10.487) 15.117 8.714 ( 4.724 2.565 -14.575) 15.535 8.988 ( -2.273 6.298 -6.731) 9.494 9.307 ( -4.204 3.345 -6.777) 8.648 9.515 ( 0.273 3.038 -4.410) 5.362 10.020 ( 1.490 -2.505 -5.011) 5.797 10.404 ( 0.926 0.472 3.568) 3.716 10.513 ( 4.098 -2.003 6.323) 7.797 11.175 ( -5.243 5.537 1.773) 7.829 11.249 ( 1.888 2.657 -0.882) 3.376 11.442 ( 0.562 -0.862 -1.693) 1.981 11.870 ( -3.205 4.204 -9.198) 10.609 12.078 ( -6.405 2.451 2.438) 7.278 12.907 ( -0.360 -1.095 2.964) 3.181 13.197 ( 2.442 -7.461 5.567) 9.624 13.238 ( -2.384 -2.812 8.296) 9.078 13.588 ( -7.539 -7.300 2.809) 10.864 14.253 ( 8.943 7.150 -0.677) 11.470 14.261 ( 7.436 -3.435 5.238) 9.723 14.627 ( 6.490 4.325 0.166) 7.801 15.396 ( -12.766 -0.329 -8.842) 15.532 18.453 ( 2.859 -3.658 2.156) 5.119 18.906 ( 2.738 -6.085 6.351) 9.212 20.597 ( 4.106 5.661 7.796) 10.473 21.300 ( -10.028 5.273 3.401) 11.829 21.526 ( 2.916 -0.977 -14.490) 14.813 23.773 ( 4.589 -1.524 1.582) 5.088 ======================= Grid point 613 (295/433) ======================= q-point: (-0.50 0.08 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.389 ( -9.174 11.380 2.666) 14.858 3.243 ( -10.128 5.917 4.012) 12.397 4.254 ( -4.666 -2.825 4.427) 7.025 5.227 ( 3.303 -2.454 0.006) 4.115 6.500 ( -4.665 0.437 -0.027) 4.685 6.657 ( 1.193 -6.706 -4.276) 8.042 7.519 ( 2.782 -13.556 6.180) 15.156 7.810 ( 6.897 -8.334 -7.270) 13.034 8.163 ( -6.697 4.928 -14.241) 16.491 8.462 ( 8.487 6.121 -2.829) 10.839 8.684 ( 3.478 7.768 -10.054) 13.172 8.897 ( 1.121 2.459 -6.099) 6.670 9.222 ( -0.006 1.485 -0.119) 1.490 9.459 ( -0.158 3.576 -3.165) 4.778 9.990 ( -1.748 3.293 -2.790) 4.657 10.457 ( 0.010 -3.846 1.300) 4.060 10.600 ( -0.106 -1.405 7.249) 7.385 10.962 ( -12.653 6.367 -0.649) 14.180 11.232 ( 1.789 4.705 -0.250) 5.039 11.483 ( 2.845 -2.778 -0.404) 3.997 11.763 ( -0.387 2.368 -7.645) 8.013 12.050 ( 1.019 -0.182 5.166) 5.269 12.897 ( -2.556 0.269 2.229) 3.402 13.291 ( 0.252 -2.488 7.437) 7.846 13.297 ( -0.779 -7.255 0.367) 7.306 13.544 ( -8.730 -9.644 1.430) 13.087 14.274 ( 0.567 0.162 1.177) 1.317 14.493 ( 13.752 4.927 2.764) 14.867 14.655 ( 4.823 5.873 -6.480) 9.987 15.224 ( -5.561 -3.482 -1.895) 6.829 18.505 ( -0.116 -1.291 1.292) 1.830 19.078 ( 5.761 -5.951 4.278) 9.322 20.594 ( -2.884 6.512 6.961) 9.959 20.853 ( -23.943 7.926 -0.962) 25.239 21.748 ( 16.399 -4.543 -7.265) 18.502 23.861 ( 3.966 -0.786 -0.522) 4.077 ======================= Grid point 614 (296/433) ======================= q-point: (-0.42 0.08 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.165 ( -11.154 5.796 6.354) 14.085 3.103 ( -6.452 5.356 15.487) 17.611 4.160 ( -9.311 4.668 4.871) 11.499 5.292 ( 2.223 -1.559 -2.619) 3.772 6.435 ( -2.431 2.261 5.054) 6.047 6.789 ( 5.962 -10.923 -5.403) 13.567 7.668 ( 0.489 -11.122 -0.420) 11.140 7.887 ( 2.667 1.027 -7.655) 8.171 8.148 ( 7.328 -0.528 -0.512) 7.365 8.562 ( 9.892 6.784 0.336) 12.000 8.642 ( 9.176 -0.868 -9.391) 13.158 8.898 ( 3.807 -0.760 -4.705) 6.100 9.264 ( 2.156 -1.721 4.675) 5.428 9.422 ( 2.654 4.326 -0.846) 5.145 9.877 ( -4.988 7.024 1.487) 8.743 10.457 ( -3.612 -1.913 -1.171) 4.252 10.632 ( -4.245 -3.224 6.685) 8.550 10.709 ( -9.693 1.614 -0.668) 9.849 11.231 ( 2.445 3.390 0.836) 4.263 11.523 ( -0.786 0.931 -0.453) 1.300 11.742 ( 3.784 -1.905 -4.462) 6.153 12.148 ( 5.369 -1.346 5.418) 7.745 12.861 ( -0.990 2.119 -0.015) 2.339 13.316 ( -1.704 -3.440 -1.768) 4.226 13.386 ( -0.619 -6.746 3.690) 7.715 13.512 ( -6.228 -10.412 1.026) 12.176 14.262 ( -3.940 -1.391 0.865) 4.267 14.566 ( 5.465 12.876 -10.516) 17.500 14.628 ( 2.694 2.351 -4.944) 6.101 15.303 ( 7.608 -6.010 9.866) 13.833 18.513 ( -0.195 -0.064 1.527) 1.541 19.212 ( 3.816 -2.065 -2.422) 4.969 20.416 ( -21.876 5.496 6.127) 23.373 20.463 ( -8.244 7.814 2.221) 11.574 22.024 ( 15.623 -5.727 -5.272) 17.455 23.908 ( 2.307 -0.050 -2.566) 3.451 ======================= Grid point 615 (297/433) ======================= q-point: (-0.33 0.08 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.992 ( -10.494 3.109 12.192) 16.383 3.109 ( -2.273 4.549 23.616) 24.157 3.910 ( -14.333 12.562 5.541) 19.849 5.278 ( -1.864 0.790 -4.803) 5.212 6.459 ( 2.415 2.418 11.243) 11.751 6.918 ( 2.141 -6.594 -8.866) 11.255 7.708 ( 1.500 0.033 -8.341) 8.474 8.022 ( 8.934 -12.894 -0.141) 15.687 8.173 ( 3.914 8.184 6.345) 11.070 8.705 ( 8.772 1.117 1.432) 8.958 8.838 ( 10.567 -3.507 -3.547) 11.685 8.997 ( 8.560 -6.711 -6.018) 12.431 9.315 ( -0.904 4.451 9.688) 10.700 9.507 ( 5.239 -5.056 2.030) 7.559 9.749 ( -1.096 6.462 3.380) 7.375 10.388 ( -3.656 -2.032 -1.609) 4.482 10.529 ( -6.356 2.035 -0.122) 6.675 10.733 ( 1.018 -9.814 6.772) 11.967 11.245 ( 1.008 2.090 1.514) 2.771 11.472 ( -0.528 2.872 -0.953) 3.072 11.830 ( 4.218 -3.833 -1.688) 5.944 12.296 ( 6.578 -1.600 3.199) 7.488 12.820 ( 0.473 4.563 -2.016) 5.011 13.291 ( -2.937 -4.299 -6.015) 7.955 13.359 ( -10.427 -7.185 0.575) 12.676 13.616 ( 4.393 -8.202 2.333) 9.593 14.170 ( -7.253 0.354 -2.469) 7.670 14.414 ( -0.565 9.335 -13.783) 16.657 14.563 ( -1.329 7.627 -3.842) 8.643 15.687 ( 18.552 -10.260 16.749) 27.018 18.533 ( 1.990 0.509 1.762) 2.706 19.192 ( -1.494 2.877 -8.571) 9.163 20.078 ( -19.242 4.264 8.289) 21.381 20.220 ( -11.247 9.780 0.058) 14.905 22.318 ( 14.539 -8.090 -2.241) 16.789 23.911 ( 0.633 0.145 -3.722) 3.778 ======================= Grid point 616 (298/433) ======================= q-point: (-0.25 0.08 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.932 ( -3.704 3.035 18.397) 19.010 3.147 ( -6.259 11.238 22.609) 26.012 3.575 ( -11.486 12.303 9.901) 19.528 5.166 ( -4.955 3.458 -4.969) 7.824 6.598 ( 6.343 0.520 12.837) 14.329 6.848 ( -3.140 5.779 -7.906) 10.284 7.680 ( -1.035 -4.620 -5.629) 7.355 8.243 ( 9.591 2.317 3.047) 10.326 8.390 ( 9.338 -16.792 4.488) 19.731 8.795 ( 5.104 4.621 0.661) 6.917 8.959 ( 1.130 -1.566 6.285) 6.575 9.198 ( 6.577 -7.058 -2.302) 9.918 9.276 ( -0.875 5.991 6.688) 9.021 9.554 ( 0.756 -1.041 0.595) 1.417 9.880 ( 9.352 -3.408 3.537) 10.563 10.355 ( -5.842 -1.378 -2.576) 6.532 10.500 ( 8.705 -3.405 0.180) 9.349 10.958 ( 5.685 -11.869 9.247) 16.085 11.246 ( 1.341 -0.445 0.408) 1.471 11.471 ( 3.059 1.323 -0.403) 3.357 11.920 ( 2.828 -3.799 -0.116) 4.737 12.383 ( 1.920 2.215 -1.257) 3.189 12.764 ( 1.178 6.614 -2.636) 7.217 13.203 ( -10.452 -6.670 -7.325) 14.401 13.254 ( -7.119 -5.636 -3.242) 9.641 13.775 ( 5.496 -2.921 1.112) 6.322 14.001 ( -7.093 1.833 -5.468) 9.142 14.229 ( -3.042 7.399 -9.913) 12.738 14.409 ( -4.100 9.396 -4.065) 11.028 16.293 ( 23.993 -18.240 19.617) 35.961 18.598 ( 5.195 0.631 2.199) 5.676 19.037 ( -4.781 5.530 -8.725) 11.383 19.754 ( -19.617 6.483 6.455) 21.645 19.922 ( -10.476 12.132 -3.532) 16.414 22.624 ( 12.097 -9.761 0.421) 15.550 23.889 ( -0.640 -0.275 -3.450) 3.519 ======================= Grid point 617 (299/433) ======================= q-point: (-0.17 0.08 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.035 ( 6.464 4.856 19.755) 21.345 2.832 ( -17.338 24.488 12.915) 32.666 3.566 ( 2.089 0.769 19.829) 19.953 5.015 ( -4.604 4.615 -3.625) 7.459 6.579 ( -4.095 7.343 -12.473) 15.042 6.905 ( 10.844 1.530 21.141) 23.809 7.701 ( -2.442 -11.083 -3.740) 11.949 8.357 ( 5.064 4.765 1.380) 7.089 8.594 ( -8.880 -11.226 6.171) 15.587 8.843 ( 9.642 11.797 3.645) 15.666 8.977 ( -9.223 -7.239 7.355) 13.840 9.255 ( 6.215 -2.050 10.535) 12.402 9.451 ( 12.961 -6.449 -8.423) 16.749 9.652 ( 8.733 -0.337 0.317) 8.746 10.002 ( 0.986 -0.149 1.816) 2.072 10.248 ( -1.673 1.509 -6.521) 6.899 10.797 ( 13.684 -10.470 1.751) 17.318 11.113 ( 0.254 -1.178 6.506) 6.617 11.439 ( 11.660 -13.126 1.043) 17.588 11.522 ( 2.362 -2.327 1.254) 3.545 11.999 ( 2.230 -3.193 1.701) 4.250 12.281 ( -5.553 7.493 -4.435) 10.327 12.711 ( 2.989 8.741 -2.372) 9.538 13.004 ( -14.967 -4.972 -5.935) 16.852 13.173 ( -5.350 -6.684 -9.431) 12.737 13.765 ( -3.625 6.883 0.261) 7.784 13.964 ( 4.191 -2.374 -2.812) 5.577 14.060 ( -2.520 5.820 -8.157) 10.333 14.211 ( -6.537 7.984 -3.260) 10.822 17.018 ( 21.124 -27.544 16.758) 38.545 18.704 ( 3.161 0.495 5.022) 5.955 18.874 ( 1.613 7.582 -7.785) 10.986 19.386 ( -17.194 10.882 3.115) 20.585 19.605 ( -9.443 12.909 -5.261) 16.837 22.893 ( 8.033 -9.439 1.405) 12.474 23.858 ( -1.731 -0.845 -1.959) 2.747 ======================= Grid point 618 (300/433) ======================= q-point: (-0.08 0.08 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.268 ( 15.072 8.001 15.910) 23.330 2.446 ( -9.568 18.155 11.844) 23.695 3.742 ( 3.528 -0.969 18.808) 19.161 4.910 ( -0.388 3.541 -2.445) 4.320 6.377 ( -2.072 7.429 -10.615) 13.121 7.239 ( 12.709 -1.195 20.125) 23.832 7.762 ( -2.662 -14.434 -2.665) 14.918 8.321 ( -1.487 9.782 0.867) 9.933 8.497 ( -11.013 -3.158 8.558) 14.300 8.832 ( -10.028 1.788 10.684) 14.762 8.995 ( 6.271 2.117 1.799) 6.858 9.524 ( 10.905 -8.195 2.918) 13.950 9.651 ( 8.361 -4.423 -4.078) 10.301 9.777 ( 1.575 -5.494 -4.752) 7.433 9.985 ( 1.892 6.469 1.061) 6.823 10.214 ( 7.110 2.784 -11.247) 13.594 11.062 ( 7.461 -2.983 3.460) 8.749 11.174 ( -1.488 -8.260 0.568) 8.412 11.572 ( 3.632 -1.472 -0.135) 3.921 11.774 ( 3.564 -16.405 4.247) 17.317 12.054 ( -1.515 5.163 -5.545) 7.726 12.098 ( -1.074 -0.514 4.839) 4.983 12.623 ( -1.413 14.450 -2.911) 14.808 12.810 ( -5.839 -6.316 -3.714) 9.369 13.103 ( -4.702 -8.210 -8.770) 12.901 13.611 ( -4.008 12.881 0.803) 13.514 13.949 ( -1.257 4.040 -6.866) 8.065 14.023 ( 1.157 2.804 -6.316) 7.007 14.047 ( -1.942 -1.256 2.248) 3.225 17.604 ( 1.438 -31.372 9.854) 32.915 18.625 ( -11.584 3.924 4.289) 12.960 18.934 ( 14.279 13.267 -5.799) 20.336 19.109 ( 0.517 7.783 1.779) 8.000 19.347 ( -3.245 9.174 -3.048) 10.197 23.076 ( 3.266 -7.320 0.952) 8.072 23.820 ( -3.175 -0.900 -0.334) 3.317 ======================= Grid point 621 (301/433) ======================= q-point: ( 0.17 0.17 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 433 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.110 ( 13.766 -0.000 4.048) 14.349 3.503 ( 5.126 -0.000 7.074) 8.736 3.924 ( -0.125 0.000 -10.680) 10.680 5.156 ( 0.126 -0.000 1.504) 1.509 6.477 ( 9.566 -0.000 -0.247) 9.570 7.046 ( -6.906 0.000 -13.279) 14.967 7.199 ( -24.008 0.000 7.536) 25.163 8.316 ( -15.297 0.000 -16.620) 22.588 8.400 ( 7.515 -0.000 -0.964) 7.577 8.506 ( -1.718 0.000 -1.456) 2.252 9.120 ( 8.075 -0.000 -0.997) 8.137 9.570 ( -12.259 0.000 -14.385) 18.900 9.582 ( -5.950 0.000 -1.894) 6.245 9.769 ( -2.137 0.000 -12.026) 12.214 9.974 ( 10.083 -0.000 4.398) 11.000 10.225 ( -14.939 0.000 -4.550) 15.617 10.457 ( 3.537 -0.000 -4.959) 6.091 11.096 ( -0.255 0.000 0.465) 0.530 11.422 ( -1.847 0.000 -2.680) 3.255 11.559 ( -4.434 0.000 0.193) 4.438 12.153 ( -3.075 0.000 -6.238) 6.955 12.487 ( 16.150 -0.000 0.881) 16.174 12.593 ( 1.801 -0.000 2.579) 3.145 12.944 ( -14.729 0.000 -2.887) 15.009 13.157 ( -0.112 0.000 17.284) 17.285 13.526 ( -0.226 0.000 12.284) 12.286 13.722 ( 7.774 -0.000 4.175) 8.824 14.257 ( 10.396 -0.000 -10.160) 14.536 14.418 ( 5.317 -0.000 6.585) 8.464 16.302 ( -29.302 0.000 -8.332) 30.463 18.117 ( 2.556 -0.000 6.618) 7.095 18.751 ( -2.077 0.000 2.744) 3.441 20.373 ( 14.854 -0.000 3.831) 15.340 20.531 ( 25.431 -0.000 0.080) 25.431 22.514 ( -20.487 0.000 -9.592) 22.622 23.606 ( -0.146 0.000 3.345) 3.349 ======================= Grid point 622 (302/433) ======================= q-point: ( 0.25 0.17 -0.64) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.220 ( 6.779 17.722 1.070) 19.005 3.619 ( -3.731 -8.804 7.853) 12.373 3.861 ( -0.116 -6.098 -12.199) 13.639 5.146 ( -2.117 0.167 2.427) 3.225 6.624 ( 4.382 -1.695 -1.741) 5.011 6.866 ( -9.359 1.997 -4.876) 10.740 6.920 ( -9.205 -3.520 4.043) 10.652 7.941 ( -17.451 -2.444 -14.862) 23.052 8.494 ( 3.105 1.717 -3.009) 4.652 8.528 ( 7.476 -1.202 -4.839) 8.986 9.116 ( -4.880 6.435 -16.271) 18.165 9.257 ( -11.873 -4.492 -17.286) 21.447 9.431 ( -1.164 7.395 1.700) 7.677 9.677 ( -2.055 -0.636 -11.680) 11.876 10.002 ( -4.730 1.035 -6.659) 8.233 10.242 ( 10.775 -3.635 9.663) 14.922 10.465 ( -0.165 1.438 -0.701) 1.608 11.145 ( 3.272 -1.822 2.266) 4.377 11.383 ( 0.243 3.628 -0.414) 3.659 11.483 ( -4.018 0.949 1.559) 4.413 12.053 ( -3.943 0.332 -6.737) 7.813 12.483 ( -8.264 12.700 -5.129) 15.997 12.706 ( 3.167 -8.409 -5.262) 10.413 12.847 ( 0.461 -8.525 10.869) 13.821 13.228 ( -1.649 2.464 15.243) 15.529 13.547 ( -5.370 -2.561 6.744) 8.994 13.941 ( 13.025 -1.337 6.116) 14.451 14.352 ( 8.275 3.642 -5.926) 10.810 14.541 ( 4.781 -0.653 6.015) 7.711 15.789 ( -23.528 1.273 -11.222) 26.099 18.244 ( 6.287 -1.929 6.462) 9.220 18.752 ( -1.548 -1.689 4.703) 5.231 20.583 ( 9.873 3.944 6.160) 12.287 20.960 ( 22.805 -4.073 -1.058) 23.190 22.061 ( -24.273 2.877 -11.243) 26.904 23.656 ( 3.320 -0.462 3.380) 4.760 ======================= Grid point 623 (303/433) ======================= q-point: ( 0.33 0.17 -0.64) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 794 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.045 ( -3.054 23.513 1.369) 23.749 3.545 ( -7.527 2.675 -4.152) 9.003 3.961 ( -0.529 -17.193 0.803) 17.220 5.134 ( -0.740 -1.009 1.894) 2.270 6.544 ( -10.203 -2.093 1.524) 10.526 6.727 ( -1.861 4.056 -5.494) 7.079 7.020 ( 5.345 -9.971 5.918) 12.768 7.656 ( -11.040 -6.485 -11.437) 17.168 8.469 ( -2.160 2.187 -3.531) 4.681 8.637 ( 5.807 2.324 -5.082) 8.060 8.777 ( -5.130 5.392 -20.320) 21.640 9.044 ( -6.188 -1.268 -15.423) 16.666 9.401 ( 2.925 7.293 -4.466) 9.038 9.587 ( 0.655 2.892 -8.546) 9.046 9.960 ( 1.578 -3.530 -3.624) 5.300 10.417 ( -1.769 0.981 0.922) 2.223 10.486 ( 6.178 -1.291 8.793) 10.823 11.214 ( -2.217 -1.071 6.161) 6.635 11.339 ( 0.679 6.277 1.114) 6.411 11.458 ( 1.628 1.382 -1.103) 2.403 11.934 ( -3.987 1.866 -7.486) 8.685 12.178 ( -9.086 8.353 -3.310) 12.779 12.764 ( -3.130 -11.390 -3.806) 12.410 13.036 ( 2.550 -7.648 8.036) 11.383 13.248 ( -3.053 2.096 12.930) 13.450 13.496 ( -6.461 -2.681 1.755) 7.211 14.210 ( 11.197 -1.852 6.004) 12.839 14.394 ( 7.117 7.098 -0.957) 10.097 14.661 ( 5.003 -0.902 3.181) 5.997 15.392 ( -14.972 -0.033 -11.271) 18.740 18.411 ( 6.687 -0.978 5.277) 8.574 18.800 ( 0.314 -4.454 6.770) 8.110 20.700 ( 4.090 4.535 7.255) 9.483 21.322 ( 14.975 -1.669 -1.037) 15.103 21.553 ( -21.125 2.717 -13.029) 24.968 23.753 ( 5.216 -0.578 2.483) 5.806 ======================= Grid point 624 (304/433) ======================= q-point: (-0.58 0.17 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.736 ( -7.063 23.307 2.381) 24.469 3.352 ( -8.267 5.104 0.229) 9.719 4.102 ( -2.402 -13.179 3.093) 13.749 5.174 ( 2.498 -2.707 0.172) 3.688 6.467 ( -3.766 -4.562 2.616) 6.468 6.622 ( -3.030 4.095 -2.112) 5.515 7.243 ( 1.018 -14.524 5.406) 15.531 7.621 ( 5.446 -9.656 -5.904) 12.560 8.257 ( -10.977 4.131 -12.326) 17.014 8.577 ( 6.160 5.896 -6.495) 10.719 8.780 ( 8.683 2.057 -11.595) 14.631 8.908 ( -2.590 -1.876 -9.973) 10.473 9.323 ( 2.033 9.183 -4.283) 10.335 9.533 ( 1.345 3.702 -5.887) 7.083 10.025 ( 3.304 -0.558 -1.076) 3.519 10.391 ( -1.346 -2.152 0.951) 2.710 10.596 ( -0.040 0.201 7.300) 7.303 11.088 ( -14.602 5.536 6.420) 16.884 11.330 ( 1.947 4.786 1.784) 5.466 11.466 ( 4.271 1.482 -3.935) 5.993 11.813 ( -2.134 2.533 -7.253) 7.973 12.061 ( 0.874 1.885 2.093) 2.950 12.783 ( -4.111 -10.646 -4.488) 12.263 13.148 ( -2.681 -8.298 4.486) 9.806 13.261 ( -3.209 -0.792 11.898) 12.348 13.420 ( -5.199 -2.882 -1.858) 6.228 14.310 ( 0.273 3.202 3.208) 4.540 14.544 ( 13.037 1.813 1.599) 13.260 14.748 ( 4.793 1.756 -0.919) 5.186 15.166 ( -6.319 -1.816 -6.612) 9.324 18.515 ( 3.109 2.273 4.418) 5.861 18.944 ( 4.565 -7.579 6.952) 11.252 20.714 ( -1.721 5.580 6.586) 8.802 20.992 ( -24.525 6.208 -6.323) 26.076 21.660 ( 16.247 -4.407 -7.236) 18.323 23.853 ( 4.768 -0.118 0.721) 4.823 ======================= Grid point 625 (305/433) ======================= q-point: (-0.50 0.17 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 794 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.427 ( -6.619 20.326 4.470) 21.839 3.213 ( -5.408 5.717 10.737) 13.312 4.153 ( -5.096 -5.707 3.250) 8.313 5.252 ( 3.734 -2.452 -2.038) 4.910 6.498 ( -0.635 3.347 7.612) 8.339 6.583 ( 1.219 -8.756 -2.416) 9.164 7.401 ( -0.058 -14.517 3.191) 14.864 7.900 ( 12.718 -7.716 0.567) 14.886 8.019 ( -2.179 -2.178 -12.794) 13.159 8.651 ( 10.464 1.877 -4.407) 11.508 8.769 ( 4.553 8.745 -12.096) 15.605 8.865 ( 0.065 -1.572 -3.984) 4.283 9.284 ( 3.496 4.584 0.180) 5.768 9.496 ( 2.041 3.598 -2.322) 4.744 10.019 ( -1.087 6.714 2.039) 7.100 10.415 ( -0.695 -2.844 -0.165) 2.933 10.586 ( -5.109 -0.824 6.442) 8.263 10.783 ( -15.787 5.229 2.538) 16.823 11.315 ( 0.788 4.680 2.244) 5.250 11.534 ( 4.818 0.790 -1.909) 5.243 11.733 ( 0.457 0.732 -6.338) 6.397 12.132 ( 4.870 0.015 4.797) 6.836 12.789 ( -2.687 -9.199 -6.056) 11.336 13.187 ( -4.541 -8.869 2.114) 10.186 13.288 ( -4.347 -4.024 7.979) 9.938 13.379 ( -0.671 -3.032 -2.016) 3.703 14.277 ( -2.742 2.873 3.014) 4.986 14.647 ( 1.460 1.241 -8.823) 9.029 14.774 ( 4.717 5.890 -3.483) 8.311 15.192 ( 7.067 -4.422 5.810) 10.161 18.547 ( 1.575 3.684 4.984) 6.395 19.133 ( 5.150 -6.125 2.615) 8.419 20.522 ( -21.840 5.325 -1.608) 22.537 20.614 ( -6.457 7.509 3.973) 10.670 21.912 ( 13.866 -5.662 -7.372) 16.694 23.912 ( 2.718 0.483 -1.309) 3.056 ======================= Grid point 626 (306/433) ======================= q-point: (-0.42 0.17 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.202 ( -2.598 17.719 8.801) 19.954 3.200 ( -1.293 5.013 19.779) 20.445 4.068 ( -8.963 3.393 3.066) 10.062 5.292 ( 1.457 0.476 -3.790) 4.088 6.511 ( 0.808 2.657 10.202) 10.573 6.742 ( 5.127 -10.201 -1.200) 11.480 7.579 ( 3.179 -12.643 0.573) 13.049 7.900 ( 3.555 0.103 -6.433) 7.351 8.281 ( 10.548 -5.987 2.600) 12.404 8.641 ( 0.426 3.944 -9.943) 10.706 8.820 ( 11.825 -1.627 -7.830) 14.276 8.903 ( 2.967 -2.257 3.696) 5.249 9.351 ( 5.594 0.040 2.765) 6.240 9.516 ( 3.501 3.381 3.646) 6.081 9.900 ( -4.623 9.486 4.221) 11.366 10.376 ( -3.730 0.551 -1.097) 3.927 10.553 ( -7.143 -0.030 4.570) 8.480 10.594 ( -3.256 -3.913 3.403) 6.123 11.295 ( -0.951 2.854 2.888) 4.170 11.532 ( 0.826 3.646 -2.575) 4.540 11.766 ( 4.864 -2.683 -4.584) 7.202 12.263 ( 6.550 -1.398 3.967) 7.784 12.791 ( -2.365 -7.894 -7.541) 11.170 13.183 ( -6.970 -8.135 0.767) 10.740 13.264 ( -3.449 -0.826 -1.543) 3.868 13.469 ( 4.554 -6.846 3.673) 9.005 14.199 ( -5.045 2.871 1.645) 6.034 14.520 ( -3.944 3.429 -13.365) 14.351 14.737 ( 1.174 7.614 -4.266) 8.806 15.499 ( 14.262 -8.494 12.235) 20.621 18.575 ( 2.778 3.992 5.728) 7.514 19.219 ( 1.279 -0.651 -4.691) 4.906 20.158 ( -17.769 4.112 4.273) 18.732 20.412 ( -8.892 9.876 0.555) 13.301 22.152 ( 11.778 -8.839 -5.794) 15.824 23.919 ( 0.376 0.641 -2.802) 2.899 ======================= Grid point 627 (307/433) ======================= q-point: (-0.33 0.17 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 794 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.129 ( 5.644 16.373 13.989) 22.263 3.284 ( 0.150 4.926 23.211) 23.729 3.831 ( -12.078 11.866 3.201) 17.232 5.242 ( -1.626 4.159 -4.202) 6.131 6.594 ( 2.619 -1.385 7.723) 8.271 6.884 ( 4.091 -1.415 3.203) 5.384 7.651 ( -1.679 -1.880 -6.442) 6.918 8.074 ( 11.090 -11.304 1.919) 15.952 8.354 ( 3.954 7.493 1.824) 8.667 8.673 ( -0.590 -11.188 -1.793) 11.346 8.988 ( 1.448 -7.904 1.381) 8.153 9.017 ( 10.215 -2.148 -4.759) 11.472 9.478 ( 6.257 3.816 7.733) 10.654 9.516 ( -2.665 6.487 7.384) 10.184 9.857 ( 5.915 0.563 2.303) 6.372 10.331 ( -0.757 -0.393 -2.131) 2.295 10.477 ( -1.911 0.115 3.389) 3.892 10.720 ( 4.644 -11.274 6.369) 13.757 11.257 ( -3.163 0.957 2.366) 4.064 11.513 ( 2.742 3.001 -2.282) 4.662 11.849 ( 4.044 -3.587 -3.372) 6.371 12.394 ( 5.144 -0.639 0.049) 5.184 12.765 ( -4.032 -7.325 -7.900) 11.503 13.129 ( -8.580 -7.179 0.564) 11.202 13.177 ( -2.083 4.264 -6.290) 7.879 13.666 ( 7.084 -7.478 3.833) 10.991 14.069 ( -6.516 4.647 -1.422) 8.129 14.329 ( -5.079 4.021 -11.037) 12.798 14.617 ( -1.660 10.084 -5.525) 11.617 15.952 ( 15.391 -16.346 15.763) 27.433 18.640 ( 5.262 3.889 6.749) 9.400 19.141 ( -2.344 4.505 -8.625) 10.009 19.872 ( -15.790 5.845 5.772) 17.799 20.157 ( -7.637 11.970 -3.721) 14.678 22.406 ( 9.490 -12.466 -2.774) 15.911 23.887 ( -1.355 0.141 -3.103) 3.389 ======================= Grid point 628 (308/433) ======================= q-point: (-0.25 0.17 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.239 ( 14.581 15.335 15.818) 26.419 3.255 ( -10.895 17.505 14.179) 25.023 3.616 ( -1.798 5.587 11.878) 13.249 5.125 ( -2.859 6.538 -3.395) 7.903 6.654 ( -0.085 -0.486 -4.880) 4.905 6.987 ( 7.187 6.329 15.851) 18.519 7.571 ( -3.692 -2.380 -4.814) 6.517 8.342 ( -0.905 -12.392 2.045) 12.592 8.408 ( 6.762 0.370 1.629) 6.965 8.777 ( 1.446 -10.887 1.490) 11.083 8.971 ( -7.314 0.603 11.644) 13.764 9.241 ( 11.414 -12.421 -12.403) 20.938 9.432 ( 2.847 15.299 11.526) 19.366 9.614 ( 5.479 -2.058 1.557) 6.056 10.007 ( 5.187 -1.090 5.816) 7.869 10.287 ( -0.636 2.511 -2.530) 3.620 10.602 ( 9.957 -8.568 -0.322) 13.140 11.000 ( 6.276 -12.418 9.055) 16.601 11.228 ( -1.224 -4.486 0.684) 4.700 11.528 ( 3.011 1.380 -2.424) 4.104 11.929 ( 3.040 -4.118 -1.599) 5.362 12.401 ( -1.605 4.282 -3.901) 6.011 12.712 ( -5.249 -7.809 -7.165) 11.827 13.037 ( -5.814 3.826 0.828) 7.010 13.064 ( -2.258 -0.886 -10.368) 10.648 13.847 ( 2.853 -1.119 0.872) 3.186 13.910 ( -2.923 0.806 -0.473) 3.069 14.160 ( -3.331 4.690 -7.682) 9.597 14.425 ( -4.407 12.060 -5.858) 14.113 16.490 ( 11.756 -26.133 16.791) 33.213 18.750 ( 5.665 4.255 9.559) 11.898 18.999 ( -1.254 5.328 -8.626) 10.216 19.588 ( -10.839 10.387 2.693) 15.252 19.880 ( -6.595 14.486 -7.855) 17.749 22.661 ( 6.196 -14.419 -0.270) 15.696 23.842 ( -2.317 -0.703 -2.120) 3.218 ======================= Grid point 629 (309/433) ======================= q-point: (-0.17 0.17 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 794 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.475 ( 18.673 13.235 12.646) 26.149 2.883 ( -10.787 24.960 8.033) 28.353 3.726 ( 3.421 -0.362 16.214) 16.575 5.008 ( -0.873 6.430 -2.120) 6.826 6.546 ( -1.045 8.429 -9.082) 12.435 7.219 ( 10.764 0.056 18.482) 21.388 7.547 ( -2.656 -7.485 -2.717) 8.394 8.332 ( -12.048 -9.055 5.811) 16.153 8.493 ( 4.233 3.572 0.022) 5.539 8.768 ( -13.501 -4.619 8.602) 16.662 9.085 ( 10.562 -1.239 1.932) 10.809 9.456 ( 7.748 -6.825 -1.579) 10.446 9.467 ( 6.174 -0.493 -1.113) 6.292 9.707 ( 2.190 -2.150 0.315) 3.085 10.084 ( 0.946 2.046 4.601) 5.124 10.281 ( 7.473 4.459 -5.117) 10.095 10.870 ( 6.895 -13.677 -1.968) 15.443 11.106 ( -2.023 -0.596 5.354) 5.754 11.415 ( 2.922 -18.016 2.967) 18.491 11.563 ( 4.627 -1.002 -3.348) 5.798 12.018 ( 2.541 -4.913 2.231) 5.964 12.232 ( -6.024 8.885 -4.255) 11.547 12.659 ( -5.945 -8.292 -5.968) 11.820 12.880 ( -4.362 9.313 -3.418) 10.836 13.004 ( 2.045 -0.365 -8.057) 8.321 13.768 ( -2.786 3.421 1.283) 4.595 13.972 ( -2.999 -2.518 2.042) 4.416 14.066 ( 5.488 4.536 -7.793) 10.556 14.180 ( -6.436 12.376 -4.354) 14.613 16.982 ( 0.686 -31.943 14.074) 34.913 18.728 ( -9.586 6.994 6.499) 13.529 19.002 ( 8.665 0.232 -1.004) 8.726 19.415 ( 6.710 16.519 -3.014) 18.083 19.577 ( -4.952 14.542 -8.043) 17.340 22.870 ( 2.069 -13.974 0.577) 14.138 23.799 ( -3.098 -1.183 -0.618) 3.373 ======================= Grid point 630 (310/433) ======================= q-point: (-0.08 0.17 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.542 ( -2.349 11.977 4.718) 13.085 2.816 ( 22.285 17.936 10.876) 30.604 3.874 ( 2.319 -1.194 12.454) 12.724 4.968 ( 3.595 4.023 -1.240) 5.536 6.402 ( 1.297 10.048 -7.291) 12.483 7.491 ( 5.576 -0.777 7.983) 9.769 7.584 ( -0.302 -12.826 -0.212) 12.832 8.237 ( -12.821 -4.141 11.744) 17.873 8.529 ( 5.946 4.362 1.995) 7.639 8.631 ( -12.779 -3.285 8.146) 15.506 9.179 ( 3.666 7.250 -2.138) 8.400 9.539 ( -2.192 -8.926 -6.983) 11.543 9.647 ( 7.045 -7.351 0.230) 10.185 9.754 ( 4.178 -1.251 -4.398) 6.194 10.071 ( -0.428 4.464 2.583) 5.175 10.362 ( 10.245 3.670 -9.498) 14.444 10.948 ( -9.605 -11.378 -3.828) 15.374 11.177 ( 5.764 -1.498 3.328) 6.822 11.528 ( -5.032 -10.030 -0.246) 11.224 11.661 ( -0.097 -7.635 -3.623) 8.451 12.068 ( -0.295 4.381 0.490) 4.418 12.147 ( 4.859 -1.889 4.919) 7.168 12.557 ( -6.743 2.485 -4.674) 8.573 12.754 ( -1.777 -3.287 -3.205) 4.923 13.059 ( 8.462 1.666 -1.525) 8.758 13.685 ( -2.899 9.566 3.433) 10.569 13.907 ( -8.543 9.263 -2.714) 12.890 13.954 ( 1.462 -3.823 -4.273) 5.917 14.132 ( 5.902 3.008 -1.913) 6.895 17.241 ( -13.756 -28.217 9.598) 32.826 18.473 ( -14.539 7.085 3.972) 16.654 19.089 ( -1.107 6.362 -2.603) 6.962 19.334 ( 10.916 8.782 -3.366) 14.409 19.592 ( 21.589 11.290 -2.053) 24.449 22.993 ( -2.481 -11.723 -0.376) 11.989 23.749 ( -4.261 -0.805 0.548) 4.371 ======================= Grid point 634 (311/433) ======================= q-point: ( 0.25 0.25 -0.64) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 432 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.463 ( -10.440 0.000 9.173) 13.897 3.491 ( 8.396 -0.000 -1.114) 8.469 3.687 ( -7.023 0.000 -10.475) 12.612 5.124 ( -1.490 0.000 1.768) 2.312 6.522 ( -11.393 0.000 2.124) 11.590 6.805 ( 1.454 -0.000 -7.920) 8.053 6.887 ( 1.609 -0.000 8.783) 8.929 7.588 ( -12.182 0.000 -10.900) 16.346 8.490 ( -2.716 0.000 -3.595) 4.506 8.649 ( 10.358 -0.000 -6.168) 12.055 8.860 ( -10.890 0.000 -18.557) 21.517 9.001 ( -4.930 0.000 -18.514) 19.159 9.512 ( 5.186 -0.000 -0.547) 5.215 9.598 ( 1.501 -0.000 -14.694) 14.771 9.916 ( -0.199 0.000 -3.841) 3.846 10.441 ( -2.793 0.000 -0.290) 2.808 10.459 ( 7.557 -0.000 10.870) 13.238 11.198 ( -1.188 0.000 6.689) 6.794 11.415 ( 0.410 -0.000 1.729) 1.777 11.467 ( 1.424 -0.000 1.809) 2.302 11.948 ( -3.867 0.000 -6.566) 7.620 12.318 ( -12.075 0.000 -9.928) 15.632 12.594 ( -2.372 0.000 -1.183) 2.651 12.956 ( 3.358 -0.000 8.302) 8.956 13.272 ( -4.388 0.000 12.733) 13.468 13.471 ( -5.326 0.000 1.965) 5.677 14.192 ( 12.418 -0.000 6.277) 13.915 14.484 ( 8.009 -0.000 -2.637) 8.432 14.630 ( 2.401 -0.000 6.002) 6.465 15.393 ( -15.332 0.000 -12.340) 19.681 18.404 ( 8.799 -0.000 6.695) 11.056 18.753 ( -1.297 0.000 6.570) 6.697 20.748 ( 3.310 -0.000 7.449) 8.151 21.297 ( 20.928 -0.000 -3.638) 21.242 21.584 ( -25.900 0.000 -11.822) 28.470 23.748 ( 5.429 -0.000 2.817) 6.117 ======================= Grid point 635 (312/433) ======================= q-point: (-0.67 0.25 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.212 ( -7.603 23.027 5.897) 24.957 3.432 ( -6.825 4.003 -3.557) 8.675 3.762 ( 0.259 -20.838 0.295) 20.842 5.136 ( 1.884 -1.027 0.378) 2.179 6.393 ( -6.440 -2.254 3.440) 7.641 6.758 ( -0.827 9.259 0.523) 9.310 6.979 ( -1.832 -12.550 4.137) 13.341 7.483 ( 3.902 -3.964 -5.011) 7.487 8.310 ( -11.315 1.372 -10.273) 15.344 8.685 ( 3.211 4.723 -10.952) 12.352 8.791 ( 10.301 -0.402 -7.753) 12.899 8.846 ( -3.468 -3.348 -13.258) 14.107 9.500 ( 3.630 6.525 -13.816) 15.705 9.591 ( 4.682 2.160 -5.823) 7.778 9.971 ( 4.550 -3.560 2.126) 6.156 10.385 ( -2.826 0.704 0.146) 2.916 10.592 ( 0.728 -0.463 8.101) 8.147 11.144 ( -12.688 0.805 11.833) 17.368 11.409 ( -0.456 2.851 2.540) 3.845 11.514 ( 3.927 2.039 -2.554) 5.109 11.847 ( -2.951 0.881 -6.616) 7.298 12.130 ( 0.393 4.318 -4.580) 6.307 12.571 ( -4.257 -8.766 -4.530) 10.747 13.019 ( -2.882 -3.886 6.027) 7.729 13.255 ( -5.565 -0.120 10.511) 11.894 13.396 ( -3.745 -0.378 -1.967) 4.247 14.369 ( 3.600 2.048 5.974) 7.270 14.591 ( 8.843 3.160 -0.266) 9.394 14.712 ( 1.500 -3.995 3.570) 5.564 15.159 ( -3.561 0.421 -10.534) 11.127 18.579 ( 7.714 3.447 6.476) 10.646 18.809 ( 0.973 -5.384 7.887) 9.599 20.793 ( -1.693 2.322 7.161) 7.716 21.078 ( -24.795 2.463 -10.304) 26.963 21.593 ( 16.884 -2.066 -6.803) 18.320 23.853 ( 5.190 0.058 1.443) 5.387 ======================= Grid point 636 (313/433) ======================= q-point: (-0.58 0.25 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.884 ( -6.136 25.136 4.050) 26.189 3.308 ( -4.511 3.775 7.022) 9.161 3.944 ( -0.557 -15.365 0.969) 15.406 5.209 ( 4.992 -1.720 -0.939) 5.363 6.404 ( 0.639 -6.179 2.486) 6.691 6.632 ( -5.158 7.116 6.397) 10.871 7.138 ( 2.636 -12.398 5.379) 13.769 7.681 ( 12.325 -9.869 -1.844) 15.896 8.063 ( -6.480 2.739 -11.696) 13.649 8.683 ( 6.625 1.622 -7.045) 9.806 8.780 ( 1.031 -3.104 -13.025) 13.430 8.908 ( 7.098 2.243 -1.694) 7.635 9.416 ( 4.136 6.295 -13.478) 15.440 9.587 ( 3.058 6.673 -1.266) 7.449 10.092 ( 3.171 -0.002 4.234) 5.290 10.361 ( -0.147 -1.664 0.572) 1.766 10.587 ( -5.610 0.360 5.546) 7.897 10.884 ( -20.879 4.462 9.059) 23.193 11.384 ( -1.845 2.237 3.175) 4.300 11.572 ( 8.816 2.955 -4.085) 10.156 11.757 ( -1.693 1.353 -6.341) 6.701 12.158 ( 5.205 2.882 2.600) 6.493 12.566 ( -3.857 -12.209 -7.735) 14.959 13.028 ( -5.136 -6.293 4.118) 9.107 13.237 ( -3.797 -1.914 8.164) 9.205 13.342 ( -1.140 -1.209 -3.820) 4.166 14.362 ( -2.405 5.449 5.496) 8.105 14.665 ( 2.454 0.637 -7.829) 8.229 14.774 ( -1.123 -4.656 2.542) 5.422 15.170 ( 10.220 1.373 -1.780) 10.464 18.652 ( 3.543 7.068 7.153) 10.662 18.986 ( 5.101 -8.764 6.326) 11.953 20.609 ( -21.599 3.389 -6.862) 22.915 20.736 ( -5.543 4.795 5.325) 9.060 21.818 ( 12.864 -3.772 -9.212) 16.266 23.923 ( 2.932 0.504 -0.409) 3.003 ======================= Grid point 637 (314/433) ======================= q-point: (-0.50 0.25 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.617 ( -0.395 23.807 6.255) 24.618 3.295 ( -0.671 4.518 15.556) 16.212 4.032 ( -2.985 -7.036 0.923) 7.699 5.296 ( 4.715 0.081 -2.031) 5.134 6.507 ( -0.506 -5.748 -0.049) 5.771 6.610 ( 3.625 -0.328 12.648) 13.162 7.351 ( 5.622 -9.588 5.872) 12.570 7.895 ( -0.078 -4.501 -10.495) 11.420 8.048 ( 13.244 -9.412 1.904) 16.359 8.748 ( 2.261 0.050 -12.541) 12.743 8.776 ( 7.228 -1.522 -8.231) 11.059 8.949 ( 3.057 6.713 4.350) 8.564 9.375 ( 4.889 2.689 -8.733) 10.363 9.585 ( 3.320 4.799 4.899) 7.619 10.082 ( -3.172 8.084 5.529) 10.295 10.382 ( -1.914 -0.573 0.235) 2.011 10.514 ( -5.227 -1.958 5.056) 7.531 10.593 ( -12.977 1.606 5.805) 14.307 11.341 ( -3.547 1.657 3.247) 5.086 11.619 ( 2.809 5.261 -4.044) 7.206 11.734 ( 5.022 -0.605 -6.738) 8.425 12.251 ( 5.294 0.128 4.476) 6.934 12.575 ( -3.824 -12.702 -9.261) 16.178 13.020 ( -6.871 -7.722 3.142) 10.803 13.270 ( 1.776 -0.470 2.171) 2.844 13.356 ( 2.354 -4.192 -0.500) 4.834 14.282 ( -4.120 5.511 4.195) 8.059 14.572 ( -3.409 2.134 -11.947) 12.606 14.793 ( -1.624 -2.021 -0.712) 2.689 15.393 ( 13.259 -2.219 5.738) 14.617 18.683 ( 3.524 7.032 7.892) 11.142 19.161 ( 3.548 -5.276 1.422) 6.515 20.232 ( -16.614 3.363 -1.393) 17.008 20.586 ( -7.654 7.815 2.282) 11.174 21.994 ( 9.388 -7.170 -9.789) 15.342 23.933 ( 0.054 0.767 -2.034) 2.175 ======================= Grid point 638 (315/433) ======================= q-point: (-0.42 0.25 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.509 ( 8.198 21.807 9.803) 25.276 3.371 ( 1.467 4.267 19.759) 20.267 3.979 ( -6.418 2.956 0.539) 7.087 5.319 ( 1.717 3.763 -2.539) 4.854 6.540 ( -0.409 -3.857 3.026) 4.920 6.829 ( 8.185 -4.052 11.785) 14.910 7.538 ( 2.772 -7.194 0.204) 7.713 7.946 ( 7.652 -4.738 -0.520) 9.015 8.377 ( 9.576 -12.443 1.263) 15.751 8.602 ( -3.810 9.893 -12.744) 16.577 8.840 ( 4.632 -3.203 -7.179) 9.124 9.009 ( 1.134 -0.573 8.443) 8.538 9.428 ( 5.681 -2.634 -4.397) 7.652 9.681 ( 5.767 3.018 12.093) 13.733 9.944 ( -3.374 9.290 3.367) 10.441 10.336 ( -1.695 0.315 0.446) 1.781 10.484 ( -4.521 0.334 6.586) 7.995 10.554 ( 1.332 -5.987 3.277) 6.954 11.273 ( -5.229 0.643 2.571) 5.863 11.582 ( 1.816 3.779 -3.762) 5.633 11.792 ( 4.823 -1.731 -6.496) 8.273 12.367 ( 4.385 -2.865 -0.780) 5.296 12.569 ( -3.593 -10.173 -8.090) 13.485 12.985 ( -7.825 -7.493 2.548) 11.130 13.290 ( 3.817 5.723 -4.307) 8.116 13.511 ( 6.544 -8.133 4.910) 11.536 14.171 ( -5.012 5.948 1.548) 7.930 14.398 ( -5.022 3.247 -11.529) 12.988 14.743 ( -2.949 2.117 -3.557) 5.083 15.698 ( 10.725 -9.360 10.492) 17.684 18.741 ( 5.515 6.276 8.478) 11.903 19.195 ( -0.804 1.065 -3.947) 4.166 19.972 ( -11.534 4.276 2.531) 12.559 20.375 ( -6.960 10.488 -1.529) 12.680 22.164 ( 6.578 -12.153 -7.684) 15.812 23.893 ( -2.113 0.468 -2.729) 3.483 ======================= Grid point 639 (316/433) ======================= q-point: (-0.33 0.25 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.580 ( 15.673 19.090 11.362) 27.188 3.466 ( -0.401 6.042 18.976) 19.918 3.790 ( -6.706 10.269 0.960) 12.302 5.256 ( -1.001 6.858 -2.319) 7.308 6.599 ( 1.241 -4.005 -0.032) 4.193 7.064 ( 8.017 0.123 14.844) 16.871 7.551 ( -4.198 -1.788 -3.419) 5.702 8.194 ( 10.478 -3.803 0.811) 11.176 8.392 ( -3.806 0.348 -4.482) 5.890 8.591 ( 3.822 -7.885 2.335) 9.068 8.919 ( -2.143 -6.686 3.649) 7.913 9.044 ( 1.245 -4.251 -2.550) 5.111 9.535 ( 4.913 -3.529 -0.921) 6.119 9.771 ( 3.876 14.185 13.223) 19.776 9.938 ( 3.150 -4.736 1.963) 6.017 10.334 ( 2.426 1.849 0.235) 3.059 10.499 ( 2.556 -2.199 3.206) 4.653 10.739 ( 6.858 -12.269 5.765) 15.192 11.197 ( -5.211 -0.577 1.930) 5.587 11.564 ( 1.873 2.005 -3.614) 4.538 11.847 ( 2.928 -3.927 -5.576) 7.422 12.403 ( -2.498 -6.208 -7.507) 10.057 12.560 ( -1.303 -4.542 -5.940) 7.590 12.952 ( -4.537 -4.417 2.055) 6.657 13.234 ( 2.454 9.705 -5.293) 11.323 13.738 ( 6.556 -7.396 4.909) 11.035 14.003 ( -6.985 6.271 -3.822) 10.135 14.243 ( -2.216 3.883 -6.836) 8.168 14.613 ( -4.618 6.402 -4.771) 9.224 16.051 ( 6.299 -18.783 13.911) 24.207 18.851 ( 7.821 5.481 9.711) 13.620 19.090 ( -4.830 4.702 -4.610) 8.167 19.776 ( -5.304 8.677 0.792) 10.200 20.142 ( -5.163 12.680 -6.288) 15.066 22.356 ( 3.795 -16.744 -3.993) 17.627 23.833 ( -2.996 -0.273 -2.197) 3.725 ======================= Grid point 640 (317/433) ======================= q-point: (-0.25 0.25 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.757 ( 16.182 15.467 8.896) 24.088 3.331 ( -7.107 20.139 7.075) 22.498 3.741 ( 3.229 2.392 10.831) 11.553 5.148 ( -1.350 7.845 -1.426) 8.087 6.635 ( 1.864 0.425 -4.462) 4.854 7.274 ( 8.536 3.814 15.555) 18.149 7.457 ( -5.197 -2.252 -1.801) 5.943 8.168 ( -8.367 -4.418 -2.027) 9.677 8.511 ( 5.531 -3.096 1.527) 6.520 8.678 ( -5.958 -4.650 3.631) 8.385 8.976 ( 3.348 -6.093 12.224) 14.063 9.173 ( 6.015 -14.108 -11.976) 19.459 9.633 ( 4.238 -1.185 -0.495) 4.428 9.746 ( 2.483 13.497 7.378) 15.581 10.030 ( -2.255 -7.199 3.172) 8.184 10.386 ( 6.642 5.859 3.585) 9.554 10.644 ( 6.753 -8.980 -4.212) 11.999 11.025 ( 5.308 -12.686 6.522) 15.220 11.153 ( -1.948 -3.901 0.914) 4.455 11.561 ( 2.032 0.398 -4.008) 4.511 11.904 ( 0.963 -6.602 -2.086) 6.990 12.325 ( -5.907 -2.005 -7.194) 9.522 12.535 ( -1.223 -3.060 -6.008) 6.852 12.920 ( -2.237 1.524 -1.179) 2.953 13.153 ( 3.570 10.002 -4.523) 11.543 13.799 ( -5.334 0.634 -3.921) 6.651 13.906 ( -0.690 -3.342 4.093) 5.329 14.169 ( 3.446 5.411 -5.586) 8.506 14.416 ( -5.783 10.616 -3.657) 12.630 16.412 ( -0.395 -26.633 14.587) 30.369 18.885 ( -10.423 8.170 2.686) 13.513 19.013 ( 8.592 1.958 6.158) 10.751 19.687 ( 8.761 12.151 -2.969) 15.272 19.872 ( -5.029 15.230 -10.393) 19.112 22.551 ( 0.444 -18.838 -1.112) 18.876 23.779 ( -3.053 -0.877 -0.878) 3.296 ======================= Grid point 641 (318/433) ======================= q-point: (-0.17 0.25 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.783 ( -1.776 13.392 0.208) 13.510 3.209 ( 14.578 20.646 9.375) 26.957 3.862 ( 3.868 0.189 9.495) 10.255 5.068 ( 1.115 6.234 -0.425) 6.348 6.591 ( 2.169 7.929 -6.130) 10.254 7.409 ( -0.723 -4.772 0.340) 4.838 7.478 ( 4.177 -0.965 7.718) 8.828 8.079 ( -10.653 -8.919 5.654) 15.001 8.561 ( -9.300 -2.937 9.821) 13.841 8.612 ( 3.138 2.118 -1.845) 4.212 9.199 ( 5.681 -5.831 -1.737) 8.325 9.325 ( 2.420 -13.212 -3.947) 14.000 9.665 ( 2.992 7.717 -0.182) 8.279 9.718 ( 1.175 -0.777 -1.886) 2.354 10.062 ( -2.737 -6.287 2.707) 7.372 10.441 ( 3.155 5.113 -0.440) 6.024 10.764 ( 1.886 -6.990 -7.569) 10.474 11.153 ( 3.140 -1.410 5.730) 6.685 11.261 ( -2.114 -14.693 -2.922) 15.129 11.580 ( 1.773 -2.041 -4.076) 4.891 11.994 ( 0.141 -8.505 4.656) 9.697 12.208 ( -1.413 2.553 -2.182) 3.643 12.518 ( -0.259 -2.673 -5.498) 6.119 12.817 ( -3.087 7.206 -4.313) 8.947 13.137 ( 7.031 6.145 -1.197) 9.414 13.738 ( -2.166 -2.015 -0.405) 2.986 13.884 ( -5.166 -2.821 0.319) 5.894 14.145 ( -0.585 10.427 -4.653) 11.433 14.226 ( 1.701 8.428 -0.192) 8.600 16.687 ( -9.004 -28.414 11.835) 32.071 18.618 ( -12.876 7.862 2.296) 15.261 19.164 ( 5.404 3.297 6.542) 9.104 19.585 ( -0.347 15.137 -10.314) 18.320 19.814 ( 20.632 11.338 -3.511) 23.802 22.703 ( -3.468 -18.228 -0.449) 18.561 23.734 ( -3.295 -0.672 0.407) 3.388 ======================= Grid point 642 (319/433) ======================= q-point: (-0.08 0.25 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.637 ( 1.149 7.499 -2.010) 7.848 3.389 ( 17.926 15.431 9.140) 25.357 3.954 ( 2.590 0.427 3.451) 4.336 5.065 ( 3.677 3.009 0.205) 4.756 6.513 ( 3.922 10.574 -4.554) 12.163 7.398 ( -5.881 -4.276 -3.270) 7.973 7.550 ( -3.525 -6.152 -1.884) 7.337 8.076 ( -5.569 -7.840 12.434) 15.719 8.489 ( -6.834 -2.432 6.344) 9.637 8.704 ( 8.987 0.950 3.361) 9.642 9.169 ( -7.037 1.708 -8.393) 11.085 9.403 ( -0.829 -2.488 -2.813) 3.846 9.671 ( 1.897 -3.695 -3.784) 5.619 9.757 ( 3.613 -4.836 -6.999) 9.243 10.112 ( 0.400 -3.526 5.042) 6.165 10.343 ( -9.117 -0.186 -6.860) 11.411 10.767 ( 1.808 2.255 -10.832) 11.211 11.250 ( -9.655 -13.000 -5.238) 17.019 11.263 ( 3.469 -1.079 3.135) 4.799 11.589 ( -1.284 -3.056 -2.283) 4.025 12.107 ( 3.762 -3.704 1.829) 5.587 12.269 ( 5.976 -2.174 4.931) 8.047 12.485 ( -1.848 2.066 -2.533) 3.755 12.707 ( 0.665 2.261 -0.203) 2.365 13.238 ( 7.567 2.430 3.055) 8.514 13.658 ( -8.034 0.490 0.990) 8.110 13.889 ( -1.087 3.535 4.432) 5.772 13.973 ( 3.144 6.826 -6.091) 9.673 14.246 ( 4.397 3.435 -0.495) 5.601 16.772 ( -17.903 -23.516 6.157) 30.190 18.366 ( -9.351 8.442 3.404) 13.050 19.085 ( -5.726 9.834 -3.349) 11.862 19.599 ( 14.595 3.365 1.534) 15.057 20.078 ( 24.465 10.064 -2.724) 26.594 22.765 ( -8.200 -15.624 -2.210) 17.783 23.683 ( -3.668 0.305 1.442) 3.953 ======================= Grid point 647 (320/433) ======================= q-point: (-0.67 0.33 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 433 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.227 ( -10.997 0.000 6.809) 12.935 3.346 ( -4.478 0.000 5.143) 6.819 3.696 ( 6.220 -0.000 -2.341) 6.646 5.192 ( 5.424 -0.000 -0.361) 5.436 6.342 ( -0.549 0.000 3.081) 3.129 6.737 ( -11.396 0.000 7.208) 13.484 6.983 ( 9.483 -0.000 6.328) 11.400 7.581 ( 10.484 -0.000 -3.048) 10.918 8.091 ( -6.782 0.000 -10.940) 12.871 8.716 ( 5.029 -0.000 -10.281) 11.445 8.729 ( 0.503 -0.000 -10.069) 10.082 8.925 ( 8.702 -0.000 -1.615) 8.851 9.471 ( 3.187 -0.000 -18.049) 18.328 9.689 ( 6.640 -0.000 -5.573) 8.669 10.061 ( 3.953 -0.000 8.574) 9.441 10.354 ( -0.963 0.000 0.316) 1.013 10.590 ( -5.390 0.000 5.615) 7.783 10.930 ( -22.302 0.000 12.525) 25.579 11.405 ( -2.898 0.000 2.663) 3.936 11.610 ( 9.368 -0.000 -3.662) 10.058 11.772 ( -2.105 0.000 -6.251) 6.596 12.215 ( 7.038 -0.000 -0.391) 7.049 12.410 ( -5.779 0.000 -6.612) 8.782 12.967 ( -4.331 0.000 4.176) 6.016 13.216 ( -4.982 0.000 8.363) 9.734 13.331 ( -1.024 0.000 -4.865) 4.972 14.436 ( -2.235 0.000 7.604) 7.926 14.672 ( 1.983 -0.000 -7.790) 8.038 14.700 ( -1.894 0.000 3.551) 4.024 15.190 ( 10.767 -0.000 -3.972) 11.476 18.797 ( 9.165 -0.000 7.339) 11.741 18.824 ( 0.106 -0.000 8.167) 8.167 20.643 ( -21.568 0.000 -8.597) 23.218 20.784 ( -5.236 0.000 5.849) 7.850 21.780 ( 12.606 -0.000 -10.000) 16.091 23.928 ( 2.990 -0.000 -0.089) 2.991 ======================= Grid point 649 (321/433) ======================= q-point: (-0.58 0.33 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.031 ( -4.251 15.662 5.886) 17.263 3.362 ( -0.026 2.157 12.881) 13.060 3.841 ( 4.071 -9.825 -1.395) 10.726 5.298 ( 6.835 0.078 -0.401) 6.848 6.400 ( 2.820 -3.382 1.161) 4.554 6.633 ( -5.191 0.982 12.079) 13.184 7.234 ( 10.963 -2.653 11.362) 16.010 7.728 ( 5.549 -6.752 -9.532) 12.932 8.006 ( 4.133 0.400 -2.672) 4.937 8.723 ( 3.462 -0.919 -8.070) 8.829 8.749 ( 5.974 -1.124 -8.487) 10.439 9.040 ( 5.506 2.084 1.744) 6.140 9.418 ( 3.873 1.116 -16.293) 16.784 9.716 ( 3.532 6.557 -1.221) 7.547 10.162 ( 0.138 0.123 9.476) 9.478 10.365 ( 0.908 -0.239 1.138) 1.475 10.494 ( -9.528 -0.408 3.999) 10.341 10.623 ( -18.534 1.056 10.578) 21.366 11.360 ( -3.961 0.406 1.881) 4.404 11.697 ( -1.242 1.522 -5.610) 5.944 11.753 ( 10.574 2.467 -6.364) 12.586 12.257 ( -1.778 0.060 -2.560) 3.117 12.371 ( 1.732 -6.563 -1.369) 6.924 12.915 ( -6.460 -2.837 2.646) 7.536 13.222 ( -0.658 -2.570 7.240) 7.711 13.330 ( 5.286 0.068 -6.206) 8.152 14.390 ( -4.733 4.536 6.348) 9.125 14.608 ( -1.977 1.872 -10.483) 10.831 14.700 ( -3.110 -5.658 1.267) 6.579 15.387 ( 12.551 0.421 1.387) 12.635 18.831 ( 2.690 7.491 7.707) 11.079 19.033 ( 6.124 -7.014 6.670) 11.453 20.278 ( -16.210 1.316 -4.926) 16.993 20.695 ( -7.023 3.094 3.763) 8.547 21.894 ( 8.042 -2.862 -12.701) 15.303 23.945 ( -0.177 0.342 -1.617) 1.663 ======================= Grid point 650 (322/433) ======================= q-point: (-0.50 0.33 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 794 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.910 ( 4.877 18.151 7.467) 20.224 3.444 ( 2.070 3.121 16.255) 16.681 3.952 ( 0.784 -4.804 -1.083) 4.987 5.383 ( 4.514 2.678 -0.360) 5.260 6.467 ( 0.473 -3.264 1.920) 3.816 6.734 ( 4.607 -5.069 13.532) 15.166 7.473 ( 7.947 1.053 6.191) 10.129 7.808 ( 3.953 -9.759 -3.281) 11.029 8.177 ( 10.531 -6.204 0.193) 12.224 8.711 ( 2.156 2.366 -11.160) 11.611 8.837 ( 6.867 -1.591 -8.389) 10.958 9.057 ( -2.260 5.826 7.321) 9.625 9.397 ( 4.143 -0.625 -10.161) 10.991 9.718 ( 2.183 2.948 5.796) 6.860 10.130 ( -4.853 8.277 7.135) 11.957 10.322 ( -4.863 -1.789 4.276) 6.718 10.463 ( 0.295 -4.266 2.177) 4.798 10.490 ( -5.263 0.439 8.270) 9.813 11.283 ( -5.632 0.510 0.828) 5.716 11.630 ( -1.021 0.865 -5.574) 5.732 11.812 ( 6.014 3.966 -8.338) 11.019 12.225 ( -3.881 -10.450 -9.337) 14.541 12.480 ( 5.749 0.111 1.936) 6.067 12.858 ( -6.372 -5.196 4.693) 9.467 13.334 ( 4.927 -3.519 5.495) 8.176 13.410 ( 8.186 0.442 -4.735) 9.467 14.292 ( -4.620 6.144 4.149) 8.735 14.457 ( -4.804 3.125 -11.355) 12.719 14.697 ( -4.637 -5.999 -1.010) 7.649 15.594 ( 8.711 -2.228 5.603) 10.594 18.863 ( 3.844 5.756 6.769) 9.681 19.188 ( 2.997 -1.402 3.918) 5.128 20.032 ( -9.468 1.995 -0.831) 9.712 20.545 ( -6.819 6.726 1.185) 9.651 21.965 ( 4.146 -7.924 -13.000) 15.779 23.902 ( -2.697 0.404 -2.467) 3.677 ======================= Grid point 651 (323/433) ======================= q-point: (-0.42 0.33 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.933 ( 11.839 16.573 7.950) 21.864 3.552 ( 2.368 3.537 16.635) 17.171 3.932 ( -2.494 3.920 -1.499) 4.882 5.381 ( 0.577 5.940 -0.299) 5.975 6.527 ( 1.805 -3.179 1.875) 4.108 6.977 ( 5.809 -8.057 13.624) 16.860 7.526 ( -0.138 0.627 -1.982) 2.084 8.063 ( 11.919 -9.298 7.387) 16.825 8.392 ( 5.119 -7.166 -1.213) 8.890 8.571 ( -1.249 9.575 -14.000) 17.007 8.863 ( 2.296 2.193 -4.168) 5.240 9.008 ( -5.866 -0.837 9.386) 11.100 9.454 ( 4.365 -4.349 -3.776) 7.226 9.800 ( 0.677 -4.710 6.596) 8.133 10.039 ( 0.814 9.485 5.693) 11.092 10.337 ( 1.582 -1.736 3.203) 3.972 10.495 ( -0.302 0.941 7.801) 7.864 10.564 ( 5.131 -6.122 3.108) 8.571 11.185 ( -5.943 -0.564 0.038) 5.970 11.583 ( -0.496 -0.483 -5.227) 5.273 11.807 ( 2.327 0.434 -8.085) 8.424 12.205 ( -4.036 -11.645 -10.933) 16.475 12.531 ( 1.495 -0.529 -5.945) 6.153 12.898 ( 1.807 -1.003 10.216) 10.423 13.398 ( 4.024 6.744 -4.352) 8.979 13.591 ( 7.780 -7.235 4.974) 11.731 14.136 ( -7.666 7.603 -3.262) 11.279 14.306 ( -1.700 2.598 -6.606) 7.299 14.644 ( -5.791 -3.283 -2.582) 7.140 15.789 ( 3.318 -8.400 9.829) 13.349 18.930 ( 4.667 2.416 3.904) 6.547 19.200 ( -1.045 6.656 4.738) 8.237 19.904 ( -2.051 4.483 -0.523) 4.958 20.363 ( -4.955 10.049 -2.415) 11.462 22.045 ( 1.161 -14.660 -9.841) 17.695 23.831 ( -3.590 0.031 -2.214) 4.218 ======================= Grid point 652 (324/433) ======================= q-point: (-0.33 0.33 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 794 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.044 ( 12.325 13.699 5.696) 19.288 3.610 ( -1.437 8.599 11.784) 14.659 3.834 ( 1.173 6.922 1.279) 7.136 5.299 ( -1.806 7.632 -0.004) 7.842 6.605 ( 3.711 -2.355 -0.773) 4.463 7.210 ( 1.459 -9.595 12.641) 15.937 7.480 ( -1.558 2.535 -0.253) 2.986 8.248 ( -6.690 10.866 -8.388) 15.270 8.380 ( 9.876 -7.109 2.833) 12.494 8.594 ( 1.834 -5.684 -0.216) 5.976 8.869 ( -0.825 -3.895 8.825) 9.682 9.001 ( 0.664 -3.709 -2.612) 4.585 9.551 ( 2.702 -5.907 -2.007) 6.798 9.860 ( -5.316 -8.725 2.721) 10.573 10.012 ( 2.504 11.861 7.184) 14.091 10.455 ( 8.203 -1.490 2.338) 8.659 10.539 ( 1.988 -0.400 2.266) 3.041 10.785 ( 8.231 -9.737 3.713) 13.279 11.117 ( -3.576 -2.032 1.123) 4.263 11.560 ( 0.409 -1.072 -4.479) 4.624 11.793 ( -0.431 -3.833 -6.134) 7.246 12.184 ( -3.536 -9.984 -9.620) 14.308 12.509 ( 0.967 -1.183 -8.172) 8.313 13.002 ( 5.188 6.155 8.535) 11.732 13.331 ( 1.295 8.541 -4.327) 9.662 13.760 ( -0.658 -4.917 0.973) 5.055 13.905 ( -6.843 3.751 -3.968) 8.754 14.261 ( 3.221 3.968 -4.182) 6.604 14.543 ( -5.248 1.762 -2.045) 5.901 15.989 ( -1.942 -16.687 12.720) 21.072 18.953 ( -3.946 0.146 -5.111) 6.459 19.156 ( 3.032 11.306 15.397) 19.342 19.880 ( 8.237 7.721 -3.213) 11.739 20.149 ( -3.927 13.483 -7.521) 15.930 22.168 ( -1.458 -20.194 -4.959) 20.845 23.766 ( -3.065 -0.418 -1.037) 3.263 ======================= Grid point 653 (325/433) ======================= q-point: (-0.25 0.33 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.049 ( 0.001 13.707 -1.360) 13.775 3.547 ( 5.596 13.641 7.902) 16.728 3.889 ( 5.915 2.698 5.031) 8.220 5.198 ( -1.318 7.065 0.538) 7.206 6.672 ( 4.707 0.966 -3.789) 6.119 7.302 ( -7.784 -8.894 5.434) 13.009 7.489 ( 3.675 1.593 3.570) 5.366 8.025 ( -5.598 5.484 -2.642) 8.270 8.491 ( -6.054 -3.652 5.143) 8.743 8.618 ( 2.354 -2.066 -1.542) 3.491 9.051 ( 1.746 -9.398 -10.832) 14.447 9.094 ( 8.820 -7.796 13.112) 17.621 9.617 ( 0.227 -6.174 -4.054) 7.390 9.816 ( -8.975 -5.926 -2.102) 10.959 9.982 ( 0.499 8.357 9.047) 12.327 10.536 ( -0.008 3.596 -1.256) 3.809 10.655 ( 9.120 -5.203 -3.006) 10.922 10.999 ( 3.792 -9.832 -2.640) 10.864 11.137 ( 1.400 -2.587 4.437) 5.324 11.560 ( 1.343 -0.546 -4.175) 4.420 11.816 ( -0.836 -8.561 0.556) 8.619 12.164 ( -2.336 -6.190 -5.707) 8.738 12.497 ( 2.409 -0.060 -7.317) 7.703 13.014 ( 2.921 12.828 2.522) 13.396 13.264 ( 2.363 6.362 -2.208) 7.137 13.678 ( -4.331 -2.960 -3.292) 6.193 13.831 ( -6.644 -2.893 1.102) 7.330 14.270 ( 5.157 4.755 -4.726) 8.458 14.420 ( -3.151 8.205 1.241) 8.877 16.186 ( -6.854 -22.755 12.124) 26.679 18.760 ( -9.952 6.357 -1.890) 11.960 19.252 ( 5.318 6.198 12.837) 15.215 19.878 ( -2.391 14.689 -9.815) 17.828 20.014 ( 17.863 9.518 -4.665) 20.771 22.308 ( -4.449 -22.284 -1.733) 22.789 23.724 ( -2.302 -0.281 0.376) 2.350 ======================= Grid point 654 (326/433) ======================= q-point: (-0.17 0.33 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 794 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.835 ( -3.695 12.782 -6.042) 14.613 3.633 ( 9.134 9.114 9.601) 16.083 3.987 ( 6.581 2.919 0.356) 7.208 5.140 ( 0.530 4.571 0.942) 4.697 6.687 ( 4.789 6.559 -4.878) 9.474 7.275 ( -8.135 -8.332 4.371) 12.438 7.490 ( -4.324 -1.304 -6.100) 7.590 7.957 ( -1.245 -2.002 4.594) 5.163 8.437 ( -5.781 -2.579 6.379) 8.987 8.701 ( 5.546 -1.762 0.114) 5.820 9.067 ( -3.485 -8.950 -10.893) 14.522 9.357 ( 5.847 -4.261 6.996) 10.064 9.640 ( -0.250 -6.326 -6.765) 9.265 9.668 ( -9.129 -3.077 -4.920) 10.817 9.984 ( -2.517 -0.848 7.597) 8.048 10.424 ( -3.981 5.109 -7.966) 10.267 10.818 ( 9.312 0.704 -5.401) 10.788 11.022 ( -6.300 -8.461 -9.831) 14.420 11.238 ( 3.185 -1.773 5.316) 6.446 11.552 ( -0.363 -0.645 -2.599) 2.702 11.961 ( 3.758 -10.727 6.822) 13.256 12.186 ( 1.131 -5.684 -0.634) 5.830 12.490 ( 0.846 0.172 -5.146) 5.218 12.901 ( 1.283 14.299 -2.166) 14.519 13.293 ( 5.649 3.390 4.564) 8.015 13.636 ( -7.520 -2.757 -0.920) 8.062 13.795 ( 1.794 -6.130 -0.667) 6.422 14.228 ( 0.077 11.130 -1.237) 11.199 14.333 ( 1.195 6.379 1.234) 6.606 16.315 ( -12.243 -23.117 7.520) 27.219 18.533 ( -7.570 8.685 1.289) 11.593 19.263 ( -3.500 8.335 1.253) 9.126 19.730 ( 7.262 10.099 -0.626) 12.454 20.255 ( 22.825 8.163 -3.724) 24.525 22.407 ( -8.279 -21.223 -1.644) 22.840 23.693 ( -2.026 0.750 1.518) 2.640 ======================= Grid point 655 (327/433) ======================= q-point: (-0.08 0.33 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.688 ( 1.220 4.002 -6.742) 7.935 3.735 ( 3.034 4.569 9.780) 11.213 4.052 ( 7.905 5.416 -4.902) 10.763 5.132 ( 0.879 1.611 1.219) 2.203 6.668 ( 5.932 9.224 -3.884) 11.634 7.226 ( -10.688 -6.935 4.961) 13.673 7.321 ( -10.061 -0.856 -10.350) 14.460 8.039 ( 2.318 -8.003 0.714) 8.362 8.430 ( -0.767 -0.625 2.301) 2.505 8.842 ( 5.756 -4.625 3.464) 8.156 8.944 ( -10.489 -2.453 -10.340) 14.932 9.355 ( -6.042 1.003 -5.683) 8.356 9.585 ( -1.974 -7.149 -6.814) 10.072 9.724 ( 3.222 -7.490 0.580) 8.174 9.957 ( -9.142 -4.782 0.009) 10.318 10.283 ( 1.615 6.836 -4.165) 8.166 10.732 ( -6.989 5.355 -14.978) 17.374 11.028 ( 2.554 -8.361 -2.901) 9.211 11.303 ( 0.214 -0.324 1.975) 2.013 11.533 ( -1.818 -0.772 -0.557) 2.052 12.134 ( 4.047 -4.210 -5.089) 7.746 12.299 ( 0.937 -8.040 5.599) 9.843 12.480 ( 0.372 -3.082 2.373) 3.907 12.843 ( 6.335 9.537 3.127) 11.868 13.376 ( 1.518 4.375 5.571) 7.245 13.529 ( -4.850 -2.719 3.597) 6.622 13.947 ( 6.842 -4.487 -0.755) 8.217 14.101 ( 1.841 13.210 -0.138) 13.339 14.321 ( 0.992 1.715 1.326) 2.384 16.290 ( -17.830 -17.999 0.408) 25.338 18.374 ( -2.686 9.426 3.612) 10.445 19.059 ( -6.088 9.760 -3.691) 12.081 19.886 ( 13.653 1.875 6.347) 15.172 20.541 ( 22.469 7.762 -2.311) 23.884 22.403 ( -13.229 -17.942 -4.158) 22.676 23.662 ( -1.429 1.988 2.377) 3.413 ======================= Grid point 661 (328/433) ======================= q-point: (-0.58 0.42 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 432 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.111 ( 0.769 -0.000 7.316) 7.357 3.478 ( 2.300 -0.000 14.460) 14.642 3.877 ( 5.932 -0.000 -1.901) 6.229 5.411 ( 5.733 -0.000 0.745) 5.781 6.432 ( 1.702 -0.000 1.890) 2.543 6.677 ( 1.625 -0.000 13.336) 13.435 7.529 ( 13.892 -0.000 16.748) 21.760 7.660 ( 0.160 -0.000 -12.265) 12.266 8.125 ( 9.265 -0.000 -0.525) 9.280 8.758 ( 4.984 -0.000 -6.757) 8.396 8.781 ( 5.832 -0.000 -8.399) 10.225 9.125 ( -0.045 0.000 5.054) 5.054 9.393 ( 3.354 -0.000 -13.103) 13.526 9.769 ( -0.526 0.000 0.156) 0.549 10.218 ( -1.280 0.000 11.479) 11.550 10.299 ( -12.351 0.000 5.000) 13.325 10.404 ( 1.877 -0.000 1.806) 2.605 10.497 ( -5.455 0.000 8.939) 10.472 11.290 ( -5.231 0.000 -0.676) 5.275 11.634 ( -2.093 0.000 -6.265) 6.606 11.885 ( 7.559 -0.000 -9.546) 12.176 12.086 ( -6.354 0.000 -10.122) 11.951 12.491 ( 6.984 -0.000 4.315) 8.210 12.805 ( -5.452 0.000 5.769) 7.938 13.281 ( 4.700 -0.000 6.537) 8.051 13.428 ( 9.356 -0.000 -6.156) 11.200 14.362 ( -4.612 0.000 4.067) 6.149 14.527 ( -3.262 0.000 -11.491) 11.946 14.582 ( -6.705 0.000 1.195) 6.811 15.578 ( 8.070 -0.000 3.948) 8.984 18.928 ( 1.208 -0.000 3.587) 3.785 19.167 ( 6.791 -0.000 9.703) 11.843 20.050 ( -9.147 0.000 -2.212) 9.411 20.613 ( -6.748 0.000 2.593) 7.229 21.884 ( 3.171 -0.000 -15.591) 15.910 23.907 ( -2.917 0.000 -2.377) 3.762 ======================= Grid point 663 (329/433) ======================= q-point: (-0.50 0.42 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.174 ( 6.580 7.219 6.128) 11.531 3.603 ( 3.059 1.520 14.123) 14.530 3.956 ( 3.158 -0.373 -1.764) 3.636 5.469 ( 1.569 2.754 1.621) 3.560 6.484 ( 2.270 -1.181 2.942) 3.899 6.834 ( 4.026 -4.843 12.478) 13.977 7.567 ( -0.579 2.411 -7.493) 7.892 7.902 ( 13.269 -5.804 15.205) 20.999 8.277 ( 8.172 -3.344 -3.623) 9.544 8.735 ( 2.445 6.667 -9.828) 12.125 8.865 ( 5.527 -3.876 -7.690) 10.233 9.067 ( -8.698 5.353 9.302) 13.814 9.384 ( 1.975 -2.421 -6.805) 7.489 9.747 ( -2.901 -0.800 4.174) 5.145 10.176 ( -1.177 4.770 4.390) 6.589 10.284 ( -1.011 -3.093 8.350) 8.962 10.468 ( 3.017 -2.873 1.477) 4.420 10.524 ( 1.841 0.639 10.170) 10.355 11.180 ( -6.130 -0.038 -3.460) 7.039 11.563 ( -2.161 -0.832 -5.730) 6.180 11.862 ( 1.077 4.886 -9.663) 10.882 12.002 ( -2.556 -8.884 -10.570) 14.043 12.520 ( -0.231 -0.436 -8.337) 8.351 12.906 ( 7.480 1.077 17.054) 18.654 13.442 ( 7.322 -2.266 5.116) 9.215 13.523 ( 6.553 0.945 -5.001) 8.298 14.287 ( -6.373 6.842 0.574) 9.368 14.346 ( -2.955 2.264 -9.693) 10.383 14.519 ( -7.284 -8.048 -0.989) 10.900 15.702 ( 2.108 -1.644 7.252) 7.729 18.953 ( 0.991 0.413 0.442) 1.161 19.310 ( 4.286 3.611 10.255) 11.687 19.953 ( -1.149 0.939 -0.635) 1.614 20.508 ( -4.910 4.311 1.612) 6.730 21.833 ( -0.831 -6.288 -15.709) 16.941 23.832 ( -3.938 0.055 -2.216) 4.519 ======================= Grid point 664 (330/433) ======================= q-point: (-0.42 0.42 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.259 ( 8.490 8.175 3.294) 12.237 3.710 ( 2.363 3.038 12.094) 12.692 3.951 ( 0.517 4.170 -1.796) 4.570 5.430 ( -2.411 5.551 2.003) 6.374 6.566 ( 4.404 -1.530 1.126) 4.796 7.012 ( -0.727 -9.029 11.889) 14.946 7.501 ( -0.945 -0.112 -5.134) 5.222 8.230 ( 8.920 -4.050 8.258) 12.813 8.412 ( 5.349 -4.888 -3.879) 8.219 8.597 ( 1.540 11.802 -11.231) 16.365 8.885 ( -1.764 3.988 0.677) 4.413 8.952 ( -4.682 -1.717 7.852) 9.302 9.424 ( 0.197 -6.743 -2.519) 7.201 9.729 ( -6.007 -4.454 3.882) 8.426 10.186 ( 4.299 6.262 3.845) 8.514 10.374 ( 3.328 -4.410 4.547) 7.155 10.556 ( 3.412 -0.684 1.863) 3.947 10.664 ( 6.572 -2.906 8.494) 11.125 11.072 ( -4.365 -2.131 -4.119) 6.369 11.522 ( -0.755 -1.979 -3.689) 4.254 11.777 ( -0.471 1.697 -8.308) 8.493 11.993 ( -1.583 -9.189 -9.661) 13.427 12.487 ( 2.900 -0.898 -10.377) 10.812 13.122 ( 9.285 5.717 15.458) 18.917 13.475 ( 0.324 6.045 -3.787) 7.141 13.650 ( 2.779 -5.786 2.911) 7.048 14.017 ( -10.646 7.323 -8.274) 15.343 14.319 ( 3.359 2.038 -3.514) 5.271 14.480 ( -5.250 -7.329 -0.320) 9.021 15.778 ( -3.262 -5.833 10.479) 12.429 18.947 ( -1.573 -0.444 -3.323) 3.703 19.365 ( 2.278 9.138 12.837) 15.921 19.980 ( 7.123 2.766 -1.532) 7.793 20.380 ( -2.584 9.929 -1.926) 10.439 21.815 ( -3.493 -15.168 -11.271) 19.218 23.762 ( -3.104 -0.121 -1.113) 3.300 ======================= Grid point 665 (331/433) ======================= q-point: (-0.33 0.42 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.286 ( 2.709 10.362 -1.733) 10.849 3.735 ( 0.107 6.753 7.395) 10.015 3.947 ( 4.721 2.484 0.998) 5.427 5.329 ( -3.603 6.249 1.940) 7.469 6.666 ( 6.465 -0.840 -2.065) 6.838 7.096 ( -8.458 -10.756 9.657) 16.748 7.485 ( 0.377 -1.966 -3.407) 3.951 8.217 ( -5.701 9.042 -4.216) 11.490 8.478 ( 3.961 3.582 -1.681) 5.598 8.536 ( -0.799 -4.087 -3.695) 5.567 8.910 ( 2.767 -4.081 -6.818) 8.414 9.009 ( 4.453 -2.313 17.617) 18.318 9.464 ( -3.016 -8.983 -2.847) 9.894 9.669 ( -9.220 -6.041 1.043) 11.072 10.195 ( 2.196 10.388 5.541) 11.976 10.512 ( 3.754 -5.086 -2.452) 6.780 10.611 ( 4.395 0.544 0.515) 4.458 10.860 ( 6.462 -6.091 2.436) 9.208 11.057 ( 0.597 -5.116 -0.439) 5.169 11.533 ( 1.359 -2.219 -1.795) 3.161 11.724 ( -0.240 -0.651 -4.866) 4.916 12.018 ( 0.198 -8.116 -6.357) 10.311 12.501 ( 5.192 0.332 -9.758) 11.059 13.255 ( 5.393 10.189 8.720) 14.455 13.380 ( -0.624 6.562 -1.051) 6.675 13.641 ( -6.891 -1.361 -3.742) 7.958 13.783 ( -8.380 -1.222 -2.711) 8.892 14.345 ( 4.890 2.998 -4.396) 7.227 14.486 ( -0.691 -1.656 2.233) 2.865 15.846 ( -6.746 -12.147 11.523) 18.051 18.850 ( -5.379 3.070 -4.505) 7.659 19.397 ( 2.148 8.208 13.759) 16.165 20.087 ( 6.710 5.965 -1.140) 9.050 20.227 ( 6.656 13.471 -8.033) 17.039 21.874 ( -5.423 -21.918 -5.048) 23.136 23.722 ( -1.525 -0.006 0.412) 1.580 ======================= Grid point 666 (332/433) ======================= q-point: (-0.25 0.42 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.108 ( -4.502 14.890 -6.900) 17.018 3.748 ( 2.089 3.751 7.408) 8.563 4.035 ( 6.686 0.923 -0.878) 6.807 5.232 ( -2.627 4.811 1.565) 5.700 6.760 ( 7.561 1.657 -5.200) 9.325 7.082 ( -11.351 -10.957 8.205) 17.783 7.466 ( -2.617 -1.650 -6.132) 6.869 8.017 ( -5.121 6.068 -2.598) 8.355 8.422 ( -2.463 2.200 2.353) 4.056 8.622 ( 4.049 -6.259 -3.151) 8.094 8.905 ( -2.273 -7.102 -10.204) 12.639 9.285 ( 10.059 -2.183 14.446) 17.738 9.457 ( -7.104 -11.315 -3.502) 13.811 9.551 ( -10.662 -5.939 -3.461) 12.686 10.128 ( -1.020 11.323 5.377) 12.577 10.484 ( -2.325 1.016 -8.165) 8.550 10.757 ( 8.261 -4.428 -1.777) 9.540 10.962 ( 2.609 -0.784 -9.374) 9.762 11.175 ( 3.787 -5.487 6.113) 9.046 11.560 ( 1.410 0.793 -2.986) 3.396 11.760 ( 1.828 -7.881 4.927) 9.473 12.067 ( 0.723 -6.246 -3.240) 7.073 12.511 ( 2.642 1.785 -7.547) 8.193 13.165 ( -2.751 11.007 -3.243) 11.800 13.375 ( 6.048 5.811 4.197) 9.379 13.566 ( -5.745 -3.543 0.151) 6.751 13.689 ( -3.156 -4.832 0.628) 5.805 14.354 ( 3.374 4.005 -4.517) 6.916 14.478 ( -0.927 5.949 4.402) 7.459 15.921 ( -8.800 -16.955 8.296) 20.826 18.688 ( -4.908 7.129 -1.664) 8.814 19.405 ( -2.019 6.537 5.986) 9.090 19.968 ( 1.224 13.842 -0.725) 13.915 20.390 ( 20.997 6.112 -4.800) 22.389 21.969 ( -7.972 -23.738 -1.960) 25.118 23.710 ( -0.440 0.907 1.704) 1.980 ======================= Grid point 667 (333/433) ======================= q-point: (-0.17 0.42 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.847 ( -3.833 12.233 -8.679) 15.481 3.779 ( -1.651 1.006 6.308) 6.598 4.129 ( 7.410 1.291 -3.115) 8.141 5.171 ( -1.657 2.325 1.153) 3.079 6.812 ( 6.987 5.269 -7.126) 11.285 7.043 ( -11.655 -10.151 8.404) 17.593 7.349 ( -4.850 2.036 -9.462) 10.826 7.926 ( -2.084 -3.439 -3.199) 5.138 8.420 ( 1.151 -0.252 2.213) 2.507 8.725 ( 2.297 -7.240 -2.576) 8.020 8.849 ( -5.387 -6.708 -10.378) 13.480 9.332 ( -15.427 -5.022 -2.560) 16.424 9.406 ( -3.758 -8.310 -6.024) 10.930 9.583 ( 6.261 -5.380 7.303) 11.022 10.022 ( -2.571 8.582 1.665) 9.112 10.391 ( 0.780 3.950 -6.516) 7.660 10.800 ( -7.071 1.591 -13.965) 15.733 10.941 ( 8.270 -0.355 -4.550) 9.445 11.289 ( 1.135 -1.263 4.441) 4.755 11.541 ( -0.113 1.484 -0.806) 1.693 11.989 ( 7.011 -11.199 5.757) 14.412 12.126 ( -0.042 -8.178 0.574) 8.198 12.449 ( -3.622 0.567 -4.416) 5.740 13.039 ( 2.388 8.571 -1.358) 9.001 13.459 ( -5.788 1.244 5.085) 7.804 13.489 ( 5.394 1.882 4.092) 7.027 13.809 ( 7.493 -7.972 -0.594) 10.956 14.327 ( 2.000 6.103 -3.064) 7.116 14.395 ( -3.707 8.281 5.779) 10.757 15.952 ( -11.246 -16.408 1.694) 19.964 18.556 ( -1.259 9.182 1.702) 9.422 19.246 ( -6.949 9.155 -3.892) 12.135 19.972 ( 8.105 7.035 7.903) 13.328 20.667 ( 21.156 5.406 -3.098) 22.055 22.016 ( -11.687 -21.855 -2.796) 24.941 23.705 ( 0.146 2.365 2.436) 3.399 ======================= Grid point 668 (334/433) ======================= q-point: (-0.08 0.42 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.674 ( -1.807 3.493 -7.585) 8.544 3.733 ( -6.886 -1.105 1.940) 7.239 4.214 ( 6.551 2.992 -1.452) 7.346 5.143 ( -1.054 0.334 1.350) 1.745 6.804 ( 3.024 4.627 -7.520) 9.333 6.976 ( -10.747 -4.578 4.839) 12.644 7.197 ( -1.487 5.287 -5.972) 8.114 7.957 ( 1.147 -9.260 -7.388) 11.901 8.471 ( 3.502 -0.563 -0.449) 3.576 8.690 ( -9.878 -1.564 -9.534) 13.817 8.811 ( -1.253 -9.690 -5.402) 11.165 9.105 ( -13.318 -5.514 -5.237) 15.337 9.393 ( -4.941 -11.890 -5.468) 13.989 9.699 ( -1.600 -0.834 -3.119) 3.603 9.956 ( 5.478 7.289 4.330) 10.094 10.376 ( 3.941 3.877 -1.824) 5.822 10.532 ( -8.876 3.647 -10.951) 14.560 11.062 ( 6.382 -2.614 -3.517) 7.741 11.293 ( -2.238 0.670 0.467) 2.382 11.515 ( -0.964 2.039 0.115) 2.258 12.056 ( -2.801 -4.064 -10.630) 11.720 12.244 ( -4.149 -4.282 2.686) 6.540 12.476 ( 4.201 -11.608 10.535) 16.229 13.065 ( 7.075 5.926 3.949) 10.039 13.378 ( -4.129 2.047 3.353) 5.699 13.609 ( 6.485 3.601 8.175) 11.039 13.998 ( 5.571 -5.341 -3.048) 8.298 14.263 ( 2.334 11.764 0.722) 12.015 14.332 ( -1.072 -1.361 4.625) 4.939 15.868 ( -13.815 -11.278 -4.911) 18.498 18.488 ( 2.030 10.004 3.013) 10.643 19.030 ( -5.220 7.974 -2.621) 9.885 20.149 ( 10.219 0.660 9.687) 14.096 20.936 ( 18.652 5.157 -1.149) 19.385 21.952 ( -16.000 -17.681 -6.047) 24.600 23.702 ( 1.182 3.302 2.582) 4.355 ======================= Grid point 675 (335/433) ======================= q-point: ( 0.50 -0.50 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 433 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.341 ( 6.674 0.000 2.289) 7.055 3.740 ( 3.272 0.000 11.262) 11.728 3.989 ( 1.089 -0.000 -1.771) 2.079 5.488 ( -2.795 0.000 3.078) 4.158 6.550 ( 4.546 0.000 1.888) 4.923 6.917 ( -0.534 0.000 11.723) 11.736 7.496 ( -1.639 0.000 -8.507) 8.663 8.196 ( 11.279 0.000 13.807) 17.829 8.347 ( 6.593 0.000 -7.430) 9.934 8.744 ( -0.218 0.000 -7.372) 7.376 8.874 ( 3.627 0.000 -7.533) 8.360 9.001 ( -8.784 0.000 11.202) 14.235 9.339 ( -1.857 0.000 -2.457) 3.080 9.688 ( -6.299 0.000 4.308) 7.631 10.255 ( 6.806 -0.000 -0.550) 6.828 10.320 ( 0.394 0.000 9.798) 9.806 10.529 ( 5.196 0.000 0.292) 5.204 10.648 ( 3.584 0.000 10.641) 11.228 11.051 ( -4.627 0.000 -6.938) 8.339 11.503 ( -0.979 0.000 -2.515) 2.699 11.838 ( -1.356 0.000 -8.933) 9.035 11.857 ( 0.061 0.000 -9.791) 9.791 12.478 ( 3.790 0.000 -11.057) 11.689 13.188 ( 9.936 0.000 18.387) 20.900 13.550 ( -0.026 -0.000 -4.781) 4.781 13.570 ( 4.398 0.000 3.722) 5.761 14.127 ( -12.251 -0.000 -11.295) 16.663 14.340 ( 3.407 -0.000 -2.722) 4.361 14.361 ( -4.752 0.000 1.815) 5.087 15.729 ( -3.680 0.000 9.632) 10.311 18.942 ( -1.167 0.000 -2.749) 2.987 19.461 ( 2.805 0.000 11.042) 11.393 20.002 ( 6.462 0.000 0.128) 6.464 20.487 ( -1.724 0.000 2.277) 2.856 21.654 ( -4.667 0.000 -15.870) 16.542 23.761 ( -3.125 0.000 -1.136) 3.325 ======================= Grid point 677 (336/433) ======================= q-point: (-0.42 0.50 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.425 ( 5.007 3.765 -1.598) 6.465 3.831 ( 1.551 3.199 7.110) 7.950 3.965 ( -1.147 -0.320 -1.250) 1.726 5.421 ( -5.417 2.802 3.316) 6.942 6.653 ( 7.109 -0.442 -1.166) 7.218 6.939 ( -7.735 -4.600 10.742) 14.014 7.441 ( 0.047 -1.730 -7.511) 7.708 8.301 ( -4.724 1.969 1.453) 5.320 8.416 ( 4.647 -3.728 -7.626) 9.677 8.670 ( 0.918 7.350 -8.335) 11.150 8.860 ( -1.475 -2.080 -7.741) 8.150 9.014 ( 4.288 2.736 21.042) 21.648 9.311 ( -3.972 -5.842 -1.601) 7.244 9.594 ( -8.854 -1.855 3.239) 9.609 10.350 ( 5.125 5.635 3.110) 8.227 10.430 ( 6.577 -3.451 0.983) 7.493 10.616 ( 3.670 -0.134 -0.019) 3.673 10.742 ( 0.278 -4.577 6.132) 7.657 10.986 ( 1.309 -1.890 -5.939) 6.368 11.503 ( 1.043 -0.671 0.609) 1.382 11.758 ( 1.264 3.315 -7.471) 8.270 11.876 ( 2.959 -6.066 -6.201) 9.166 12.506 ( 7.095 0.155 -11.189) 13.250 13.371 ( -0.230 2.936 7.382) 7.948 13.504 ( 1.889 4.080 6.027) 7.519 13.601 ( -4.225 -2.229 0.219) 4.782 13.816 ( -12.553 3.449 -11.673) 17.485 14.372 ( 2.478 -1.608 0.153) 2.957 14.408 ( 4.611 -2.467 -0.360) 5.242 15.710 ( -7.308 -2.891 10.880) 13.421 18.886 ( -2.494 0.804 -4.586) 5.282 19.526 ( 0.035 4.059 10.083) 10.869 20.148 ( 9.372 1.216 3.190) 9.975 20.462 ( 3.755 8.493 -2.919) 9.734 21.527 ( -6.716 -11.631 -10.634) 17.130 23.723 ( -1.101 0.034 0.449) 1.190 ======================= Grid point 678 (337/433) ======================= q-point: (-0.33 0.50 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 794 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.375 ( -0.723 11.775 -5.556) 13.040 3.807 ( -1.628 2.978 3.968) 5.222 4.000 ( 1.957 -4.376 -0.830) 4.865 5.314 ( -5.474 3.389 2.315) 6.842 6.772 ( 8.916 -0.153 -6.171) 10.844 6.898 ( -10.598 -7.201 10.442) 16.530 7.425 ( 0.114 -2.249 -6.837) 7.198 8.108 ( -11.831 3.131 -2.657) 12.523 8.471 ( 1.092 -3.418 -6.733) 7.629 8.557 ( 1.232 5.011 -5.715) 7.699 8.790 ( -4.729 -4.942 -8.236) 10.706 9.260 ( -2.719 -6.128 4.015) 7.814 9.293 ( 8.429 0.269 10.012) 13.090 9.468 ( -10.624 -2.520 1.671) 11.046 10.338 ( -0.682 9.439 3.854) 10.218 10.493 ( -0.671 1.033 -5.232) 5.375 10.696 ( 8.803 -2.151 -3.253) 9.629 10.880 ( 3.433 -8.992 2.612) 9.973 11.056 ( 5.966 -4.617 -2.168) 7.849 11.551 ( 2.621 -1.108 1.693) 3.311 11.717 ( 0.735 2.034 -3.419) 4.046 11.962 ( 3.462 -4.358 -3.732) 6.701 12.547 ( 4.794 1.636 -8.750) 10.110 13.268 ( -7.563 1.117 -1.211) 7.741 13.482 ( -3.381 1.955 -8.151) 9.039 13.547 ( -6.699 -0.170 6.152) 9.097 13.643 ( 2.857 3.422 4.425) 6.281 14.414 ( 3.570 2.347 -3.028) 5.237 14.515 ( 2.645 -1.777 3.914) 5.047 15.687 ( -8.022 -7.278 8.733) 13.913 18.796 ( -2.105 3.871 -3.792) 5.813 19.512 ( -3.036 4.340 6.132) 8.103 20.216 ( -0.361 10.245 6.877) 12.344 20.510 ( 18.516 7.261 -8.621) 21.677 21.528 ( -7.669 -20.711 -3.576) 22.373 23.725 ( 0.690 0.615 1.870) 2.086 ======================= Grid point 679 (338/433) ======================= q-point: (-0.25 0.50 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.134 ( -4.923 16.853 -7.590) 19.128 3.791 ( -2.922 0.212 4.006) 4.963 4.079 ( 2.982 -6.384 -3.201) 7.739 5.214 ( -4.365 2.017 0.907) 4.893 6.809 ( -5.097 -6.662 -2.286) 8.694 6.929 ( 5.335 0.303 2.393) 5.855 7.382 ( -1.020 1.370 -7.506) 7.698 7.891 ( -8.927 -0.877 -4.224) 9.915 8.423 ( -1.120 0.390 -3.650) 3.838 8.585 ( 1.711 -6.446 -6.070) 9.018 8.707 ( -5.993 -7.508 -9.184) 13.290 9.175 ( -10.351 -8.222 -4.181) 13.865 9.307 ( -11.196 -3.665 -2.018) 11.953 9.565 ( 11.111 2.928 12.608) 17.059 10.207 ( -4.037 10.045 2.267) 11.060 10.441 ( 1.205 1.772 -4.992) 5.432 10.822 ( 5.170 0.948 -8.568) 10.052 10.949 ( 3.079 -0.933 -8.213) 8.821 11.232 ( 4.824 -5.215 6.142) 9.391 11.585 ( 1.019 2.629 -1.523) 3.204 11.776 ( 4.401 -8.100 8.377) 12.456 12.006 ( -0.054 -4.444 -4.401) 6.255 12.487 ( -4.275 2.858 -6.255) 8.097 13.134 ( -4.634 1.349 -0.691) 4.875 13.418 ( -2.299 -2.097 -3.460) 4.654 13.556 ( 6.869 -2.260 0.416) 7.243 13.721 ( 4.026 2.921 9.218) 10.474 14.402 ( 0.246 3.463 -2.790) 4.454 14.542 ( -1.099 4.690 5.918) 7.631 15.686 ( -7.072 -10.629 2.485) 13.006 18.714 ( 0.510 6.903 -0.612) 6.949 19.393 ( -6.987 5.893 -2.084) 9.375 20.150 ( 2.066 10.995 8.772) 14.217 20.754 ( 19.917 3.940 -4.325) 20.758 21.586 ( -9.406 -22.135 -1.736) 24.114 23.747 ( 1.546 1.904 2.557) 3.544 ======================= Grid point 680 (339/433) ======================= q-point: (-0.17 -0.50 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 794 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.849 ( -5.219 14.221 -6.947) 16.665 3.717 ( -8.152 -0.500 0.799) 8.206 4.186 ( 3.746 -6.136 -1.339) 7.313 5.148 ( -2.533 0.102 0.222) 2.544 6.766 ( -6.147 -6.391 -1.148) 8.941 7.001 ( 4.499 5.440 -2.863) 7.617 7.297 ( 1.773 4.826 -6.223) 8.072 7.809 ( -1.469 -6.217 -6.259) 8.943 8.408 ( -1.330 -5.689 -4.789) 7.554 8.604 ( -3.391 -6.523 -8.178) 10.997 8.635 ( -4.978 -8.595 -7.973) 12.737 9.017 ( -13.060 -3.793 -1.221) 13.655 9.190 ( -7.081 -8.447 -3.452) 11.551 9.703 ( 1.925 1.561 0.086) 2.480 10.124 ( 4.349 9.693 6.842) 12.637 10.444 ( 4.078 2.562 -2.231) 5.308 10.644 ( -8.127 8.070 -14.039) 18.118 11.023 ( 6.346 -1.871 -5.107) 8.358 11.311 ( -0.752 0.971 3.095) 3.330 11.563 ( 0.470 2.862 0.051) 2.901 11.965 ( -1.592 -5.189 -8.336) 9.947 12.096 ( 5.024 -12.237 12.359) 18.103 12.326 ( -7.514 -1.846 -1.196) 7.830 13.111 ( 0.957 -0.943 3.369) 3.627 13.408 ( 2.160 1.629 -0.978) 2.876 13.708 ( 7.836 4.032 4.990) 10.127 13.864 ( 6.985 -6.215 1.978) 9.557 14.329 ( -4.215 1.954 1.382) 4.847 14.485 ( -0.600 9.427 4.609) 10.511 15.663 ( -7.397 -9.607 -4.428) 12.908 18.675 ( 3.173 9.048 1.591) 9.719 19.178 ( -7.156 7.036 -4.724) 11.092 20.199 ( 4.925 4.557 11.481) 13.298 21.011 ( 16.004 2.692 -0.285) 16.231 21.595 ( -11.171 -18.767 -5.022) 22.410 23.766 ( 1.969 3.214 2.347) 4.441 ======================= Grid point 681 (340/433) ======================= q-point: (-0.08 -0.50 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.620 ( -5.916 7.134 -4.126) 10.145 3.555 ( -11.903 -2.314 -1.510) 12.219 4.279 ( 1.316 -3.229 1.643) 3.854 5.139 ( 0.617 -0.885 0.796) 1.340 6.711 ( -4.678 -2.361 -1.714) 5.514 6.900 ( -3.544 6.099 -9.437) 11.782 7.334 ( 10.388 8.037 1.984) 13.283 7.856 ( 3.720 -7.562 -9.961) 13.048 8.397 ( -5.415 -11.335 -10.430) 16.328 8.491 ( -8.572 -0.217 -5.602) 10.242 8.604 ( -1.814 -7.743 -8.655) 11.754 8.877 ( -6.479 -4.324 -0.113) 7.790 9.179 ( -3.786 -10.185 -1.771) 11.009 9.628 ( -3.906 2.012 -7.248) 8.476 10.205 ( 6.632 9.791 1.727) 11.951 10.348 ( -4.928 4.666 -3.635) 7.698 10.511 ( 3.851 1.545 1.348) 4.363 11.091 ( 2.035 -2.847 -4.367) 5.596 11.260 ( -3.335 2.533 -0.103) 4.189 11.538 ( -0.043 3.868 0.523) 3.904 11.879 ( -4.711 -3.630 -10.726) 12.265 12.121 ( -7.475 -1.930 1.771) 7.921 12.519 ( 6.514 -14.658 13.805) 21.163 13.196 ( 2.821 -1.690 6.438) 7.229 13.418 ( 3.071 5.753 -0.827) 6.573 13.819 ( 6.178 6.368 8.033) 11.968 13.974 ( -0.046 -4.565 -3.549) 5.783 14.328 ( 1.545 -3.172 5.505) 6.539 14.420 ( 2.654 8.388 0.879) 8.842 15.563 ( -8.660 -5.457 -8.198) 13.115 18.636 ( 1.873 9.905 -0.483) 10.092 19.023 ( -1.638 5.289 0.475) 5.557 20.340 ( 5.075 -1.039 11.215) 12.354 21.203 ( 3.372 -1.743 6.899) 7.874 21.528 ( -5.073 -10.007 -13.180) 17.308 23.783 ( 2.715 3.516 1.479) 4.682 ======================= Grid point 689 (341/433) ======================= q-point: ( 0.58 -0.42 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 432 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.502 ( 3.963 -0.000 -3.718) 5.434 3.870 ( -6.820 0.000 -1.644) 7.015 3.910 ( 0.961 -0.000 2.368) 2.556 5.349 ( -6.785 0.000 2.724) 7.311 6.765 ( 6.760 -0.000 -6.857) 9.629 6.829 ( -7.488 0.000 11.526) 13.745 7.399 ( 1.652 -0.000 -7.487) 7.667 8.141 ( -13.858 0.000 -1.300) 13.919 8.420 ( 3.841 -0.000 -8.882) 9.677 8.631 ( -3.130 0.000 -8.658) 9.206 8.736 ( -5.924 0.000 -7.886) 9.863 9.184 ( -6.047 0.000 -3.467) 6.971 9.316 ( 12.326 -0.000 15.741) 19.993 9.449 ( -9.242 0.000 6.137) 11.094 10.440 ( 1.061 -0.000 0.988) 1.450 10.526 ( 1.945 -0.000 -2.441) 3.121 10.701 ( 3.537 -0.000 -1.872) 4.002 10.712 ( 5.147 -0.000 5.920) 7.845 11.014 ( 6.637 -0.000 -5.592) 8.679 11.541 ( 2.267 -0.000 3.118) 3.855 11.752 ( 0.679 -0.000 -6.222) 6.259 11.914 ( 6.323 -0.000 -3.403) 7.181 12.564 ( 5.987 -0.000 -9.200) 10.976 13.272 ( -9.720 0.000 -0.436) 9.729 13.505 ( -5.211 0.000 -0.319) 5.220 13.512 ( -10.531 0.000 -4.582) 11.484 13.721 ( 5.461 -0.000 5.649) 7.857 14.448 ( 4.800 -0.000 4.973) 6.912 14.468 ( 4.133 -0.000 -2.855) 5.023 15.623 ( -8.220 0.000 8.809) 12.048 18.833 ( -0.887 0.000 -4.399) 4.488 19.557 ( -3.810 0.000 4.998) 6.285 20.313 ( 2.602 -0.000 12.049) 12.327 20.624 ( 15.219 -0.000 -10.145) 18.291 21.285 ( -8.430 0.000 -5.442) 10.034 23.731 ( 1.099 -0.000 1.935) 2.225 ======================= Grid point 691 (342/433) ======================= q-point: (-0.33 0.58 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.454 ( -0.708 14.617 -4.650) 15.355 3.764 ( -5.490 -4.574 1.511) 7.304 3.929 ( -1.690 -6.189 -3.828) 7.471 5.243 ( -6.323 0.843 0.838) 6.433 6.699 ( -7.716 -3.315 2.719) 8.827 6.944 ( 11.464 0.436 -3.299) 11.937 7.402 ( 3.392 0.580 -6.379) 7.248 7.880 ( -14.261 -0.261 -3.951) 14.801 8.417 ( 0.323 -0.917 -9.471) 9.521 8.512 ( -3.683 -1.126 -7.731) 8.637 8.592 ( -7.373 -3.589 -7.145) 10.876 9.058 ( -7.963 -3.404 -4.767) 9.886 9.263 ( -11.380 -1.017 1.147) 11.483 9.635 ( 10.821 2.781 12.095) 16.465 10.394 ( -3.381 8.371 2.440) 9.352 10.466 ( -0.198 0.348 -2.124) 2.162 10.832 ( 10.003 -0.007 -5.214) 11.280 10.868 ( 4.588 -5.894 -1.217) 7.568 11.129 ( 7.907 -3.414 0.094) 8.613 11.608 ( 3.096 -0.111 2.124) 3.756 11.724 ( -0.122 0.741 0.919) 1.187 11.954 ( 0.159 -1.215 -6.027) 6.150 12.537 ( -4.200 1.723 -5.872) 7.422 13.124 ( -7.849 -1.098 0.876) 7.974 13.396 ( 2.006 -0.331 -5.669) 6.023 13.468 ( 0.617 -3.516 -0.478) 3.602 13.825 ( 3.834 4.051 8.406) 10.088 14.469 ( -0.214 3.249 -0.347) 3.274 14.565 ( 2.481 -1.452 5.259) 5.993 15.554 ( -5.974 -3.234 2.796) 7.346 18.808 ( 1.894 2.597 -2.236) 3.915 19.468 ( -7.111 1.949 -0.721) 7.408 20.347 ( -2.074 7.217 12.009) 14.163 20.837 ( 19.792 4.879 -9.367) 22.433 21.210 ( -8.031 -14.761 0.460) 16.811 23.773 ( 2.362 0.728 2.642) 3.618 ======================= Grid point 692 (343/433) ======================= q-point: (-0.25 -0.42 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.187 ( -5.827 19.967 -3.917) 21.165 3.708 ( -8.427 -1.012 1.055) 8.553 3.987 ( 0.970 -13.589 -3.884) 14.166 5.149 ( -4.109 0.012 -0.675) 4.164 6.651 ( -4.105 -4.690 1.337) 6.374 7.101 ( 11.446 4.041 -6.393) 13.719 7.389 ( 3.034 5.283 -6.541) 8.939 7.699 ( -5.600 -6.001 -5.137) 9.683 8.307 ( -6.085 -2.995 -11.948) 13.739 8.462 ( -3.891 -7.881 -9.184) 12.712 8.501 ( -4.270 -4.825 -2.666) 6.973 8.939 ( -8.204 -3.968 -2.083) 9.349 9.093 ( -10.547 -2.011 0.964) 10.780 9.743 ( 0.688 1.899 -1.414) 2.466 10.327 ( 3.759 10.741 8.583) 14.254 10.478 ( 3.273 1.379 -0.012) 3.552 10.785 ( -4.950 4.670 -14.085) 15.643 10.992 ( 7.807 -0.807 -5.520) 9.595 11.298 ( 3.231 -3.004 5.162) 6.790 11.622 ( 1.188 3.044 -0.499) 3.306 11.844 ( 5.372 -6.832 6.202) 10.677 11.904 ( -2.690 -5.480 -1.701) 6.337 12.341 ( -11.847 1.872 -3.711) 12.555 13.068 ( -2.062 -2.448 3.197) 4.524 13.440 ( 5.794 1.814 -2.275) 6.483 13.624 ( 9.922 -8.289 -3.276) 13.338 13.889 ( 3.427 4.433 9.301) 10.858 14.391 ( -5.282 3.977 2.705) 7.144 14.610 ( 0.470 3.438 5.017) 6.100 15.514 ( -3.719 -5.510 -4.856) 8.232 18.820 ( 4.646 5.618 0.321) 7.297 19.285 ( -8.637 3.829 -5.287) 10.827 20.315 ( -0.678 6.883 11.754) 13.638 21.035 ( 6.685 -0.570 4.066) 7.845 21.270 ( 1.314 -13.385 -7.569) 15.433 23.818 ( 2.606 1.970 2.222) 3.951 ======================= Grid point 693 (344/433) ======================= q-point: (-0.17 -0.42 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.873 ( -7.448 18.118 -1.495) 19.646 3.526 ( -13.459 -0.840 -0.960) 13.519 4.129 ( 0.624 -12.240 0.669) 12.274 5.116 ( 0.271 -1.265 -0.638) 1.442 6.660 ( 0.200 -2.638 -0.627) 2.719 7.044 ( -3.277 8.837 -10.425) 14.054 7.453 ( 13.556 3.148 -4.476) 14.618 7.729 ( 4.085 -4.960 -4.137) 7.642 8.169 ( -7.453 -10.081 -15.323) 19.799 8.424 ( -4.828 -8.185 -6.510) 11.519 8.471 ( -3.194 -4.630 -2.492) 6.152 8.827 ( -7.166 -1.058 1.269) 7.354 9.015 ( -3.960 -6.571 1.067) 7.746 9.657 ( -4.292 1.124 -7.038) 8.320 10.364 ( 2.167 5.156 0.991) 5.680 10.504 ( -7.210 9.799 -7.902) 14.507 10.551 ( 6.768 4.430 4.276) 9.150 11.050 ( 1.679 -1.027 -5.210) 5.570 11.322 ( -2.364 2.751 2.554) 4.436 11.614 ( 1.819 3.985 0.139) 4.383 11.813 ( -3.650 -3.368 -9.030) 10.306 12.087 ( -6.576 -2.101 3.106) 7.570 12.233 ( 4.477 -13.363 11.999) 18.509 13.135 ( 2.435 -3.804 5.855) 7.395 13.503 ( 5.712 3.270 -2.796) 7.151 13.812 ( 6.041 -7.078 -4.394) 10.291 13.980 ( 3.599 4.648 8.958) 10.714 14.302 ( -1.925 1.647 5.283) 5.859 14.583 ( -0.238 7.031 2.841) 7.587 15.459 ( -4.167 -5.051 -9.326) 11.395 18.822 ( 2.460 9.065 -1.673) 9.541 19.104 ( -3.719 2.785 -2.763) 5.406 20.347 ( 0.340 1.669 12.372) 12.489 21.073 ( -13.685 -10.328 11.217) 20.488 21.424 ( 15.496 -1.567 -13.944) 20.905 23.846 ( 2.568 2.874 0.905) 3.959 ======================= Grid point 694 (345/433) ======================= q-point: (-0.08 -0.42 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.583 ( -9.318 13.308 1.785) 16.343 3.302 ( -14.764 -2.767 1.612) 15.107 4.218 ( -3.736 -8.577 3.618) 10.030 5.172 ( 4.455 -1.232 0.416) 4.641 6.664 ( -1.167 2.844 -3.147) 4.400 6.835 ( -2.031 5.382 -10.255) 11.759 7.623 ( 10.934 5.145 1.861) 12.226 7.838 ( 7.669 -3.418 -7.767) 11.438 8.087 ( -3.625 -11.364 -15.512) 19.568 8.345 ( -5.342 -1.150 -2.043) 5.834 8.489 ( 1.312 -6.530 -4.914) 8.277 8.780 ( -1.348 -3.283 0.606) 3.601 9.078 ( 1.460 -7.154 2.367) 7.675 9.527 ( -4.781 1.148 -6.590) 8.222 10.140 ( -10.205 4.494 -9.594) 14.710 10.479 ( 4.124 2.732 3.048) 5.810 10.641 ( 5.221 6.292 6.926) 10.715 11.002 ( -6.008 -2.594 -3.926) 7.631 11.236 ( -3.470 4.178 0.231) 5.436 11.593 ( 0.189 5.502 0.958) 5.588 11.738 ( -0.538 -2.873 -9.790) 10.217 12.024 ( -3.377 -1.592 5.053) 6.283 12.558 ( 5.043 -14.264 12.879) 19.869 13.250 ( 2.231 -2.301 5.766) 6.597 13.517 ( 2.924 5.095 -3.012) 6.602 13.885 ( -5.321 1.066 1.519) 5.636 14.020 ( 8.877 -0.899 1.675) 9.078 14.390 ( 3.915 -0.176 6.252) 7.378 14.522 ( 1.929 5.347 -2.176) 6.087 15.363 ( -5.097 -2.667 -8.128) 9.958 18.695 ( -3.174 7.988 -4.792) 9.841 19.098 ( 4.459 2.802 1.602) 5.504 20.423 ( -1.127 -2.781 11.279) 11.671 20.940 ( -20.531 -10.205 7.878) 24.243 21.621 ( 17.341 2.183 -10.625) 20.454 23.863 ( 2.787 2.680 -0.679) 3.926 ======================= Grid point 703 (346/433) ======================= q-point: (-0.33 -0.33 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 433 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.547 ( -11.569 0.000 1.220) 11.633 3.583 ( 1.120 -0.000 1.031) 1.522 3.806 ( -3.806 0.000 -8.581) 9.387 5.149 ( -4.758 0.000 -0.983) 4.858 6.604 ( -2.986 0.000 1.763) 3.467 7.140 ( 15.301 -0.000 -7.624) 17.095 7.479 ( 8.963 -0.000 -4.159) 9.881 7.601 ( -14.109 0.000 -7.535) 15.994 8.313 ( -4.390 0.000 -16.356) 16.935 8.347 ( -8.343 0.000 -6.238) 10.417 8.453 ( -3.554 0.000 -1.378) 3.812 8.896 ( -6.543 0.000 -2.169) 6.893 9.078 ( -11.350 0.000 2.248) 11.570 9.762 ( -0.401 0.000 -2.392) 2.426 10.443 ( -0.243 0.000 -1.880) 1.896 10.512 ( 5.624 -0.000 12.421) 13.635 10.808 ( -2.139 0.000 -11.210) 11.413 10.994 ( 9.471 -0.000 -5.845) 11.129 11.244 ( 5.744 -0.000 4.467) 7.276 11.657 ( 2.458 -0.000 -0.625) 2.536 11.786 ( 4.276 -0.000 9.925) 10.807 11.846 ( -5.948 0.000 -7.939) 9.920 12.364 ( -13.048 0.000 -3.487) 13.506 13.042 ( -2.322 0.000 2.836) 3.665 13.482 ( 4.178 -0.000 0.191) 4.182 13.509 ( 12.243 -0.000 -5.106) 13.265 13.936 ( 2.346 -0.000 7.674) 8.025 14.441 ( -5.755 0.000 4.056) 7.040 14.635 ( 2.098 -0.000 5.007) 5.429 15.460 ( -2.807 0.000 -5.238) 5.943 18.876 ( 5.412 -0.000 -0.243) 5.418 19.322 ( -9.237 0.000 -5.143) 10.572 20.403 ( -3.860 0.000 11.683) 12.304 20.999 ( -10.894 0.000 9.182) 14.247 21.149 ( 21.092 -0.000 -12.083) 24.308 23.837 ( 2.851 -0.000 2.184) 3.591 ======================= Grid point 704 (347/433) ======================= q-point: (-0.25 -0.33 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.251 ( -9.964 18.142 2.505) 20.849 3.514 ( -13.894 -0.943 0.533) 13.936 3.844 ( 2.325 -14.698 -3.270) 15.236 5.098 ( -0.081 -0.483 -1.505) 1.582 6.621 ( 3.442 -1.145 0.042) 3.628 7.232 ( -3.125 10.237 -11.071) 15.399 7.413 ( 7.104 -6.958 -11.173) 14.957 7.673 ( 13.327 -1.393 -1.347) 13.467 8.087 ( -8.049 2.237 -13.603) 15.963 8.234 ( -7.184 -9.668 -5.423) 13.210 8.414 ( -1.769 -1.588 -1.078) 2.610 8.820 ( -3.486 -0.060 1.976) 4.007 8.932 ( -7.802 -2.133 2.337) 8.419 9.672 ( -4.678 0.453 -7.054) 8.476 10.392 ( -4.610 -0.354 -5.355) 7.075 10.655 ( -2.747 4.375 -12.427) 13.458 10.679 ( 6.102 5.875 13.067) 15.572 11.055 ( 1.828 1.234 -3.799) 4.393 11.332 ( -0.144 -1.323 4.341) 4.540 11.686 ( 2.713 3.395 -1.586) 4.626 11.749 ( -0.855 -3.278 -5.641) 6.580 11.986 ( 7.283 -5.350 12.853) 15.712 12.115 ( -13.507 -0.821 -0.117) 13.532 13.077 ( 2.359 -1.753 4.844) 5.666 13.557 ( 6.253 2.569 -1.537) 6.933 13.676 ( 6.314 -5.568 -5.816) 10.232 14.041 ( 5.540 1.462 9.277) 10.904 14.360 ( -4.508 2.651 5.410) 7.525 14.672 ( -0.070 2.182 4.346) 4.863 15.385 ( -2.015 -2.237 -11.138) 11.538 18.963 ( 5.870 4.731 -0.559) 7.560 19.125 ( -7.951 -0.218 -6.530) 10.291 20.390 ( -3.863 2.072 11.843) 12.628 20.896 ( -13.860 -6.019 12.368) 19.527 21.415 ( 19.284 0.007 -11.676) 22.544 23.886 ( 2.523 1.106 0.606) 2.820 ======================= Grid point 705 (348/433) ======================= q-point: (-0.17 -0.33 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 794 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.918 ( -10.951 19.299 4.633) 22.668 3.268 ( -16.332 -0.957 2.892) 16.614 3.986 ( -3.449 -14.518 2.812) 15.185 5.149 ( 5.782 -0.936 -0.527) 5.881 6.713 ( 6.396 1.910 -2.069) 6.988 6.943 ( -8.466 5.468 -13.069) 16.503 7.591 ( 10.265 -6.103 -10.969) 16.215 7.877 ( 7.164 6.472 5.349) 11.038 7.902 ( -0.581 -6.944 -16.333) 17.757 8.232 ( -2.666 -9.702 -0.701) 10.086 8.428 ( 5.055 -0.616 -2.802) 5.813 8.764 ( -2.719 1.682 2.521) 4.071 8.946 ( 1.549 -6.407 4.079) 7.751 9.547 ( -4.555 0.919 -6.337) 7.858 10.190 ( -12.141 0.264 -11.227) 16.539 10.552 ( 1.851 5.416 -2.450) 6.226 10.758 ( 1.343 3.147 5.794) 6.729 11.003 ( -3.671 3.649 1.627) 5.426 11.313 ( -3.511 2.518 2.357) 4.922 11.684 ( -3.824 -1.297 -9.335) 10.171 11.715 ( 4.541 5.853 0.704) 7.442 11.984 ( -2.893 -2.756 5.401) 6.718 12.292 ( 6.766 -12.020 12.774) 18.800 13.193 ( 3.879 -3.022 6.305) 7.996 13.587 ( 2.766 2.924 -4.390) 5.956 13.780 ( 3.070 -7.351 -3.243) 8.601 14.109 ( -0.880 5.371 5.981) 8.086 14.395 ( 7.887 0.988 5.079) 9.433 14.637 ( -2.088 5.186 1.628) 5.823 15.302 ( -2.807 -3.264 -10.769) 11.597 18.843 ( -5.779 6.845 -7.324) 11.572 19.121 ( 5.189 -0.348 -1.247) 5.349 20.390 ( -4.427 -0.671 12.447) 13.228 20.770 ( -18.007 -6.891 11.699) 22.552 21.653 ( 18.216 1.124 -10.094) 20.856 23.908 ( 2.162 1.748 -1.412) 3.118 ======================= Grid point 706 (349/433) ======================= q-point: (-0.08 -0.33 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.569 ( -13.993 17.062 6.166) 22.911 3.069 ( -13.647 -2.526 11.088) 17.764 4.029 ( -10.031 -13.004 5.629) 17.361 5.264 ( 6.391 0.251 -0.213) 6.399 6.578 ( -9.790 4.472 -6.492) 12.569 6.902 ( 10.281 2.990 -7.407) 13.019 7.673 ( 1.683 -5.234 -8.992) 10.540 7.894 ( 4.418 -6.146 -10.524) 12.964 8.014 ( 6.757 1.848 4.127) 8.131 8.272 ( 0.177 -3.774 2.575) 4.572 8.576 ( 14.386 2.794 -4.299) 15.272 8.777 ( 3.866 -1.357 0.383) 4.115 9.118 ( 8.498 -5.151 5.063) 11.152 9.427 ( -4.639 1.906 -3.682) 6.222 9.932 ( -10.799 0.100 -6.270) 12.488 10.535 ( -0.254 1.233 -0.378) 1.315 10.733 ( -4.518 -1.240 -1.605) 4.952 10.904 ( -4.148 8.157 6.796) 11.399 11.227 ( -2.408 3.934 0.264) 4.620 11.558 ( -5.924 -1.302 -2.804) 6.682 11.765 ( 5.987 4.206 -1.682) 7.508 12.055 ( 3.854 -0.605 6.122) 7.259 12.566 ( 3.154 -12.231 9.934) 16.070 13.299 ( 2.280 -1.098 3.562) 4.369 13.573 ( 1.956 2.767 -3.700) 5.017 13.836 ( -2.956 0.569 2.370) 3.831 14.103 ( 4.547 -4.003 -3.552) 7.022 14.499 ( -3.504 8.103 4.492) 9.906 14.572 ( 5.852 -0.379 -5.938) 8.346 15.263 ( 0.902 -2.032 -0.900) 2.399 18.655 ( -4.353 5.087 -6.010) 8.997 19.193 ( 4.675 0.267 -3.588) 5.899 20.385 ( -7.593 -3.458 10.431) 13.357 20.570 ( -20.935 -5.801 9.727) 23.802 21.886 ( 18.221 2.371 -6.789) 19.589 23.912 ( 2.068 1.462 -3.048) 3.962 ======================= Grid point 716 (350/433) ======================= q-point: (-0.25 -0.25 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 432 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.169 ( -14.101 0.000 7.147) 15.809 3.260 ( -16.851 0.000 3.336) 17.178 3.785 ( -0.705 0.000 1.049) 1.264 5.140 ( 6.388 -0.000 -0.939) 6.456 6.731 ( 10.113 -0.000 -1.477) 10.220 7.008 ( -14.337 0.000 -14.643) 20.493 7.513 ( 12.976 -0.000 -11.503) 17.341 7.832 ( 2.278 -0.000 -15.255) 15.424 8.029 ( -6.548 0.000 2.991) 7.199 8.046 ( 8.892 -0.000 2.459) 9.225 8.424 ( 7.162 -0.000 -2.565) 7.607 8.818 ( -5.152 0.000 2.429) 5.695 8.849 ( 3.311 -0.000 5.380) 6.317 9.557 ( -4.213 0.000 -6.028) 7.355 10.183 ( -11.651 0.000 -11.406) 16.305 10.632 ( 2.898 -0.000 -6.384) 7.011 10.758 ( -6.526 0.000 2.845) 7.120 11.077 ( -0.522 0.000 7.899) 7.916 11.323 ( -2.645 0.000 3.274) 4.209 11.665 ( -1.714 0.000 -9.740) 9.890 11.809 ( 5.739 -0.000 0.593) 5.770 11.932 ( -5.528 0.000 5.995) 8.155 12.163 ( 7.409 -0.000 12.202) 14.275 13.159 ( 4.197 -0.000 6.381) 7.637 13.642 ( 0.072 -0.000 -7.446) 7.446 13.675 ( 5.722 -0.000 -0.448) 5.739 14.163 ( -0.405 0.000 6.379) 6.392 14.410 ( 7.271 -0.000 4.228) 8.411 14.691 ( -2.147 0.000 3.944) 4.490 15.264 ( -2.168 0.000 -12.817) 12.999 18.921 ( -8.525 0.000 -8.601) 12.110 19.107 ( 7.197 -0.000 -2.159) 7.514 20.387 ( -6.017 0.000 12.605) 13.968 20.699 ( -16.555 0.000 13.629) 21.444 21.664 ( 18.479 -0.000 -9.927) 20.977 23.925 ( 1.943 -0.000 -1.667) 2.560 ======================= Grid point 717 (351/433) ======================= q-point: (-0.17 -0.25 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.897 ( -15.983 13.643 8.155) 22.541 3.034 ( -15.091 -1.616 11.521) 19.055 3.774 ( -10.479 -10.592 6.141) 16.115 5.270 ( 8.319 0.314 -0.558) 8.344 6.663 ( -13.421 3.390 -10.452) 17.345 6.911 ( 10.924 -1.107 -5.578) 12.315 7.591 ( 3.200 -2.530 -13.788) 14.379 7.809 ( 6.754 -1.789 -7.981) 10.607 8.015 ( 3.428 -1.378 4.593) 5.894 8.221 ( 4.691 -1.245 6.025) 7.737 8.632 ( 16.747 2.259 -3.111) 17.182 8.777 ( 0.546 0.474 2.112) 2.233 9.032 ( 12.705 -2.968 6.028) 14.373 9.466 ( -2.872 1.459 -2.858) 4.307 9.927 ( -10.847 -0.467 -8.950) 14.070 10.574 ( -7.658 2.516 -0.652) 8.087 10.676 ( -1.437 -3.334 -3.848) 5.290 11.079 ( -1.972 7.118 9.974) 12.411 11.287 ( -2.907 1.304 1.717) 3.619 11.520 ( -8.483 -1.705 -5.247) 10.119 11.870 ( 5.669 5.681 0.813) 8.067 12.022 ( 5.438 -2.941 5.981) 8.602 12.370 ( 5.176 -6.426 9.923) 12.906 13.273 ( 3.574 -1.131 5.685) 6.810 13.601 ( 1.446 0.728 -5.283) 5.526 13.768 ( 3.279 -3.736 -1.476) 5.185 14.123 ( -3.634 2.272 0.619) 4.330 14.565 ( 6.735 -0.043 -4.192) 7.933 14.634 ( -4.831 4.368 2.573) 7.003 15.214 ( 3.258 -2.092 -1.914) 4.319 18.734 ( -5.789 2.459 -8.394) 10.489 19.187 ( 4.795 -0.456 -5.901) 7.617 20.344 ( -9.084 -0.892 12.118) 15.171 20.487 ( -20.079 -2.445 12.372) 23.711 21.917 ( 18.842 0.826 -6.649) 19.998 23.934 ( 1.545 0.615 -3.672) 4.030 ======================= Grid point 718 (352/433) ======================= q-point: (-0.08 -0.25 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.499 ( -19.715 17.368 10.119) 28.155 2.947 ( -10.017 -3.948 20.181) 22.873 3.710 ( -16.747 -14.507 8.968) 23.903 5.341 ( 1.487 1.463 -3.046) 3.692 6.425 ( -7.098 0.955 -0.245) 7.166 7.001 ( 3.983 -1.798 -12.992) 13.707 7.631 ( 7.693 -2.679 -7.362) 10.980 7.900 ( 5.400 0.320 0.541) 5.436 8.211 ( 12.736 -3.472 -0.179) 13.202 8.329 ( 6.247 3.053 5.396) 8.801 8.774 ( 5.498 0.718 5.170) 7.581 8.908 ( 12.029 -1.022 -3.930) 12.696 9.317 ( 6.840 0.961 0.305) 6.914 9.429 ( 8.791 2.840 3.882) 10.021 9.755 ( -5.514 1.753 -1.194) 5.908 10.430 ( -8.539 -5.077 -1.720) 10.082 10.641 ( -2.480 1.284 -3.682) 4.622 11.011 ( -1.586 11.493 9.067) 14.725 11.230 ( -1.165 2.373 -0.962) 2.813 11.416 ( -5.654 -4.687 0.720) 7.379 11.902 ( 4.278 5.752 0.506) 7.186 12.176 ( 6.310 -1.394 4.677) 7.977 12.554 ( 1.841 -8.754 6.255) 10.916 13.348 ( 2.815 0.093 0.260) 2.829 13.598 ( 0.334 2.097 -1.452) 2.573 13.815 ( -1.677 -0.333 1.362) 2.186 14.072 ( 1.661 -4.516 -8.504) 9.771 14.434 ( -8.539 4.780 -9.267) 13.477 14.576 ( -3.597 -0.694 -3.344) 4.959 15.438 ( 17.021 0.903 14.467) 22.357 18.596 ( -2.046 2.499 -6.828) 7.554 19.201 ( 1.242 -0.853 -8.620) 8.750 20.225 ( -17.838 -3.746 6.973) 19.516 20.242 ( -17.779 -2.983 11.524) 21.396 22.192 ( 19.087 2.473 -2.499) 19.408 23.926 ( 1.345 0.545 -4.679) 4.899 ======================= Grid point 729 (353/433) ======================= q-point: (-0.17 -0.17 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 433 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.773 ( -17.260 0.000 12.844) 21.514 2.837 ( -15.667 0.000 16.701) 22.899 3.539 ( -16.566 0.000 11.464) 20.146 5.359 ( 1.689 -0.000 -3.342) 3.744 6.437 ( -8.401 0.000 -1.762) 8.584 6.968 ( 1.154 -0.000 -12.862) 12.914 7.604 ( 10.006 -0.000 -5.617) 11.475 7.939 ( 10.193 -0.000 -2.323) 10.455 8.113 ( 7.506 -0.000 2.658) 7.962 8.395 ( 12.589 -0.000 4.114) 13.244 8.797 ( 1.207 -0.000 4.197) 4.368 8.874 ( 11.106 -0.000 1.374) 11.191 9.337 ( 15.677 -0.000 -1.009) 15.710 9.444 ( -1.165 0.000 2.758) 2.994 9.794 ( 3.979 -0.000 -1.253) 4.171 10.363 ( -12.947 0.000 -2.331) 13.155 10.656 ( -0.628 0.000 -3.192) 3.253 11.154 ( 0.246 -0.000 9.156) 9.160 11.282 ( 0.731 -0.000 0.785) 1.073 11.324 ( -10.855 0.000 -0.831) 10.887 11.984 ( 3.830 -0.000 0.754) 3.903 12.139 ( 5.679 -0.000 4.370) 7.166 12.460 ( 2.991 -0.000 6.919) 7.538 13.348 ( 3.264 -0.000 1.525) 3.602 13.620 ( 2.372 -0.000 -0.530) 2.431 13.774 ( 0.838 -0.000 -2.852) 2.972 14.058 ( -3.426 0.000 -4.862) 5.948 14.484 ( -6.493 0.000 -17.278) 18.458 14.571 ( -7.418 0.000 2.160) 7.726 15.444 ( 19.567 -0.000 15.749) 25.117 18.622 ( -2.399 0.000 -8.541) 8.872 19.193 ( 1.755 -0.000 -9.388) 9.551 20.187 ( -23.172 0.000 10.820) 25.573 20.213 ( -14.261 0.000 9.454) 17.110 22.216 ( 19.634 -0.000 -2.188) 19.755 23.932 ( 1.176 -0.000 -4.984) 5.121 ======================= Grid point 730 (354/433) ======================= q-point: (-0.08 -0.17 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.407 ( -21.161 19.286 15.646) 32.627 2.789 ( -16.145 -16.225 19.879) 30.317 3.405 ( -12.769 -5.873 16.916) 21.993 5.275 ( -6.753 0.368 -6.060) 9.081 6.410 ( 1.712 -0.261 10.405) 10.548 6.845 ( -5.456 -3.825 -16.528) 17.821 7.797 ( 13.008 1.643 -2.042) 13.269 8.059 ( 7.833 5.782 2.930) 10.167 8.292 ( 6.564 -10.538 -0.722) 12.436 8.631 ( 16.682 10.159 2.316) 19.669 8.892 ( 6.048 -3.148 6.016) 9.093 9.066 ( 9.913 -1.237 2.584) 10.319 9.347 ( -3.425 5.412 1.277) 6.531 9.487 ( -3.694 -6.663 4.573) 8.885 9.991 ( 14.037 14.552 -0.674) 20.231 10.255 ( 3.438 -10.784 -4.052) 12.022 10.592 ( -2.812 3.003 -1.545) 4.395 11.131 ( -8.589 4.059 7.586) 12.157 11.227 ( 6.219 4.000 1.250) 7.499 11.357 ( 3.262 -3.870 1.865) 5.394 12.012 ( 2.105 4.718 1.209) 5.305 12.245 ( 2.345 -4.090 1.418) 4.923 12.541 ( 0.437 -4.106 3.535) 5.436 13.393 ( 2.647 0.918 -3.178) 4.236 13.603 ( -4.713 5.084 1.418) 7.076 13.767 ( -2.350 -3.721 -1.756) 4.738 13.988 ( 1.170 -3.424 -12.764) 13.267 14.226 ( -9.504 1.230 -14.125) 17.069 14.443 ( -9.230 -0.896 0.604) 9.293 15.978 ( 30.913 3.065 22.645) 38.442 18.566 ( 2.117 0.581 -7.660) 7.968 19.128 ( -2.759 0.432 -9.803) 10.193 19.863 ( -24.196 -4.289 8.121) 25.880 19.990 ( -18.335 -1.564 5.606) 19.236 22.524 ( 18.230 1.934 0.982) 18.359 23.917 ( 0.807 0.161 -4.902) 4.971 ======================= Grid point 742 (355/433) ======================= q-point: (-0.08 -0.08 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 432 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.356 ( -17.000 0.000 16.170) 23.462 2.378 ( -23.977 0.000 21.201) 32.005 3.403 ( -1.367 0.000 22.656) 22.697 5.100 ( -8.902 0.000 -5.243) 10.331 6.589 ( 8.749 -0.000 18.562) 20.520 6.622 ( -6.476 0.000 -15.777) 17.054 7.989 ( 9.093 -0.000 -2.554) 9.445 8.217 ( -3.105 0.000 -2.780) 4.168 8.312 ( 12.061 -0.000 7.090) 13.990 8.917 ( -6.124 0.000 8.116) 10.167 9.047 ( 20.007 -0.000 0.597) 20.016 9.229 ( 5.133 -0.000 6.219) 8.064 9.363 ( 4.224 -0.000 0.857) 4.310 9.395 ( -3.817 0.000 7.338) 8.272 10.090 ( 3.466 -0.000 -12.488) 12.960 10.315 ( 0.354 -0.000 -6.120) 6.130 10.750 ( 19.388 -0.000 4.968) 20.014 11.013 ( -7.694 0.000 6.607) 10.142 11.413 ( 5.893 -0.000 -1.372) 6.051 11.481 ( 13.881 -0.000 7.302) 15.685 12.067 ( 0.180 -0.000 2.099) 2.107 12.208 ( -3.006 0.000 -2.109) 3.672 12.524 ( -1.650 0.000 1.018) 1.939 13.368 ( -6.300 0.000 -5.983) 8.688 13.517 ( -8.163 0.000 -1.545) 8.308 13.641 ( -5.821 0.000 -5.902) 8.289 13.927 ( 3.524 -0.000 -12.043) 12.548 14.058 ( -2.770 0.000 -8.216) 8.670 14.281 ( -10.134 0.000 1.545) 10.251 16.741 ( 40.673 -0.000 22.150) 46.313 18.592 ( 6.393 -0.000 -7.991) 10.234 18.995 ( -8.089 0.000 -7.415) 10.973 19.464 ( -25.441 0.000 7.411) 26.498 19.691 ( -18.572 0.000 2.250) 18.708 22.821 ( 14.569 -0.000 2.173) 14.730 23.899 ( 0.032 -0.000 -3.680) 3.681 ======================= Grid point 743 (356/433) ======================= q-point: ( 0.00 0.00 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 433 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.402 ( -1.109 0.000 5.937) 6.039 2.454 ( 2.249 -0.000 4.703) 5.213 4.014 ( 1.895 -0.000 7.208) 7.453 4.832 ( -0.067 0.000 -1.634) 1.636 6.152 ( -0.714 0.000 -4.071) 4.133 7.510 ( 5.351 -0.000 6.189) 8.181 8.051 ( -0.992 0.000 1.127) 1.502 8.059 ( 0.232 -0.000 -1.083) 1.108 8.813 ( -9.989 0.000 15.254) 18.233 8.927 ( 5.257 -0.000 3.617) 6.381 9.116 ( -12.559 0.000 8.048) 14.916 9.552 ( 7.292 -0.000 -13.867) 15.668 9.559 ( 11.109 -0.000 -10.693) 15.419 9.776 ( -1.306 0.000 0.618) 1.444 9.828 ( 4.167 -0.000 2.741) 4.987 10.014 ( 0.805 -0.000 -4.790) 4.857 11.147 ( 2.017 -0.000 2.451) 3.174 11.265 ( 0.061 -0.000 -0.482) 0.486 11.631 ( 2.449 -0.000 1.620) 2.936 11.868 ( -2.868 0.000 -3.702) 4.682 12.104 ( 0.850 -0.000 3.301) 3.409 12.187 ( 0.926 -0.000 2.294) 2.474 12.413 ( -1.220 0.000 0.412) 1.287 12.796 ( 0.085 -0.000 -3.020) 3.021 13.200 ( -4.300 0.000 -2.851) 5.159 13.309 ( -0.717 0.000 -1.746) 1.887 13.860 ( -1.918 0.000 -0.368) 1.953 13.896 ( 2.267 -0.000 -3.481) 4.154 14.100 ( -1.066 0.000 1.031) 1.483 18.085 ( 0.671 -0.000 1.721) 1.848 18.544 ( -5.023 0.000 -0.274) 5.030 18.722 ( 3.539 -0.000 1.066) 3.696 19.101 ( 3.357 -0.000 0.428) 3.384 19.226 ( -2.479 0.000 -0.697) 2.575 23.161 ( 1.506 -0.000 0.431) 1.566 23.824 ( -1.218 0.000 -0.212) 1.236 ======================= Grid point 744 (357/433) ======================= q-point: ( 0.08 0.00 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.480 ( 4.837 0.149 1.028) 4.948 2.677 ( 17.631 -10.198 0.959) 20.391 4.026 ( -1.973 1.036 -0.456) 2.275 4.887 ( 5.972 -1.527 -0.536) 6.188 6.176 ( 2.609 -4.303 -0.392) 5.048 7.483 ( -7.303 0.567 -6.279) 9.648 7.904 ( 0.761 15.815 0.660) 15.847 8.223 ( 1.288 -14.181 1.111) 14.283 8.827 ( -6.329 8.037 15.550) 18.614 8.897 ( -7.730 0.148 9.170) 11.994 8.972 ( -6.027 -6.231 2.485) 9.018 9.461 ( -0.869 5.289 -15.012) 15.940 9.631 ( 9.698 5.183 -11.543) 15.943 9.782 ( -1.605 2.981 0.132) 3.388 9.945 ( 2.217 -11.316 -3.420) 12.027 10.048 ( 7.381 -1.736 -6.120) 9.744 11.109 ( -10.837 8.343 -1.742) 13.787 11.206 ( 1.037 -2.083 -0.737) 2.441 11.596 ( -3.636 2.609 -2.951) 5.360 11.789 ( -9.242 3.048 0.758) 9.761 12.014 ( 1.292 3.160 0.986) 3.554 12.219 ( -0.327 -1.731 -0.986) 2.019 12.459 ( 0.463 -4.273 2.474) 4.959 12.938 ( 14.727 3.303 0.718) 15.110 13.067 ( 1.474 11.924 3.024) 12.390 13.433 ( 0.078 -17.906 2.533) 18.085 13.810 ( -4.421 -0.841 1.442) 4.725 13.908 ( 1.111 0.307 -3.603) 3.783 14.135 ( 4.183 0.093 2.098) 4.680 17.755 ( -23.313 14.225 -0.680) 27.318 18.431 ( -13.409 -5.912 5.376) 15.609 18.841 ( 3.147 -4.558 -3.407) 6.502 19.304 ( 17.651 0.113 -0.353) 17.655 19.390 ( 18.829 -5.795 0.017) 19.700 23.115 ( -4.326 3.722 -2.346) 6.171 23.786 ( -3.515 0.465 1.851) 4.000 ======================= Grid point 745 (358/433) ======================= q-point: ( 0.17 0.00 -0.55) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 794 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.554 ( 8.957 5.911 -5.024) 11.849 3.165 ( 21.907 -17.731 0.080) 28.184 3.945 ( -3.426 1.110 -6.530) 7.457 5.017 ( 6.983 -1.523 0.287) 7.153 6.308 ( 5.211 -7.403 2.741) 9.459 7.260 ( -10.560 0.117 -11.975) 15.966 7.753 ( -4.882 11.587 1.505) 12.663 8.340 ( -2.191 -7.047 2.810) 7.897 8.545 ( -13.489 8.535 0.677) 15.977 8.868 ( -9.309 -8.022 -6.203) 13.766 9.037 ( 0.094 3.294 19.685) 19.959 9.328 ( 3.515 7.825 -11.599) 14.426 9.653 ( 3.280 6.290 -10.336) 12.536 9.678 ( 0.306 -0.814 -8.037) 8.083 10.009 ( -3.094 -8.773 -4.402) 10.291 10.206 ( 9.388 -4.079 -4.155) 11.048 10.733 ( -18.179 11.643 -2.811) 21.771 11.241 ( -0.591 -4.174 -1.908) 4.628 11.409 ( -8.871 9.731 -3.811) 13.708 11.614 ( -2.855 3.892 -2.317) 5.354 12.093 ( 3.176 0.675 -1.248) 3.479 12.239 ( 2.880 -5.504 0.081) 6.212 12.514 ( 0.976 -0.564 3.748) 3.914 13.003 ( 5.144 13.356 10.975) 18.036 13.206 ( 10.262 -3.395 0.539) 10.823 13.628 ( 0.450 -12.820 4.885) 13.726 13.775 ( -1.763 -2.664 4.347) 5.394 13.890 ( 0.855 0.594 -4.070) 4.201 14.248 ( 6.635 -0.495 2.890) 7.254 17.156 ( -28.469 14.736 -5.728) 32.565 18.330 ( -9.184 -5.747 7.046) 12.924 18.874 ( -1.370 -4.448 -0.817) 4.725 19.629 ( 20.228 0.056 1.912) 20.319 19.838 ( 25.218 -8.600 -2.894) 26.801 22.917 ( -10.618 7.184 -4.652) 13.638 23.733 ( -3.998 0.200 3.709) 5.458 ======================= Grid point 746 (359/433) ======================= q-point: ( 0.25 0.00 -0.55) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.595 ( 9.688 9.595 -8.486) 16.061 3.676 ( 18.270 -17.047 -1.189) 25.016 3.824 ( -4.078 1.074 -8.777) 9.737 5.128 ( 4.171 -0.574 1.401) 4.437 6.498 ( 5.762 -7.292 3.959) 10.102 7.027 ( -8.883 -2.293 -13.551) 16.364 7.526 ( -13.098 8.036 5.694) 16.388 8.241 ( -9.487 9.766 -0.887) 13.644 8.355 ( -2.303 -3.279 -4.566) 6.075 8.728 ( -11.742 -7.064 -6.321) 15.091 9.034 ( -1.611 4.677 -0.422) 4.965 9.236 ( -0.997 9.415 -6.273) 11.357 9.526 ( -3.174 0.133 -6.304) 7.059 9.783 ( 10.650 -0.103 -3.516) 11.216 9.902 ( -12.372 0.623 -8.657) 15.113 10.335 ( 4.486 4.370 4.524) 7.726 10.386 ( -9.335 -3.693 -6.674) 12.055 11.154 ( -3.961 8.597 -2.156) 9.708 11.262 ( -0.931 -1.199 -3.190) 3.532 11.550 ( -1.080 1.973 -2.055) 3.046 12.050 ( -0.426 3.843 -6.432) 7.504 12.384 ( 3.924 -2.100 -1.683) 4.759 12.566 ( 2.752 -2.558 5.817) 6.925 13.055 ( 4.955 7.897 11.729) 14.983 13.369 ( 0.747 -6.954 6.812) 9.763 13.681 ( 0.253 2.863 4.592) 5.418 13.871 ( 7.785 2.020 -7.109) 10.734 13.946 ( 0.285 -12.807 8.062) 15.136 14.377 ( 6.094 0.603 3.614) 7.110 16.498 ( -27.954 12.701 -10.164) 32.343 18.326 ( -3.681 -6.473 7.029) 10.240 18.893 ( -1.526 -4.212 2.031) 4.918 19.976 ( 19.056 -0.097 3.665) 19.405 20.314 ( 24.619 -8.058 -4.832) 26.351 22.576 ( -16.569 9.716 -5.624) 20.014 23.706 ( -2.546 -0.776 4.950) 5.621 ======================= Grid point 747 (360/433) ======================= q-point: ( 0.33 0.00 -0.55) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 794 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.585 ( 6.960 10.601 -8.537) 15.287 3.670 ( -5.088 1.099 -11.843) 12.936 4.069 ( 11.199 -11.883 1.517) 16.399 5.180 ( 0.711 0.446 2.697) 2.824 6.641 ( 2.457 -3.264 -0.329) 4.098 6.851 ( -6.873 -2.638 -10.864) 13.124 7.303 ( -10.806 1.508 11.135) 15.589 7.987 ( -7.965 6.707 -6.869) 12.474 8.366 ( 2.539 -3.542 -5.837) 7.284 8.559 ( -8.864 -1.980 -3.799) 9.845 8.857 ( -8.568 10.315 -9.782) 16.598 9.064 ( -4.927 4.982 -7.831) 10.508 9.476 ( -1.928 -4.061 -4.751) 6.541 9.557 ( -13.178 8.232 -6.845) 16.979 9.911 ( 5.103 -2.140 -3.338) 6.463 10.372 ( 1.854 -5.697 2.252) 6.400 10.393 ( 3.163 2.900 4.053) 5.902 11.069 ( 4.728 7.417 -4.855) 10.047 11.236 ( -2.223 -1.954 -2.143) 3.654 11.508 ( -1.896 0.080 0.345) 1.929 11.944 ( -2.727 4.543 -7.768) 9.403 12.322 ( -5.336 3.940 -2.333) 7.031 12.740 ( 8.494 -2.975 3.428) 9.631 13.154 ( 4.637 2.139 10.011) 11.238 13.431 ( -5.349 -4.376 7.293) 10.048 13.728 ( 2.584 -1.358 8.272) 8.772 13.923 ( 9.107 5.404 -10.020) 14.579 14.139 ( 1.158 -11.601 9.134) 14.811 14.471 ( 4.544 3.101 3.555) 6.550 15.905 ( -22.268 8.388 -11.349) 26.363 18.400 ( 0.134 -6.445 4.824) 8.052 18.935 ( -0.714 -4.142 5.038) 6.561 20.290 ( 15.377 0.249 4.657) 16.068 20.736 ( 22.197 -6.122 -7.225) 24.132 22.132 ( -20.878 10.539 -4.347) 23.788 23.724 ( -0.428 -1.671 4.882) 5.177 ======================= Grid point 748 (361/433) ======================= q-point: ( 0.42 0.00 -0.55) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.526 ( 1.960 7.685 -5.353) 9.569 3.499 ( -6.016 1.635 -8.438) 10.491 4.294 ( 4.599 -5.878 1.627) 7.639 5.191 ( -0.194 0.620 2.753) 2.829 6.639 ( -1.803 -1.977 -7.302) 7.777 6.693 ( -6.729 1.370 -2.724) 7.387 7.352 ( 3.741 -7.082 12.630) 14.955 7.788 ( -5.253 2.370 -6.595) 8.758 8.346 ( -3.406 2.657 -9.002) 9.985 8.470 ( -10.034 8.674 -4.690) 14.068 8.503 ( -1.892 -0.459 -8.430) 8.652 8.907 ( -3.649 3.493 -5.379) 7.379 9.298 ( -6.468 4.374 -3.384) 8.510 9.460 ( -1.038 -1.765 -4.158) 4.635 9.970 ( 1.113 -4.456 -4.505) 6.434 10.431 ( 2.685 0.904 5.921) 6.564 10.532 ( 5.902 -2.835 6.099) 8.948 11.054 ( 4.074 6.259 -7.534) 10.608 11.203 ( -1.555 -0.315 -1.664) 2.299 11.499 ( -1.655 -2.870 2.197) 3.975 11.781 ( -4.600 5.369 -7.361) 10.206 12.183 ( -5.655 2.048 -0.245) 6.019 12.894 ( 6.337 1.696 3.160) 7.281 13.273 ( 3.873 -1.467 5.555) 6.929 13.399 ( -4.296 -1.009 3.982) 5.944 13.843 ( -4.389 -9.539 8.190) 13.317 13.960 ( 11.613 8.602 -6.341) 15.782 14.301 ( 1.302 -7.708 5.993) 9.851 14.507 ( 2.937 5.348 1.543) 6.293 15.491 ( -13.168 3.351 -8.728) 16.149 18.488 ( 0.950 -4.834 1.441) 5.133 19.010 ( 0.846 -3.904 6.431) 7.571 20.521 ( 9.336 1.100 4.630) 10.479 21.081 ( 19.916 -4.161 -10.087) 22.710 21.656 ( -22.714 9.082 0.391) 24.465 23.773 ( 1.020 -1.730 3.124) 3.714 ======================= Grid point 749 (362/433) ======================= q-point: (-0.50 0.00 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 794 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.458 ( -2.794 0.566 -0.305) 2.867 3.361 ( -4.851 1.617 -0.445) 5.132 4.362 ( -0.745 0.022 1.856) 2.000 5.208 ( 1.356 0.008 0.941) 1.650 6.551 ( -3.576 -0.615 -2.938) 4.669 6.640 ( 0.409 -1.660 -2.108) 2.714 7.630 ( 10.735 -5.260 8.265) 14.533 7.703 ( -1.783 -4.071 -4.248) 6.148 8.031 ( -7.310 9.793 -12.134) 17.222 8.340 ( -0.578 0.574 0.154) 0.829 8.498 ( 0.913 2.277 -3.930) 4.633 8.823 ( -0.677 1.799 -1.894) 2.699 9.207 ( -0.237 1.857 0.428) 1.921 9.427 ( -1.414 -0.058 -2.056) 2.497 9.972 ( -1.510 -0.879 -2.240) 2.841 10.496 ( 1.115 -0.993 1.292) 1.975 10.693 ( 3.793 -3.439 8.090) 9.574 10.956 ( -3.399 4.861 -7.596) 9.637 11.178 ( -0.465 0.094 -0.603) 0.767 11.534 ( -0.111 -4.007 2.760) 4.867 11.648 ( -0.674 3.385 -5.365) 6.380 12.115 ( -1.534 0.339 1.953) 2.507 12.947 ( 0.944 4.277 3.862) 5.839 13.350 ( 0.405 -1.097 1.979) 2.299 13.386 ( -0.620 -2.577 1.238) 2.925 13.839 ( -7.200 -6.847 3.139) 10.420 14.073 ( 10.045 5.088 -3.074) 11.673 14.394 ( 1.365 -2.654 0.904) 3.119 14.499 ( 1.563 3.177 -0.355) 3.558 15.301 ( -3.806 0.211 -2.382) 4.495 18.530 ( -0.354 -2.324 -0.703) 2.454 19.097 ( 2.006 -2.060 2.635) 3.900 20.621 ( 1.283 1.923 3.330) 4.054 21.199 ( -17.812 5.477 1.075) 18.666 21.406 ( 14.771 -2.960 -4.244) 15.651 23.817 ( 1.381 -0.931 0.131) 1.671 ======================= Grid point 750 (363/433) ======================= q-point: (-0.42 0.00 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.422 ( -7.377 -7.116 5.038) 11.421 3.317 ( -2.050 1.205 9.805) 10.089 4.292 ( -5.905 5.844 2.021) 8.550 5.240 ( 2.027 -0.848 -1.904) 2.907 6.515 ( -1.529 0.383 3.802) 4.115 6.705 ( 5.485 -4.194 -3.121) 7.578 7.608 ( -3.284 6.019 -12.423) 14.189 7.755 ( 7.223 -1.741 -3.449) 8.192 8.116 ( 7.754 -6.668 11.057) 15.061 8.383 ( 6.459 1.746 2.913) 7.298 8.473 ( 3.563 0.162 -1.892) 4.037 8.829 ( 2.594 0.262 1.866) 3.206 9.249 ( 5.281 -0.516 2.338) 5.798 9.398 ( -1.156 1.308 1.695) 2.433 9.913 ( -3.588 3.130 1.012) 4.868 10.497 ( -1.189 -0.902 -1.746) 2.297 10.689 ( -5.901 3.106 -7.489) 10.028 10.892 ( -3.698 -6.475 7.894) 10.859 11.182 ( 0.897 -0.082 0.489) 1.025 11.546 ( -0.461 2.017 -1.783) 2.731 11.679 ( 4.225 -4.789 2.249) 6.771 12.150 ( 3.329 -0.827 3.324) 4.776 12.895 ( -3.679 5.184 2.785) 6.940 13.346 ( -1.629 -0.306 -0.650) 1.780 13.432 ( 2.071 -3.725 -0.837) 4.344 13.807 ( -8.323 -8.277 4.898) 12.719 14.091 ( 5.332 8.596 -12.064) 15.744 14.396 ( -0.696 2.748 -2.914) 4.066 14.521 ( 1.242 -2.388 -0.805) 2.809 15.340 ( 6.855 -1.882 6.378) 9.551 18.518 ( -1.090 0.102 -1.863) 2.160 19.125 ( 1.276 1.169 -4.460) 4.784 20.560 ( -7.560 2.364 0.743) 7.955 20.859 ( -20.703 3.969 11.050) 23.801 21.715 ( 19.643 -4.971 -4.681) 20.796 23.834 ( 1.212 0.089 -3.025) 3.260 ======================= Grid point 751 (364/433) ======================= q-point: (-0.33 0.00 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 794 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.398 ( -11.901 -11.388 10.200) 19.375 3.376 ( 0.016 1.552 17.394) 17.463 4.073 ( -11.858 11.513 1.951) 16.642 5.247 ( -0.719 -0.938 -3.950) 4.123 6.544 ( 1.633 1.383 9.333) 9.575 6.799 ( 3.325 -0.608 -5.754) 6.673 7.513 ( 5.976 1.574 -10.196) 11.923 7.921 ( 10.587 -3.550 -0.411) 11.174 8.223 ( -0.366 -0.009 8.312) 8.320 8.496 ( 9.381 5.509 3.211) 11.344 8.730 ( 13.146 -11.847 2.657) 17.895 8.917 ( 4.810 -0.333 5.585) 7.378 9.381 ( 1.915 3.741 4.351) 6.049 9.448 ( 10.514 -6.741 5.242) 13.545 9.820 ( -5.033 4.125 4.356) 7.831 10.446 ( -5.449 1.153 -3.022) 6.337 10.513 ( -3.443 0.917 -8.127) 8.874 10.949 ( -3.786 -9.702 7.363) 12.754 11.208 ( 1.899 1.011 0.799) 2.295 11.504 ( -1.557 1.830 0.949) 2.583 11.826 ( 3.808 -5.806 3.869) 7.948 12.262 ( 5.205 -1.571 3.776) 6.620 12.779 ( -4.160 5.882 -0.303) 7.211 13.303 ( -2.439 -1.433 -4.777) 5.552 13.500 ( 1.941 -2.410 -0.562) 3.145 13.775 ( -9.491 -9.889 4.230) 14.345 13.974 ( 2.491 9.474 -15.620) 18.437 14.290 ( -3.025 6.827 -5.767) 9.435 14.522 ( -3.166 -1.906 -2.231) 4.317 15.657 ( 19.264 -6.010 13.751) 24.419 18.481 ( 0.276 2.206 -3.546) 4.185 19.071 ( -0.410 2.791 -8.239) 8.709 20.345 ( -14.547 2.995 -0.896) 14.880 20.547 ( -21.303 4.353 11.609) 24.648 22.090 ( 19.863 -6.910 0.100) 21.031 23.825 ( 1.300 0.601 -5.193) 5.387 ======================= Grid point 752 (365/433) ======================= q-point: (-0.25 0.00 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.373 ( -13.372 -12.388 13.925) 22.938 3.430 ( -6.110 9.363 19.132) 22.159 3.751 ( -10.711 9.643 3.349) 14.797 5.178 ( -4.997 0.391 -3.754) 6.262 6.610 ( -0.600 2.174 -2.381) 3.280 6.771 ( 3.600 5.944 7.364) 10.125 7.628 ( 7.917 -6.614 -4.804) 11.380 8.141 ( 10.187 -0.432 6.558) 12.123 8.349 ( 9.701 -6.499 -1.391) 11.759 8.619 ( 9.579 7.241 5.028) 13.018 8.995 ( 8.364 -1.874 -0.153) 8.573 9.078 ( 5.006 -9.670 9.731) 14.604 9.415 ( 2.076 2.150 7.041) 7.649 9.700 ( -11.365 0.987 4.696) 12.337 9.775 ( 13.006 -5.352 4.604) 14.798 10.346 ( 4.000 6.891 -2.858) 8.465 10.435 ( -3.698 -5.794 -4.541) 8.238 11.085 ( 3.333 -12.566 5.207) 14.005 11.220 ( 1.051 3.354 1.032) 3.663 11.485 ( -0.741 0.296 4.360) 4.433 11.951 ( 2.242 -5.440 3.534) 6.863 12.346 ( 0.874 1.627 2.052) 2.761 12.660 ( -1.705 5.467 -3.239) 6.579 13.244 ( -3.133 -4.369 -7.744) 9.427 13.476 ( -8.210 -1.914 -1.980) 8.660 13.749 ( -2.649 -4.957 -1.467) 5.808 13.851 ( 1.246 5.082 -9.137) 10.529 14.111 ( -3.248 10.193 -7.446) 13.034 14.431 ( -6.913 -0.201 -2.128) 7.236 16.233 ( 28.262 -10.727 16.737) 34.554 18.455 ( 3.839 3.729 -5.808) 7.898 18.978 ( -2.079 2.093 -6.721) 7.340 20.028 ( -18.245 4.333 -1.279) 18.796 20.187 ( -23.360 5.770 7.935) 25.336 22.486 ( 17.459 -7.471 3.418) 19.295 23.812 ( 1.846 0.330 -5.640) 5.944 ======================= Grid point 753 (366/433) ======================= q-point: (-0.17 0.00 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 794 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.365 ( -11.082 -10.633 14.178) 20.902 3.079 ( -20.753 21.545 9.362) 31.346 3.744 ( 2.740 -0.263 13.312) 13.593 5.044 ( -7.130 1.599 -2.465) 7.712 6.434 ( -5.510 6.639 -10.106) 13.287 6.970 ( 11.171 1.009 17.781) 21.023 7.787 ( 2.731 -11.605 -2.180) 12.120 8.288 ( 2.915 4.396 5.406) 7.553 8.566 ( 14.111 4.574 0.582) 14.845 8.804 ( 12.443 -6.148 1.767) 13.991 9.119 ( 3.213 -0.297 4.414) 5.468 9.304 ( 3.121 -12.323 1.797) 12.839 9.457 ( -12.334 0.871 8.758) 15.152 9.526 ( 4.629 1.813 3.030) 5.822 9.928 ( 4.998 5.669 0.985) 7.622 10.234 ( -6.768 3.121 -5.280) 9.133 10.683 ( 17.493 -11.875 2.754) 21.322 11.182 ( -1.519 4.165 4.242) 6.136 11.348 ( 9.898 -8.493 2.186) 13.224 11.550 ( 4.902 -3.782 4.462) 7.631 12.048 ( 0.932 -4.486 2.898) 5.421 12.264 ( -4.698 6.198 -1.796) 7.982 12.581 ( -0.652 4.621 -2.788) 5.436 13.197 ( -3.884 -8.063 -8.491) 12.336 13.259 ( -16.092 -2.788 -5.254) 17.156 13.710 ( -1.469 8.545 -3.301) 9.277 13.816 ( 1.659 -0.047 -3.462) 3.839 13.948 ( 0.439 6.091 -6.696) 9.063 14.289 ( -8.273 0.491 -1.284) 8.386 16.958 ( 32.121 -13.788 14.424) 37.814 18.476 ( 8.423 4.542 -7.479) 12.145 18.887 ( -3.855 0.990 -2.369) 4.632 19.652 ( -20.436 6.147 0.290) 21.343 19.774 ( -22.761 5.478 3.117) 23.617 22.829 ( 12.766 -6.127 4.074) 14.735 23.815 ( 2.160 -0.286 -4.439) 4.945 ======================= Grid point 754 (367/433) ======================= q-point: (-0.08 0.00 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.382 ( -5.840 -6.518 10.717) 13.837 2.618 ( -15.635 16.326 7.532) 23.826 3.893 ( 4.210 -0.734 12.424) 13.138 4.904 ( -5.669 1.515 -1.916) 6.173 6.246 ( -3.784 4.165 -7.527) 9.399 7.276 ( 12.441 -0.464 15.428) 19.825 7.919 ( -0.764 -15.113 -1.186) 15.179 8.218 ( -1.485 12.826 0.888) 12.942 8.766 ( 11.647 4.617 7.976) 14.852 8.962 ( -15.716 -6.567 10.942) 20.245 9.142 ( 7.446 0.093 -5.216) 9.091 9.397 ( 2.813 -6.409 0.458) 7.014 9.452 ( 7.218 -3.657 -5.012) 9.518 9.698 ( 7.512 -0.594 7.991) 10.983 9.881 ( -1.164 9.407 -1.381) 9.579 10.078 ( -4.323 0.701 -6.013) 7.439 11.057 ( 7.911 -8.223 3.929) 12.068 11.174 ( 4.954 2.568 2.297) 6.034 11.528 ( 5.534 -1.545 3.460) 6.707 11.808 ( 12.990 -8.341 0.283) 15.440 12.043 ( -5.423 -0.250 -1.665) 5.678 12.168 ( 0.008 1.545 3.716) 4.025 12.496 ( -1.662 6.524 -1.497) 6.897 12.971 ( -15.548 -0.998 -4.326) 16.169 13.186 ( -4.730 -14.683 -7.754) 17.265 13.503 ( -3.447 16.972 -4.262) 17.835 13.845 ( 2.855 -0.624 -2.287) 3.711 13.910 ( 1.187 2.005 -3.631) 4.314 14.157 ( -6.191 -0.226 -0.117) 6.196 17.675 ( 28.101 -13.750 7.579) 32.189 18.550 ( 10.512 5.678 -6.789) 13.742 18.789 ( -6.752 1.772 1.830) 7.216 19.261 ( -19.069 5.029 3.741) 20.073 19.411 ( -15.461 2.938 -1.749) 15.835 23.063 ( 7.132 -3.434 2.802) 8.397 23.829 ( 1.180 -0.468 -2.381) 2.699 ======================= Grid point 756 (368/433) ======================= q-point: ( 0.08 0.08 -0.55) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 432 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.670 ( 12.620 -0.000 1.494) 12.708 2.933 ( 22.488 -0.000 -5.383) 23.124 3.957 ( -3.766 0.000 -6.647) 7.640 5.003 ( 7.930 -0.000 0.237) 7.933 6.232 ( 5.595 -0.000 2.953) 6.327 7.262 ( -11.265 0.000 -12.457) 16.795 7.907 ( -11.248 0.000 2.101) 11.443 8.227 ( 6.220 -0.000 0.588) 6.248 8.631 ( -15.204 0.000 -0.379) 15.209 8.776 ( -11.536 0.000 -3.282) 11.994 9.070 ( -0.431 0.000 21.306) 21.311 9.442 ( 9.812 -0.000 -10.994) 14.736 9.658 ( -0.216 0.000 -10.257) 10.260 9.789 ( -2.902 0.000 -12.658) 12.987 9.832 ( -0.503 0.000 -3.976) 4.008 10.162 ( 10.116 -0.000 -2.713) 10.474 10.879 ( -20.634 0.000 -1.755) 20.709 11.177 ( -0.836 0.000 -2.885) 3.004 11.506 ( -4.839 0.000 -4.613) 6.686 11.661 ( -7.415 0.000 -1.705) 7.609 12.085 ( 6.344 -0.000 4.197) 7.607 12.189 ( -0.975 0.000 -3.181) 3.327 12.509 ( 3.891 -0.000 2.006) 4.378 13.165 ( 6.602 -0.000 -0.671) 6.636 13.243 ( 1.923 -0.000 12.896) 13.039 13.377 ( 7.240 -0.000 5.559) 9.128 13.762 ( -2.734 0.000 5.656) 6.282 13.903 ( 2.038 -0.000 -6.977) 7.268 14.244 ( 6.766 -0.000 3.300) 7.528 17.307 ( -32.630 0.000 -6.681) 33.307 18.268 ( -8.213 0.000 7.652) 11.225 18.831 ( -0.543 0.000 1.085) 1.213 19.669 ( 24.872 -0.000 -2.772) 25.026 19.713 ( 22.755 -0.000 0.529) 22.761 22.986 ( -10.710 0.000 -5.200) 11.906 23.736 ( -4.405 0.000 3.775) 5.801 ======================= Grid point 757 (369/433) ======================= q-point: ( 0.17 0.08 -0.55) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.829 ( 14.083 12.093 -3.267) 18.848 3.349 ( 20.495 -14.432 -4.724) 25.507 3.839 ( -4.003 0.434 -9.260) 10.097 5.124 ( 5.449 0.012 1.433) 5.634 6.386 ( 7.361 -3.478 5.286) 9.707 7.002 ( -9.697 -0.516 -14.619) 17.550 7.654 ( -18.147 4.219 6.089) 19.601 8.310 ( 1.765 -1.153 -2.697) 3.423 8.357 ( -13.239 1.789 -7.569) 15.354 8.597 ( -9.439 -3.816 -1.636) 10.312 9.069 ( -3.375 0.498 -0.430) 3.438 9.506 ( -1.229 15.154 -5.473) 16.159 9.532 ( -4.344 1.080 -9.399) 10.410 9.774 ( 12.584 -5.471 -1.615) 13.817 9.801 ( -4.641 -6.000 -7.741) 10.837 10.279 ( 0.551 -2.365 -6.723) 7.148 10.501 ( -14.167 5.722 1.947) 15.402 11.149 ( -3.024 -2.838 0.255) 4.155 11.379 ( -2.650 6.528 -4.232) 8.219 11.573 ( -1.550 0.070 -3.866) 4.166 12.119 ( -1.581 3.083 -4.212) 5.454 12.283 ( 9.449 -5.437 0.918) 10.940 12.570 ( 2.329 1.309 1.731) 3.183 13.148 ( -5.329 -0.040 4.109) 6.730 13.330 ( 2.897 4.209 13.539) 14.471 13.645 ( 9.093 -7.809 8.547) 14.721 13.765 ( -3.775 -1.390 7.704) 8.691 13.928 ( 9.130 1.588 -9.378) 13.184 14.385 ( 7.203 0.199 4.016) 8.250 16.672 ( -32.858 4.872 -11.508) 35.154 18.236 ( -3.103 -2.558 8.308) 9.230 18.839 ( -1.239 -1.418 4.260) 4.658 20.025 ( 22.873 5.038 -0.011) 23.421 20.155 ( 24.425 -8.014 -2.647) 25.842 22.701 ( -17.079 3.230 -7.053) 18.759 23.698 ( -3.157 -0.136 5.198) 6.083 ======================= Grid point 758 (370/433) ======================= q-point: ( 0.25 0.08 -0.55) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.870 ( 11.271 17.385 -5.982) 21.565 3.672 ( 0.237 -3.029 -16.707) 16.981 3.803 ( 8.866 -12.807 4.241) 16.143 5.190 ( 1.129 0.554 3.027) 3.278 6.572 ( 5.768 -3.450 4.637) 8.166 6.799 ( -5.548 -2.050 -12.914) 14.204 7.348 ( -18.492 2.485 9.754) 21.054 8.044 ( -14.518 -0.226 -10.716) 18.045 8.340 ( 3.289 -0.084 -3.966) 5.154 8.500 ( -4.965 -2.611 -3.398) 6.559 8.975 ( -4.385 2.895 -8.479) 9.975 9.218 ( -8.745 8.252 -14.200) 18.607 9.418 ( -4.503 1.039 -3.182) 5.611 9.665 ( -9.737 0.097 -7.157) 12.085 9.927 ( 1.361 4.212 -6.265) 7.671 10.228 ( 5.291 -8.554 3.129) 10.534 10.459 ( 1.836 3.255 4.568) 5.902 11.149 ( 0.505 -1.077 1.156) 1.659 11.276 ( 1.411 7.233 -4.154) 8.459 11.524 ( -2.201 0.914 -1.745) 2.953 12.021 ( -3.011 3.310 -5.397) 7.010 12.392 ( -0.679 2.458 -6.444) 6.930 12.642 ( 6.261 -4.582 2.291) 8.090 13.129 ( -4.052 -5.693 8.879) 11.298 13.404 ( -0.157 2.996 13.418) 13.749 13.710 ( -3.688 -0.778 1.922) 4.231 13.938 ( 6.391 -8.426 11.913) 15.930 14.036 ( 12.132 4.925 -7.336) 15.009 14.514 ( 6.068 1.328 3.957) 7.364 16.035 ( -27.929 4.837 -13.251) 31.289 18.303 ( 1.334 -3.539 7.620) 8.506 18.870 ( -0.977 -2.419 6.435) 6.944 20.333 ( 18.588 4.080 1.441) 19.085 20.604 ( 22.995 -7.334 -5.148) 24.679 22.287 ( -22.023 5.462 -7.003) 23.746 23.703 ( -0.672 -0.625 5.593) 5.668 ======================= Grid point 759 (371/433) ======================= q-point: ( 0.33 0.08 -0.55) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.797 ( 5.134 19.074 -4.874) 20.345 3.531 ( -4.439 1.493 -10.874) 11.839 4.100 ( 5.722 -13.946 2.044) 15.212 5.195 ( -1.761 0.056 2.992) 3.472 6.625 ( -0.160 0.307 -4.851) 4.863 6.702 ( -5.214 -0.495 -1.950) 5.589 7.221 ( -4.099 -5.793 13.006) 14.816 7.773 ( -12.677 -3.411 -7.949) 15.347 8.377 ( 3.922 1.625 -6.205) 7.518 8.454 ( 1.691 -2.143 -6.118) 6.700 8.682 ( -15.549 9.768 -11.340) 21.582 8.968 ( -5.278 2.034 -10.947) 12.322 9.318 ( -5.036 0.118 -4.388) 6.680 9.487 ( -2.168 3.099 -5.510) 6.682 9.905 ( 2.108 -2.778 -4.369) 5.590 10.459 ( 1.190 -0.440 3.228) 3.469 10.479 ( 7.498 -0.687 8.065) 11.033 11.186 ( 4.671 4.602 -2.617) 7.060 11.228 ( 2.142 4.603 -2.197) 5.532 11.469 ( -3.021 -0.074 0.916) 3.158 11.884 ( -4.631 4.852 -6.298) 9.201 12.235 ( -7.303 3.607 -3.019) 8.687 12.809 ( 3.998 -8.709 -2.685) 9.952 13.217 ( 0.303 -5.566 9.334) 10.871 13.417 ( -2.535 3.198 9.021) 9.901 13.680 ( -6.348 -6.635 3.440) 9.806 14.125 ( 11.004 7.905 -5.473) 14.613 14.178 ( 6.725 -4.901 9.637) 12.733 14.597 ( 4.264 3.547 1.810) 5.834 15.536 ( -18.870 1.459 -10.815) 21.798 18.418 ( 3.450 -2.474 5.632) 7.053 18.934 ( 0.064 -3.732 7.785) 8.633 20.565 ( 12.130 3.425 1.520) 12.695 20.987 ( 20.547 -5.474 -8.149) 22.772 21.806 ( -24.478 6.174 -3.897) 25.543 23.749 ( 1.501 -0.747 4.442) 4.748 ======================= Grid point 760 (372/433) ======================= q-point: ( 0.42 0.08 -0.55) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.632 ( -1.367 16.605 -1.109) 16.698 3.399 ( -3.466 2.155 -3.539) 5.403 4.274 ( 0.412 -9.380 1.876) 9.575 5.188 ( -0.966 -1.716 0.812) 2.130 6.572 ( -1.819 2.669 -1.631) 3.619 6.613 ( -3.285 -1.096 0.947) 3.590 7.431 ( 6.239 -12.127 12.119) 18.245 7.618 ( -5.640 -6.132 -4.968) 9.700 8.228 ( -13.672 9.630 -15.773) 22.988 8.382 ( 3.025 3.157 -1.225) 4.541 8.510 ( 4.930 -0.788 -7.580) 9.076 8.850 ( -1.656 0.761 -5.421) 5.719 9.223 ( -1.930 0.589 -3.523) 4.060 9.443 ( 0.782 1.477 -2.412) 2.934 9.964 ( 3.366 -0.606 -0.526) 3.460 10.460 ( -1.287 -1.900 2.176) 3.162 10.661 ( 4.897 -0.503 8.199) 9.563 11.100 ( -2.429 9.665 -8.536) 13.121 11.236 ( 3.155 5.048 -0.228) 5.957 11.462 ( -0.759 -3.135 3.722) 4.925 11.728 ( -2.879 4.619 -5.607) 7.814 12.117 ( -3.289 0.071 0.915) 3.415 12.889 ( -2.243 -9.248 -3.924) 10.294 13.311 ( -0.564 -2.718 6.034) 6.642 13.395 ( -1.026 2.288 4.748) 5.370 13.650 ( -10.179 -10.140 5.388) 15.345 14.192 ( 8.704 6.242 -4.277) 11.534 14.371 ( 8.193 -0.257 4.806) 9.502 14.597 ( 1.644 6.059 -3.196) 7.045 15.273 ( -8.159 -2.792 -3.523) 9.315 18.510 ( 2.593 0.241 3.696) 4.521 19.034 ( 1.876 -4.250 5.999) 7.588 20.672 ( 3.834 3.313 -0.270) 5.074 21.268 ( 3.821 -0.102 -10.709) 11.371 21.371 ( -9.182 0.965 3.281) 9.798 23.807 ( 2.342 -0.138 1.855) 2.991 ======================= Grid point 761 (373/433) ======================= q-point: (-0.50 0.08 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.451 ( -5.199 10.190 3.859) 12.073 3.349 ( -0.909 2.058 6.468) 6.848 4.318 ( -3.911 -3.461 1.734) 5.503 5.208 ( 0.973 -2.509 -1.910) 3.300 6.551 ( 1.091 3.221 5.564) 6.521 6.618 ( 0.818 -4.340 0.189) 4.420 7.552 ( -3.386 -9.832 -3.604) 11.005 7.787 ( 5.969 0.330 0.507) 5.999 7.943 ( 1.802 -6.450 -2.312) 7.085 8.441 ( 8.172 3.333 0.111) 8.827 8.519 ( 2.252 2.806 -5.990) 6.987 8.827 ( 1.407 -0.060 -0.688) 1.567 9.216 ( 2.069 -2.133 -1.409) 3.289 9.440 ( 1.593 2.500 1.607) 3.372 9.991 ( 1.124 4.588 2.532) 5.359 10.467 ( -2.083 -2.470 -0.190) 3.237 10.739 ( -1.253 0.606 3.384) 3.659 10.861 ( -8.736 5.216 -4.924) 11.304 11.235 ( 3.156 5.297 0.627) 6.197 11.541 ( 2.040 -3.040 5.384) 6.511 11.645 ( 0.349 1.809 -4.444) 4.811 12.131 ( 2.368 -1.151 2.642) 3.730 12.875 ( -5.711 -7.316 -4.073) 10.135 13.317 ( -3.494 -1.773 0.967) 4.036 13.405 ( 1.105 -0.509 2.297) 2.599 13.613 ( -10.888 -10.252 7.510) 16.735 14.219 ( 4.161 4.693 -7.476) 9.758 14.501 ( 3.484 0.108 -4.468) 5.667 14.518 ( 4.018 9.118 -2.711) 10.326 15.271 ( 2.453 -5.146 5.504) 7.924 18.544 ( 1.203 2.677 2.689) 3.981 19.121 ( 2.195 -1.759 -0.347) 2.834 20.617 ( -5.267 3.359 -3.033) 6.944 20.938 ( -20.677 4.275 8.751) 22.856 21.610 ( 17.355 -5.832 -7.198) 19.673 23.843 ( 2.007 0.809 -1.299) 2.524 ======================= Grid point 762 (374/433) ======================= q-point: (-0.42 0.08 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.320 ( -7.067 3.998 9.354) 12.387 3.404 ( 1.477 1.574 14.751) 14.908 4.224 ( -8.800 3.580 1.446) 9.610 5.228 ( 0.617 -1.236 -3.528) 3.789 6.587 ( 1.652 2.965 8.637) 9.280 6.732 ( 5.374 -5.484 1.079) 7.754 7.539 ( 1.175 -1.457 -11.378) 11.531 7.794 ( 4.959 -5.441 -1.377) 7.490 8.254 ( 7.307 -3.982 9.829) 12.878 8.512 ( 5.026 -4.515 -3.428) 7.576 8.581 ( 10.369 1.825 1.380) 10.618 8.896 ( 4.964 -1.454 4.017) 6.550 9.318 ( 5.580 -6.084 1.213) 8.344 9.472 ( 4.172 4.507 5.401) 8.178 9.938 ( -2.932 7.991 4.523) 9.639 10.424 ( -4.061 -1.142 -2.327) 4.818 10.578 ( -4.920 4.475 -8.679) 10.934 10.802 ( -5.645 -5.504 8.136) 11.330 11.254 ( 3.575 3.914 1.538) 5.520 11.545 ( -2.222 2.419 0.567) 3.333 11.718 ( 4.136 -5.242 3.266) 7.433 12.227 ( 5.034 -1.788 2.673) 5.974 12.809 ( -4.975 -3.844 -4.876) 7.957 13.250 ( -5.279 -2.603 -4.843) 7.622 13.481 ( 4.367 -1.652 2.374) 5.238 13.565 ( -11.930 -10.098 7.171) 17.197 14.136 ( 0.424 6.876 -13.384) 15.052 14.407 ( -3.527 3.080 -3.521) 5.859 14.544 ( 4.074 6.229 -5.173) 9.064 15.519 ( 13.384 -8.120 11.483) 19.415 18.543 ( 1.659 4.336 1.286) 4.818 19.120 ( 0.354 2.012 -6.244) 6.570 20.418 ( -11.450 3.960 -2.810) 12.437 20.629 ( -19.842 4.588 11.049) 23.169 21.935 ( 17.226 -8.975 -3.758) 19.784 23.844 ( 1.392 1.355 -3.877) 4.336 ======================= Grid point 763 (375/433) ======================= q-point: (-0.33 0.08 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.256 ( -6.089 0.978 14.141) 15.427 3.520 ( 1.559 2.112 18.615) 18.799 3.972 ( -13.614 10.603 0.738) 17.271 5.195 ( -2.201 1.282 -3.470) 4.304 6.636 ( 0.677 0.560 2.229) 2.396 6.864 ( 5.865 2.495 7.139) 9.570 7.543 ( 4.304 -2.127 -8.503) 9.765 8.013 ( 10.754 -11.630 -0.078) 15.840 8.314 ( 2.444 4.278 7.353) 8.851 8.721 ( 9.915 0.835 -1.579) 10.075 8.779 ( 6.894 -15.432 1.935) 17.012 9.042 ( 6.405 1.085 7.784) 10.139 9.462 ( 3.328 -1.144 3.707) 5.111 9.619 ( 7.917 -1.492 10.221) 13.014 9.809 ( -3.704 5.451 2.049) 6.902 10.342 ( -4.067 -2.000 -3.116) 5.500 10.473 ( 0.346 4.635 -3.425) 5.773 10.856 ( -0.250 -10.461 5.915) 12.020 11.282 ( 1.991 3.260 2.078) 4.349 11.495 ( -2.016 0.958 2.095) 3.061 11.847 ( 2.419 -5.419 3.781) 7.037 12.340 ( 3.909 -1.617 1.503) 4.489 12.734 ( -2.152 0.072 -6.322) 6.678 13.140 ( -6.714 -4.391 -9.172) 12.185 13.449 ( -12.476 -2.783 7.299) 14.719 13.631 ( 5.751 -5.873 -0.882) 8.267 13.970 ( -1.462 6.950 -13.647) 15.385 14.283 ( -4.367 5.165 -3.220) 7.491 14.473 ( -1.209 6.398 -5.119) 8.282 15.992 ( 20.971 -13.670 14.108) 28.735 18.544 ( 4.494 5.439 -1.316) 7.177 19.038 ( -1.674 3.956 -5.947) 7.337 20.142 ( -13.225 6.757 -3.762) 15.321 20.295 ( -22.041 5.649 8.917) 24.439 22.300 ( 15.482 -11.657 0.370) 19.384 23.825 ( 1.186 1.022 -4.966) 5.207 ======================= Grid point 764 (376/433) ======================= q-point: (-0.25 0.08 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.271 ( -1.724 1.313 15.763) 15.912 3.470 ( -16.036 17.690 9.435) 25.673 3.747 ( 0.047 1.171 9.158) 9.233 5.094 ( -4.601 3.535 -2.582) 6.350 6.568 ( -3.275 5.634 -7.162) 9.683 7.017 ( 9.076 4.053 15.489) 18.404 7.594 ( 0.298 -7.356 -3.369) 8.096 8.314 ( 9.957 -5.576 3.891) 12.057 8.443 ( 9.538 -7.680 0.399) 12.252 8.814 ( 1.758 -1.150 2.150) 3.006 9.055 ( 9.555 -13.168 -2.571) 16.471 9.144 ( 3.191 4.519 8.505) 10.146 9.514 ( -12.300 4.116 2.864) 13.283 9.556 ( 5.457 2.948 7.090) 9.420 9.980 ( 9.470 -0.863 6.835) 11.711 10.277 ( -5.690 -0.432 -4.576) 7.315 10.503 ( 10.090 -3.495 1.338) 10.761 11.087 ( 8.368 -13.971 4.630) 16.931 11.274 ( -0.399 2.179 2.142) 3.082 11.500 ( 0.480 -1.443 2.453) 2.886 11.955 ( 1.945 -5.285 3.523) 6.643 12.359 ( -1.963 3.034 -1.038) 3.760 12.667 ( 0.823 2.577 -6.772) 7.292 13.011 ( -7.974 -7.378 -11.074) 15.513 13.265 ( -14.484 0.222 2.218) 14.654 13.771 ( 7.124 -0.980 -1.688) 7.387 13.832 ( -0.841 2.707 -7.499) 8.016 14.125 ( -3.853 8.528 -4.014) 10.182 14.333 ( -5.069 5.721 -3.559) 8.431 16.617 ( 23.427 -20.407 13.366) 33.822 18.582 ( 9.239 6.110 -4.609) 11.997 18.938 ( -2.834 4.431 -0.283) 5.267 19.808 ( -13.962 9.612 -5.355) 17.777 19.901 ( -22.681 7.272 5.630) 24.475 22.653 ( 11.686 -12.075 2.465) 16.984 23.811 ( 1.251 -0.024 -4.302) 4.480 ======================= Grid point 765 (377/433) ======================= q-point: (-0.17 0.08 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.357 ( 4.503 3.958 13.182) 14.481 2.993 ( -18.606 21.450 3.544) 28.615 3.868 ( 3.454 -1.670 11.531) 12.152 4.962 ( -4.289 4.510 -1.945) 6.520 6.386 ( -3.297 9.331 -6.898) 12.064 7.264 ( 11.015 -0.425 14.513) 18.224 7.651 ( -2.484 -11.435 -1.554) 11.805 8.412 ( 1.776 6.892 3.876) 8.104 8.711 ( 0.224 -16.056 1.841) 16.162 8.866 ( 5.356 -0.802 0.921) 5.493 9.166 ( -2.708 3.574 9.933) 10.898 9.308 ( 8.977 -10.176 -5.424) 14.613 9.336 ( -1.726 2.819 -0.798) 3.401 9.694 ( 6.939 -0.399 4.828) 8.463 10.071 ( 2.368 6.035 3.973) 7.603 10.118 ( -5.316 5.826 -4.398) 9.030 10.836 ( 13.428 -13.674 2.202) 19.291 11.205 ( -2.383 0.938 3.039) 3.974 11.452 ( 10.082 -9.487 1.789) 13.958 11.573 ( 2.760 -9.940 2.169) 10.542 12.049 ( 1.704 -2.065 2.268) 3.509 12.222 ( -5.832 5.653 -1.253) 8.218 12.639 ( 4.182 4.606 -5.003) 7.984 12.882 ( -10.874 -7.206 -7.278) 14.938 13.026 ( -11.215 -0.837 -3.710) 11.842 13.769 ( -0.939 6.164 0.721) 6.277 13.847 ( 4.344 3.412 -5.851) 8.046 13.986 ( 0.581 5.767 -2.852) 6.460 14.169 ( -7.079 2.998 -1.426) 7.819 17.266 ( 17.881 -26.020 8.644) 32.734 18.682 ( 14.054 6.576 -6.867) 16.968 18.860 ( -3.169 5.631 6.169) 8.933 19.426 ( -17.298 11.034 -1.171) 20.551 19.518 ( -14.238 7.969 -1.506) 16.386 22.930 ( 6.640 -10.328 2.264) 12.485 23.813 ( 0.680 -0.978 -2.445) 2.720 ======================= Grid point 766 (378/433) ======================= q-point: (-0.08 0.08 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.494 ( 9.680 6.112 6.760) 13.295 2.584 ( -8.024 15.782 2.714) 17.912 3.993 ( 1.777 -2.090 6.887) 7.413 4.868 ( -0.059 3.760 -1.523) 4.057 6.232 ( -0.661 7.916 -3.948) 8.871 7.503 ( 5.922 -0.744 6.569) 8.876 7.728 ( -1.534 -15.964 -0.872) 16.061 8.343 ( 0.375 12.428 0.915) 12.467 8.737 ( -9.209 -8.634 12.652) 17.872 8.991 ( 2.906 0.398 -1.154) 3.152 9.090 ( -10.571 2.621 14.213) 17.906 9.404 ( 8.979 -7.653 -10.433) 15.749 9.486 ( 8.044 -6.497 -11.936) 15.792 9.793 ( -1.260 -1.263 4.657) 4.987 9.994 ( 5.894 11.428 -5.281) 13.900 10.040 ( -0.203 4.157 -0.968) 4.273 11.125 ( 5.573 -8.242 2.454) 10.248 11.171 ( -3.938 -3.187 -0.633) 5.105 11.583 ( 1.781 -3.585 0.582) 4.045 11.831 ( 1.466 -19.192 1.562) 19.311 11.968 ( -2.231 8.867 -2.694) 9.532 12.200 ( 1.120 -2.057 3.728) 4.403 12.601 ( -3.441 13.602 0.342) 14.035 12.738 ( 0.452 -6.836 -2.949) 7.458 12.959 ( -1.652 -10.292 -4.718) 11.441 13.618 ( -1.659 17.720 0.066) 17.797 13.850 ( 0.414 -1.557 -2.622) 3.077 13.945 ( -0.332 5.772 -2.003) 6.119 14.083 ( -0.962 -1.771 1.019) 2.258 17.732 ( 0.347 -27.211 3.368) 27.421 18.715 ( -11.948 5.611 4.731) 14.022 18.825 ( 13.025 12.921 -5.217) 19.074 19.145 ( -0.303 5.458 1.389) 5.640 19.295 ( -0.970 6.812 -1.807) 7.114 23.091 ( 1.329 -7.330 0.444) 7.463 23.813 ( -1.202 -1.067 -0.260) 1.627 ======================= Grid point 769 (379/433) ======================= q-point: ( 0.17 0.17 -0.55) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 433 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.117 ( 13.246 -0.000 -3.226) 13.633 3.517 ( 13.533 -0.000 -10.659) 17.227 3.728 ( -3.686 0.000 -4.232) 5.612 5.196 ( 1.176 -0.000 3.149) 3.362 6.534 ( 7.469 -0.000 6.284) 9.761 6.780 ( -5.584 0.000 -13.904) 14.983 7.375 ( -21.448 0.000 9.669) 23.527 8.033 ( -16.698 0.000 -11.609) 20.337 8.334 ( 3.425 -0.000 -5.684) 6.636 8.481 ( -2.959 0.000 -1.169) 3.182 9.002 ( -1.894 0.000 -8.053) 8.273 9.278 ( -13.444 0.000 -15.609) 20.600 9.535 ( -2.944 0.000 -10.768) 11.163 9.580 ( -7.467 0.000 -0.840) 7.514 10.026 ( -12.984 0.000 -11.353) 17.248 10.092 ( 17.976 -0.000 7.980) 19.668 10.495 ( 0.690 -0.000 4.502) 4.554 11.128 ( 1.035 -0.000 2.780) 2.966 11.370 ( 0.272 -0.000 -2.724) 2.737 11.529 ( -1.331 0.000 -3.577) 3.817 12.058 ( -4.114 0.000 -3.625) 5.483 12.402 ( 7.215 -0.000 -7.916) 10.711 12.612 ( 0.942 -0.000 -0.683) 1.164 13.047 ( -7.340 0.000 11.300) 13.474 13.458 ( -0.442 0.000 13.364) 13.371 13.694 ( -6.242 0.000 0.790) 6.292 13.850 ( 10.876 -0.000 12.541) 16.601 14.088 ( 12.933 -0.000 -6.366) 14.414 14.526 ( 6.275 -0.000 4.297) 7.605 16.083 ( -30.137 0.000 -14.034) 33.244 18.268 ( 1.932 -0.000 8.739) 8.951 18.846 ( -1.223 0.000 6.895) 7.003 20.413 ( 17.575 -0.000 -0.106) 17.576 20.492 ( 25.512 -0.000 -4.093) 25.838 22.340 ( -22.350 0.000 -7.879) 23.698 23.697 ( -0.766 0.000 5.832) 5.882 ======================= Grid point 770 (380/433) ======================= q-point: ( 0.25 0.17 -0.55) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.187 ( 9.136 18.402 -4.580) 21.049 3.543 ( -1.596 -0.997 -14.184) 14.309 3.799 ( 2.530 -14.342 4.640) 15.285 5.196 ( -3.047 0.056 2.971) 4.255 6.642 ( 0.912 1.235 0.065) 1.537 6.679 ( -0.469 -1.523 -4.650) 4.915 7.146 ( -11.818 -1.896 12.796) 17.521 7.706 ( -15.775 -2.394 -8.330) 17.999 8.374 ( 6.736 -1.035 -10.041) 12.135 8.449 ( 0.632 0.691 -3.174) 3.309 8.842 ( -13.516 7.007 -11.553) 19.112 8.950 ( -9.533 -3.850 -12.570) 16.239 9.381 ( -2.325 5.423 -8.092) 10.015 9.506 ( -3.162 -1.787 -4.776) 6.000 9.859 ( -0.332 -1.548 -5.703) 5.919 10.417 ( 12.653 -1.507 7.981) 15.035 10.501 ( -1.677 0.846 3.410) 3.893 11.204 ( 5.072 -0.117 3.705) 6.282 11.359 ( 2.984 5.158 -2.379) 6.416 11.479 ( -2.475 0.349 -1.770) 3.062 11.951 ( -4.871 1.867 -3.850) 6.484 12.321 ( -6.602 4.411 -9.430) 12.328 12.636 ( -0.159 -7.205 -3.691) 8.097 13.103 ( 0.432 -4.223 14.443) 15.054 13.485 ( -3.094 2.940 10.202) 11.059 13.591 ( -6.949 -2.891 -1.375) 7.651 14.111 ( 9.900 -1.819 11.169) 15.036 14.245 ( 11.763 3.602 -4.579) 13.127 14.637 ( 4.512 0.749 3.489) 5.752 15.552 ( -22.627 0.362 -12.760) 25.979 18.389 ( 5.417 -0.642 8.344) 9.970 18.880 ( -1.008 -1.594 8.129) 8.345 20.638 ( 12.346 3.261 -0.951) 12.804 20.888 ( 22.277 -3.963 -6.460) 23.531 21.887 ( -25.201 2.154 -6.032) 26.003 23.741 ( 1.769 -0.149 5.177) 5.473 ======================= Grid point 771 (381/433) ======================= q-point: ( 0.33 0.17 -0.55) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 794 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.041 ( 1.325 24.333 -1.810) 24.436 3.436 ( -2.289 1.536 -5.847) 6.464 4.004 ( -0.390 -18.183 2.506) 18.359 5.156 ( -2.770 -1.304 0.461) 3.096 6.590 ( -8.343 -0.589 3.600) 9.106 6.653 ( 3.825 4.544 -1.013) 6.025 7.212 ( 0.499 -9.744 11.858) 15.356 7.496 ( -7.896 -5.483 -3.598) 10.264 8.374 ( -13.899 5.003 -14.299) 20.560 8.432 ( 4.904 1.134 -6.576) 8.282 8.495 ( 2.981 0.426 -9.819) 10.271 8.843 ( -2.239 -1.376 -4.561) 5.264 9.258 ( -0.801 2.957 -10.142) 10.595 9.473 ( 1.658 1.388 -2.702) 3.461 9.929 ( 5.948 -2.838 1.038) 6.671 10.449 ( -3.334 0.871 2.295) 4.140 10.650 ( 6.313 -0.903 7.681) 9.984 11.285 ( 1.081 6.915 -3.147) 7.674 11.334 ( 4.688 5.140 0.641) 6.986 11.431 ( -1.757 0.345 0.913) 2.010 11.814 ( -4.589 3.884 -4.828) 7.710 12.128 ( -5.700 1.308 -2.311) 6.288 12.669 ( -3.684 -11.798 -6.310) 13.877 13.232 ( -1.474 -4.931 11.516) 12.614 13.432 ( -3.616 1.134 0.363) 3.807 13.514 ( -7.964 -3.632 5.929) 10.573 14.290 ( 6.673 2.972 -0.207) 7.308 14.389 ( 11.281 2.706 2.682) 11.907 14.692 ( 2.750 3.101 -0.363) 4.161 15.211 ( -12.010 -3.077 -6.484) 13.991 18.533 ( 5.960 1.768 7.218) 9.526 18.948 ( 0.329 -4.161 7.764) 8.815 20.740 ( 4.946 3.371 -3.415) 6.891 21.215 ( 18.116 -3.478 -10.043) 21.004 21.422 ( -24.112 2.647 0.429) 24.261 23.809 ( 3.016 0.218 3.099) 4.330 ======================= Grid point 772 (382/433) ======================= q-point: (-0.58 0.17 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.784 ( -3.706 23.089 2.578) 23.526 3.391 ( 0.085 2.115 3.424) 4.026 4.149 ( -2.705 -14.216 1.455) 14.544 5.155 ( 0.915 -2.565 -1.770) 3.248 6.527 ( -3.260 -3.628 3.777) 6.169 6.662 ( 2.094 7.127 6.087) 9.603 7.332 ( -4.156 -12.366 2.147) 13.221 7.614 ( 10.335 -11.245 6.991) 16.797 7.999 ( -10.710 5.979 -13.335) 18.118 8.479 ( 6.113 0.546 -3.514) 7.072 8.539 ( 5.712 -0.904 -10.808) 12.258 8.840 ( 2.639 1.159 0.227) 2.891 9.192 ( 1.469 -0.133 -7.924) 8.060 9.489 ( 3.172 2.653 0.758) 4.204 10.063 ( 5.883 2.071 4.860) 7.907 10.415 ( -2.306 -1.926 1.430) 3.327 10.738 ( -1.298 0.026 7.164) 7.281 11.050 ( -9.816 12.403 -9.420) 18.410 11.359 ( 2.931 6.594 0.710) 7.250 11.475 ( 2.767 -3.189 5.659) 7.060 11.700 ( -1.864 3.176 -4.301) 5.662 12.110 ( 2.665 -0.910 1.879) 3.386 12.663 ( -5.926 -13.027 -7.920) 16.357 13.272 ( -5.305 -4.793 7.655) 10.475 13.354 ( -5.409 -2.720 -4.461) 7.520 13.482 ( -5.901 -3.340 10.691) 12.660 14.316 ( 3.548 5.747 -3.272) 7.505 14.511 ( 3.269 0.937 -5.464) 6.436 14.684 ( 5.656 6.714 -3.274) 9.369 15.154 ( 0.010 -6.450 4.407) 7.812 18.621 ( 3.790 5.159 6.313) 8.990 19.056 ( 2.455 -4.860 3.797) 6.638 20.682 ( -4.689 3.162 -6.577) 8.674 21.020 ( -19.654 4.051 6.682) 21.151 21.499 ( 15.561 -5.467 -9.424) 18.996 23.862 ( 2.604 1.036 0.173) 2.808 ======================= Grid point 773 (383/433) ======================= q-point: (-0.50 0.17 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 794 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.546 ( -3.646 18.604 7.541) 20.402 3.439 ( 2.275 1.996 11.720) 12.105 4.193 ( -5.439 -7.004 0.798) 8.903 5.200 ( 2.934 -1.562 -2.840) 4.372 6.583 ( -0.038 -5.790 2.450) 6.287 6.693 ( 4.231 4.476 11.699) 13.221 7.410 ( 0.984 -9.458 -3.012) 9.975 7.789 ( -1.038 1.856 -8.163) 8.435 8.006 ( 13.162 -15.413 8.932) 22.149 8.539 ( 2.428 1.463 -7.148) 7.689 8.591 ( 7.224 -0.769 -3.520) 8.072 8.899 ( 5.626 2.462 4.368) 7.536 9.222 ( 4.204 -3.883 -3.991) 6.977 9.541 ( 4.716 2.991 4.657) 7.271 10.106 ( 0.768 8.620 6.787) 10.998 10.408 ( -2.028 -1.068 -0.586) 2.366 10.697 ( -7.058 7.264 -7.082) 12.359 10.734 ( -8.354 -0.652 5.607) 10.083 11.350 ( 2.609 5.438 1.131) 6.137 11.582 ( -0.955 0.149 5.334) 5.421 11.641 ( 2.204 -1.477 -1.998) 3.321 12.204 ( 5.294 -0.462 2.225) 5.761 12.638 ( -5.335 -12.542 -9.343) 16.525 13.230 ( -5.481 0.052 -0.728) 5.529 13.318 ( -4.498 -10.425 1.826) 11.500 13.486 ( -4.317 -2.814 8.935) 10.314 14.259 ( 0.258 6.600 -7.275) 9.826 14.437 ( -2.996 1.374 -8.187) 8.826 14.698 ( 4.994 7.221 -4.570) 9.898 15.358 ( 10.042 -8.102 9.736) 16.164 18.649 ( 2.850 6.637 4.979) 8.773 19.133 ( 2.062 -1.033 -2.253) 3.224 20.479 ( -11.753 2.254 -1.977) 12.130 20.732 ( -15.890 6.020 7.181) 18.447 21.758 ( 14.161 -9.016 -8.255) 18.708 23.874 ( 1.348 1.672 -2.564) 3.344 ======================= Grid point 774 (384/433) ======================= q-point: (-0.42 0.17 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.413 ( 0.004 14.697 12.245) 19.130 3.552 ( 2.830 1.529 15.885) 16.208 4.100 ( -9.417 1.988 0.144) 9.625 5.223 ( 1.427 1.567 -2.893) 3.586 6.620 ( -1.351 -2.566 2.242) 3.666 6.874 ( 8.979 -0.332 12.631) 15.500 7.488 ( 4.033 -5.198 -9.043) 11.183 7.840 ( 7.794 -4.661 -0.169) 9.083 8.383 ( 7.383 -6.787 8.053) 12.862 8.499 ( 1.429 -4.574 -4.204) 6.375 8.688 ( 4.537 -2.915 -3.899) 6.655 9.053 ( 8.609 0.157 9.178) 12.585 9.351 ( 5.903 -6.823 -0.239) 9.026 9.660 ( 8.830 1.936 7.319) 11.632 9.985 ( -6.822 12.438 4.319) 14.829 10.343 ( -3.589 1.745 -2.436) 4.675 10.539 ( 0.573 2.514 -2.979) 3.940 10.705 ( -5.158 -5.142 6.937) 10.058 11.349 ( 0.741 3.478 1.954) 4.057 11.523 ( -2.831 1.946 0.607) 3.489 11.746 ( 2.463 -4.850 3.362) 6.395 12.306 ( 4.596 -1.559 0.510) 4.879 12.617 ( -3.973 -10.967 -9.876) 15.284 13.122 ( -4.267 1.596 -5.273) 6.968 13.337 ( -9.359 -7.898 7.271) 14.242 13.544 ( 4.209 -4.134 3.451) 6.835 14.110 ( -2.291 7.646 -12.419) 14.763 14.327 ( -4.323 1.349 -3.690) 5.842 14.641 ( 1.209 8.591 -5.655) 10.356 15.733 ( 15.149 -12.506 11.188) 22.607 18.663 ( 4.491 6.821 1.992) 8.407 19.116 ( 0.211 3.740 -3.690) 5.258 20.248 ( -12.752 3.618 1.159) 13.306 20.426 ( -16.819 8.350 3.488) 19.098 22.052 ( 12.607 -13.658 -4.270) 19.072 23.850 ( 0.324 1.522 -4.128) 4.412 ======================= Grid point 775 (385/433) ======================= q-point: (-0.33 0.17 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 794 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.412 ( 5.767 12.711 14.418) 20.068 3.670 ( -0.082 3.099 16.445) 16.735 3.851 ( -11.421 9.101 -1.277) 14.659 5.176 ( -1.250 4.879 -2.429) 5.592 6.616 ( -1.670 -0.439 -1.320) 2.173 7.098 ( 9.233 2.900 13.700) 16.774 7.518 ( 0.974 -1.713 -6.958) 7.231 8.087 ( 11.671 -10.988 -0.659) 16.044 8.421 ( 1.100 0.597 5.086) 5.238 8.697 ( -0.406 -9.477 2.869) 9.911 8.799 ( 8.970 -11.839 -6.371) 16.162 9.218 ( 2.337 1.420 12.411) 12.708 9.494 ( 3.548 -4.110 -0.448) 5.448 9.762 ( -4.702 14.339 5.426) 16.036 9.907 ( 12.745 -4.500 7.641) 15.526 10.261 ( -1.515 0.831 -4.906) 5.201 10.534 ( 0.212 3.755 3.884) 5.406 10.817 ( 5.450 -12.921 4.023) 14.589 11.314 ( -3.530 1.705 2.734) 4.779 11.491 ( 0.104 0.488 -0.189) 0.534 11.847 ( 1.506 -5.774 3.182) 6.763 12.372 ( 1.261 -1.832 -2.448) 3.308 12.594 ( -3.762 -9.088 -8.741) 13.159 12.993 ( -3.021 4.206 -7.877) 9.427 13.248 ( -11.274 -1.635 6.538) 13.134 13.716 ( 8.395 -4.459 1.096) 9.569 13.917 ( -3.093 5.923 -11.776) 13.540 14.218 ( -4.785 2.808 -1.383) 5.717 14.512 ( -1.620 10.404 -5.526) 11.891 16.220 ( 15.964 -19.827 11.281) 27.843 18.702 ( 8.207 6.143 -2.532) 10.559 19.050 ( -0.630 6.913 2.006) 7.226 19.981 ( -14.370 6.861 0.251) 15.926 20.065 ( -15.757 10.785 -1.095) 19.126 22.374 ( 9.860 -16.602 -0.568) 19.318 23.816 ( -0.028 0.507 -4.015) 4.047 ======================= Grid point 776 (386/433) ======================= q-point: (-0.25 0.17 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.518 ( 11.057 12.144 12.575) 20.685 3.398 ( -16.408 19.653 1.579) 25.650 3.837 ( 2.587 -1.383 9.774) 10.204 5.073 ( -2.245 6.850 -1.871) 7.448 6.545 ( -1.760 5.619 -4.230) 7.250 7.285 ( 7.906 3.256 11.728) 14.514 7.504 ( -1.399 -3.997 -1.807) 4.605 8.357 ( 3.397 -15.390 -1.226) 15.808 8.504 ( 1.832 -1.245 7.628) 7.943 8.756 ( 2.520 -7.256 -4.229) 8.768 9.062 ( 8.513 -14.949 -4.405) 17.758 9.221 ( -8.610 1.509 13.549) 16.124 9.511 ( 3.858 8.960 -2.656) 10.110 9.704 ( 3.652 4.058 5.069) 7.450 10.111 ( 0.151 0.171 2.672) 2.682 10.251 ( 4.714 4.367 2.097) 6.759 10.600 ( 6.789 -8.244 0.532) 10.693 11.122 ( 8.627 -15.755 3.893) 18.379 11.251 ( -3.832 -0.965 1.510) 4.231 11.498 ( 0.358 -1.240 -0.643) 1.443 11.958 ( 2.447 -6.563 3.940) 8.036 12.329 ( -4.068 2.473 -3.930) 6.173 12.564 ( -3.981 -8.482 -7.297) 11.876 12.872 ( 0.720 4.446 -8.218) 9.371 13.075 ( -10.836 5.006 2.377) 12.171 13.790 ( -1.737 0.420 -4.946) 5.259 13.893 ( 8.740 -1.246 -0.778) 8.862 14.093 ( -5.053 4.955 -0.400) 7.088 14.328 ( -3.740 11.873 -4.341) 13.183 16.744 ( 11.348 -26.999 9.001) 30.639 18.787 ( 10.820 4.345 -6.925) 13.561 19.003 ( 0.227 9.126 10.527) 13.933 19.644 ( -14.974 10.673 0.037) 18.388 19.711 ( -10.298 12.149 -6.479) 17.194 22.669 ( 5.722 -16.653 0.959) 17.635 23.796 ( -0.210 -0.773 -2.487) 2.613 ======================= Grid point 777 (387/433) ======================= q-point: (-0.17 0.17 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 794 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.652 ( 8.072 10.425 5.022) 14.109 2.975 ( -5.615 22.816 1.934) 23.576 3.944 ( 1.612 -2.619 6.014) 6.755 4.972 ( -0.092 6.813 -1.269) 6.931 6.421 ( -0.312 10.228 -3.463) 10.803 7.451 ( 4.909 -5.944 4.630) 8.993 7.522 ( -1.302 -2.845 0.505) 3.170 8.472 ( -4.000 -13.413 3.754) 14.491 8.534 ( -2.164 3.548 6.308) 7.554 8.866 ( -1.991 -9.875 -1.923) 10.256 9.160 ( -2.447 -1.236 8.634) 9.059 9.292 ( 6.249 -9.965 -5.397) 12.941 9.461 ( 5.163 10.486 -6.597) 13.422 9.761 ( -0.279 -1.354 3.692) 3.942 10.072 ( 0.585 2.240 -3.904) 4.539 10.254 ( 3.903 11.656 1.599) 12.395 10.841 ( 2.116 -17.006 -0.925) 17.162 11.181 ( -1.040 1.489 2.150) 2.814 11.443 ( 1.502 -20.458 0.507) 20.519 11.522 ( 1.554 -2.574 -0.992) 3.166 12.101 ( 4.573 -4.803 4.689) 8.122 12.169 ( -5.351 6.734 -2.615) 8.990 12.552 ( -3.129 -9.450 -3.933) 10.703 12.834 ( -9.463 2.399 -1.304) 9.849 12.881 ( 8.870 8.436 -3.652) 12.774 13.776 ( -0.408 -2.480 -0.138) 2.517 13.932 ( -1.199 10.466 -2.525) 10.833 14.035 ( 2.047 -2.875 0.955) 3.657 14.125 ( -2.969 12.631 -1.493) 13.061 17.170 ( 0.254 -30.116 5.060) 30.539 18.794 ( -6.449 3.480 0.579) 7.351 19.049 ( 9.919 9.852 4.670) 14.740 19.335 ( -4.085 13.526 -4.999) 14.988 19.468 ( 0.693 10.654 -2.359) 10.934 22.880 ( 0.868 -14.506 0.355) 14.536 23.788 ( -1.167 -1.383 -0.359) 1.845 ======================= Grid point 778 (388/433) ======================= q-point: (-0.08 0.17 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.536 ( -2.818 6.274 -5.031) 8.521 2.975 ( 19.593 19.105 5.032) 27.825 3.992 ( -1.192 -2.329 -0.451) 2.655 4.946 ( 4.426 4.515 -0.436) 6.338 6.323 ( 2.404 10.175 -0.552) 10.469 7.459 ( -7.244 -2.248 -6.249) 9.827 7.629 ( 3.354 -11.103 1.411) 11.684 8.453 ( -2.915 8.621 3.068) 9.604 8.589 ( -6.119 -15.181 8.553) 18.468 8.848 ( -5.431 -5.008 9.349) 11.915 9.149 ( -5.312 7.645 2.057) 9.534 9.336 ( 0.081 -3.527 -10.299) 10.887 9.516 ( 10.498 -5.656 -12.053) 16.955 9.748 ( -3.903 -1.415 0.410) 4.172 10.071 ( 3.154 2.675 -1.491) 4.396 10.198 ( 5.186 11.393 -6.720) 14.207 10.882 ( -12.354 -14.169 -2.740) 18.997 11.226 ( 4.320 0.548 1.017) 4.472 11.498 ( -8.258 -10.349 -2.407) 13.457 11.608 ( -2.073 -9.796 -1.970) 10.205 12.065 ( 1.580 4.849 0.060) 5.101 12.222 ( 3.606 -0.414 0.571) 3.674 12.546 ( -5.247 1.496 3.414) 6.436 12.754 ( 2.758 -8.191 3.997) 9.522 13.024 ( 13.851 2.881 -1.839) 14.266 13.753 ( -3.009 9.618 3.693) 10.733 13.818 ( 0.132 1.868 -4.099) 4.507 13.937 ( -4.596 5.356 1.599) 7.237 14.143 ( 5.961 1.625 1.410) 6.337 17.344 ( -15.166 -25.920 0.724) 30.040 18.560 ( -14.726 6.449 5.267) 16.917 18.992 ( -1.216 10.224 -6.702) 12.285 19.350 ( 13.761 5.152 4.002) 15.229 19.548 ( 20.540 9.843 -2.473) 22.911 22.972 ( -4.463 -11.163 -1.785) 12.154 23.771 ( -2.922 -0.958 1.766) 3.546 ======================= Grid point 782 (389/433) ======================= q-point: ( 0.25 0.25 -0.55) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 432 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.433 ( 9.000 -0.000 -4.812) 10.206 3.443 ( -0.788 0.000 -8.499) 8.535 3.685 ( -8.483 0.000 7.399) 11.256 5.143 ( -3.420 0.000 0.279) 3.432 6.584 ( -9.432 0.000 4.525) 10.461 6.711 ( 7.525 -0.000 -1.147) 7.612 7.104 ( -4.146 0.000 12.091) 12.782 7.439 ( -8.223 0.000 -2.967) 8.742 8.423 ( -10.951 0.000 -4.161) 11.715 8.426 ( 8.744 -0.000 -15.189) 17.526 8.516 ( -4.970 0.000 -15.488) 16.266 8.823 ( -1.713 0.000 -1.427) 2.229 9.297 ( -0.949 0.000 -15.505) 15.534 9.488 ( 2.588 -0.000 -1.455) 2.969 9.891 ( 6.336 -0.000 1.823) 6.593 10.467 ( -3.967 0.000 2.516) 4.697 10.635 ( 7.411 -0.000 7.504) 10.547 11.322 ( 3.767 -0.000 5.878) 6.982 11.426 ( 2.553 -0.000 -0.771) 2.667 11.437 ( -0.325 0.000 -4.585) 4.596 11.855 ( -5.161 0.000 -3.052) 5.996 12.154 ( -7.741 0.000 -6.821) 10.317 12.528 ( -3.792 0.000 -5.643) 6.799 13.174 ( -1.942 0.000 13.214) 13.356 13.440 ( -5.694 0.000 -4.662) 7.359 13.486 ( -5.784 0.000 9.160) 10.833 14.311 ( 8.310 -0.000 4.154) 9.291 14.433 ( 10.924 -0.000 -1.474) 11.023 14.716 ( 2.287 -0.000 2.819) 3.630 15.178 ( -13.519 0.000 -8.815) 16.139 18.555 ( 8.109 -0.000 8.764) 11.940 18.902 ( -1.208 0.000 8.062) 8.152 20.778 ( 4.808 -0.000 -4.853) 6.832 21.176 ( 19.466 -0.000 -8.842) 21.380 21.449 ( -25.083 0.000 -1.183) 25.111 23.812 ( 3.252 -0.000 3.542) 4.809 ======================= Grid point 783 (390/433) ======================= q-point: ( 0.33 0.25 -0.55) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.278 ( -2.730 26.505 1.230) 26.673 3.424 ( 0.626 1.497 1.941) 2.530 3.781 ( -2.496 -23.366 1.599) 23.553 5.120 ( 1.116 -0.937 -1.639) 2.193 6.476 ( -6.546 -1.418 5.287) 8.533 6.828 ( 5.970 9.325 6.722) 12.953 7.094 ( -5.662 -11.443 6.257) 14.218 7.458 ( 5.549 -4.276 3.663) 7.905 8.091 ( -12.402 2.922 -11.445) 17.127 8.467 ( 6.447 -1.158 -13.404) 14.919 8.517 ( 5.050 -0.609 -7.907) 9.402 8.855 ( 4.391 0.361 3.435) 5.587 9.202 ( 1.356 0.625 -14.717) 14.792 9.537 ( 4.809 1.780 -0.858) 5.199 10.061 ( 8.831 -1.231 7.146) 11.427 10.412 ( -3.569 0.805 2.454) 4.405 10.738 ( -0.752 -0.105 7.039) 7.080 11.267 ( -10.108 7.819 -4.875) 13.678 11.433 ( 3.141 -0.042 3.111) 4.421 11.447 ( 1.442 0.988 -0.817) 1.929 11.750 ( -3.730 1.594 -3.334) 5.251 12.101 ( 4.406 0.046 0.316) 4.418 12.444 ( -5.809 -7.657 -8.586) 12.888 13.169 ( -7.082 -3.536 7.448) 10.869 13.343 ( -4.694 0.318 -1.466) 4.927 13.435 ( -6.512 -1.583 7.885) 10.348 14.411 ( 5.061 2.915 -3.050) 6.589 14.543 ( 3.355 2.185 -4.412) 5.957 14.749 ( 1.590 0.342 0.201) 1.638 15.057 ( 1.181 -2.768 1.403) 3.321 18.727 ( 7.485 4.858 8.576) 12.376 18.952 ( 0.325 -4.849 6.026) 7.741 20.729 ( -5.297 1.420 -9.028) 10.563 21.081 ( -18.766 1.966 6.468) 19.947 21.416 ( 15.177 -2.635 -11.327) 19.120 23.877 ( 2.901 0.472 0.989) 3.101 ======================= Grid point 784 (391/433) ======================= q-point: (-0.58 0.25 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.982 ( -3.818 25.065 5.905) 26.033 3.475 ( 2.791 1.575 9.317) 9.853 3.955 ( -1.661 -17.251 0.186) 17.332 5.175 ( 5.140 -0.865 -2.068) 5.607 6.474 ( -1.288 -4.499 5.191) 6.989 6.811 ( -0.987 6.775 10.647) 12.658 7.245 ( 5.214 -7.051 4.493) 9.853 7.652 ( 3.821 -12.385 -1.731) 13.076 7.912 ( 2.428 2.623 -1.429) 3.849 8.518 ( 5.300 -2.480 -10.197) 11.756 8.567 ( 5.296 -1.251 -5.677) 7.863 8.964 ( 6.959 2.989 4.079) 8.602 9.170 ( 3.729 -1.602 -10.199) 10.977 9.600 ( 5.302 3.078 2.157) 6.499 10.234 ( 4.905 3.816 9.988) 11.764 10.381 ( -0.885 -0.980 1.334) 1.877 10.708 ( -6.991 -0.142 6.820) 9.768 10.905 ( -14.748 10.700 -7.310) 19.632 11.427 ( -0.907 1.459 0.218) 1.732 11.553 ( 5.547 -0.950 4.417) 7.154 11.663 ( -2.573 1.770 -3.224) 4.489 12.211 ( 5.865 1.135 1.545) 6.171 12.390 ( -4.174 -11.590 -9.874) 15.788 13.146 ( -5.562 -6.327 5.951) 10.314 13.245 ( -4.560 0.744 -1.763) 4.945 13.411 ( -5.239 -4.322 7.031) 9.776 14.390 ( 1.563 5.999 -7.767) 9.937 14.472 ( -2.922 2.763 -5.627) 6.916 14.769 ( 0.908 -0.298 -2.365) 2.551 15.236 ( 10.998 -3.965 7.050) 13.652 18.792 ( 3.462 8.062 6.449) 10.889 19.075 ( 3.883 -4.968 2.827) 6.910 20.509 ( -13.295 1.011 -1.776) 13.452 20.843 ( -12.117 4.873 4.454) 13.799 21.606 ( 11.718 -6.268 -12.329) 18.127 23.902 ( 1.220 1.156 -1.654) 2.358 ======================= Grid point 785 (392/433) ======================= q-point: (-0.50 0.25 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.777 ( 1.178 21.745 9.618) 23.806 3.582 ( 3.249 1.537 13.352) 13.827 4.037 ( -3.785 -8.307 -0.309) 9.133 5.253 ( 5.248 1.548 -1.993) 5.823 6.542 ( -0.787 -4.845 4.131) 6.416 6.872 ( 4.706 -0.133 12.606) 13.456 7.387 ( 5.487 -3.081 -3.413) 7.159 7.772 ( 5.979 -5.592 -1.176) 8.271 8.124 ( 10.214 -11.061 6.805) 16.522 8.527 ( 0.799 0.595 -8.070) 8.131 8.649 ( 5.472 -1.548 -4.698) 7.376 9.075 ( 6.803 2.591 6.109) 9.503 9.241 ( 6.018 -4.493 -3.423) 8.253 9.688 ( 5.886 1.675 4.369) 7.519 10.220 ( -4.577 10.417 7.743) 13.763 10.389 ( -0.495 2.483 0.305) 2.551 10.590 ( -6.993 2.549 -2.236) 7.772 10.647 ( -5.593 -0.637 5.623) 7.957 11.391 ( -3.104 0.107 0.925) 3.241 11.571 ( -2.287 2.913 -1.115) 3.868 11.677 ( 3.347 -1.818 2.118) 4.358 12.252 ( -1.421 -6.720 -6.292) 9.316 12.421 ( 1.856 -5.277 -4.174) 6.980 13.129 ( -8.229 -3.558 5.891) 10.728 13.216 ( 2.260 -1.901 -1.855) 3.487 13.447 ( 0.130 -5.817 5.416) 7.950 14.259 ( -1.891 7.296 -12.780) 14.837 14.365 ( -3.642 3.032 -1.935) 5.118 14.746 ( -0.935 1.478 -3.871) 4.248 15.538 ( 12.896 -7.252 8.026) 16.832 18.797 ( 3.288 6.823 2.083) 7.855 19.168 ( 3.396 1.495 1.708) 4.085 20.288 ( -13.784 1.027 5.786) 14.985 20.597 ( -11.378 8.620 -0.835) 14.299 21.797 ( 9.338 -12.121 -9.975) 18.265 23.879 ( -0.505 1.370 -3.434) 3.731 ======================= Grid point 786 (393/433) ======================= q-point: (-0.42 0.25 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.722 ( 7.596 18.490 11.580) 23.101 3.700 ( 2.420 1.133 13.673) 13.931 3.970 ( -7.541 2.127 -1.213) 7.929 5.275 ( 2.406 5.219 -1.815) 6.027 6.578 ( -1.464 -2.888 2.444) 4.057 7.094 ( 8.900 -3.588 12.635) 15.866 7.464 ( 3.777 -3.403 -6.742) 8.444 7.973 ( 11.757 -2.690 1.898) 12.209 8.424 ( 0.567 -7.826 -0.607) 7.869 8.448 ( 1.961 -5.266 1.877) 5.924 8.703 ( 3.813 -0.130 -4.744) 6.088 9.210 ( 2.277 -1.305 10.414) 10.739 9.391 ( 6.297 -5.759 0.272) 8.538 9.807 ( 5.430 -2.970 -2.120) 6.542 10.061 ( -2.591 12.566 10.436) 16.539 10.321 ( -0.589 5.336 -2.665) 5.994 10.590 ( 2.508 -0.063 4.811) 5.425 10.621 ( -2.798 -5.591 4.562) 7.739 11.325 ( -6.242 -1.038 2.036) 6.647 11.515 ( -0.207 1.698 -2.746) 3.236 11.749 ( 0.964 -3.734 2.034) 4.360 12.247 ( -3.678 -11.473 -10.136) 15.744 12.466 ( 1.255 -2.207 -2.844) 3.813 13.058 ( -4.727 0.710 3.086) 5.690 13.241 ( -0.165 1.920 1.256) 2.301 13.604 ( 7.146 -6.938 3.887) 10.692 14.049 ( -4.456 7.494 -13.946) 16.447 14.271 ( -3.313 3.044 -0.467) 4.523 14.663 ( -2.481 4.350 -4.526) 6.750 15.891 ( 11.472 -13.581 8.476) 19.695 18.809 ( 5.516 4.791 -3.074) 7.926 19.191 ( 2.383 7.412 6.134) 9.912 20.076 ( -14.277 3.530 6.268) 15.987 20.296 ( -9.892 12.354 -5.864) 16.878 22.035 ( 7.268 -17.973 -5.283) 20.094 23.829 ( -1.309 0.783 -3.708) 4.010 ======================= Grid point 787 (394/433) ======================= q-point: (-0.33 0.25 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.794 ( 11.896 15.627 10.256) 22.156 3.713 ( -10.552 12.301 3.134) 16.507 3.823 ( 1.617 0.330 5.728) 5.961 5.217 ( -0.095 7.931 -1.502) 8.073 6.585 ( -0.575 -0.648 -0.244) 0.900 7.337 ( 7.959 -1.110 11.199) 13.784 7.475 ( -0.601 0.000 -4.248) 4.291 8.155 ( 4.529 -2.610 -3.638) 6.368 8.399 ( 0.193 -8.060 4.391) 9.181 8.677 ( 1.628 -5.024 5.401) 7.554 8.769 ( 7.438 -11.030 -8.343) 15.703 9.236 ( -7.610 0.026 11.652) 13.917 9.532 ( 4.498 -3.608 0.269) 5.772 9.848 ( 3.909 3.839 -4.987) 7.408 10.089 ( -0.318 0.129 11.494) 11.499 10.304 ( 8.809 4.212 -1.866) 9.941 10.567 ( -2.364 2.419 3.796) 5.085 10.818 ( 6.711 -13.794 2.861) 15.604 11.247 ( -5.591 -1.191 2.557) 6.262 11.491 ( 0.373 0.173 -3.231) 3.258 11.821 ( 0.551 -6.965 2.301) 7.356 12.229 ( -4.465 -11.048 -9.358) 15.151 12.464 ( -1.416 -2.586 -4.051) 5.010 12.992 ( -0.831 7.172 1.505) 7.375 13.189 ( -1.546 6.637 0.960) 6.882 13.793 ( 0.786 -3.104 -1.793) 3.669 13.858 ( 2.301 1.449 -6.241) 6.808 14.184 ( -2.904 4.386 -0.307) 5.269 14.531 ( -3.217 7.750 -3.787) 9.207 16.270 ( 7.351 -21.402 7.889) 23.965 18.851 ( 6.441 2.391 -6.277) 9.306 19.198 ( 2.583 10.709 12.728) 16.833 19.825 ( -11.408 8.154 3.099) 14.361 19.972 ( -7.546 14.545 -10.140) 19.270 22.304 ( 4.307 -20.919 -1.492) 21.410 23.786 ( -1.212 -0.283 -2.486) 2.780 ======================= Grid point 788 (395/433) ======================= q-point: (-0.25 0.25 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.881 ( 6.511 12.819 3.456) 14.787 3.400 ( -3.841 20.336 1.185) 20.730 3.902 ( 1.681 -1.565 4.731) 5.259 5.122 ( -0.200 8.583 -0.916) 8.635 6.564 ( 0.661 3.757 -2.124) 4.366 7.417 ( -0.674 2.487 -0.162) 2.582 7.499 ( 2.700 -1.137 4.653) 5.498 8.187 ( -5.167 -11.411 2.427) 12.759 8.563 ( 3.257 -6.164 4.586) 8.345 8.696 ( -1.627 -3.189 -3.744) 5.180 8.984 ( 2.604 -14.887 -4.919) 15.893 9.199 ( 0.170 -0.271 8.866) 8.872 9.601 ( 1.871 0.078 -2.272) 2.944 9.816 ( 0.137 7.145 -0.107) 7.147 10.094 ( -1.872 -0.048 2.753) 3.329 10.446 ( 6.370 7.654 2.770) 10.336 10.560 ( 0.559 -9.528 -3.840) 10.288 11.067 ( 2.368 -17.714 -0.301) 17.874 11.206 ( -1.338 0.386 2.988) 3.297 11.487 ( 0.982 -1.127 -2.730) 3.112 11.940 ( 1.417 -10.104 3.735) 10.865 12.198 ( -3.516 -6.013 -5.301) 8.754 12.442 ( -0.911 -2.542 -2.846) 3.923 12.904 ( -0.781 9.109 -0.380) 9.150 13.093 ( 1.812 10.322 -1.562) 10.595 13.721 ( -2.120 -2.463 -2.775) 4.273 13.963 ( -0.786 -3.901 1.570) 4.279 14.098 ( 1.795 6.730 -1.818) 7.199 14.375 ( -2.196 11.551 -0.925) 11.794 16.612 ( 0.004 -27.023 5.516) 27.580 18.846 ( -3.621 1.895 -2.138) 4.612 19.240 ( 5.824 10.334 11.680) 16.647 19.618 ( -1.820 15.099 -7.333) 16.884 19.686 ( 0.089 11.828 -4.191) 12.548 22.540 ( 0.249 -20.562 -0.138) 20.564 23.765 ( -1.144 -1.010 -0.441) 1.588 ======================= Grid point 789 (396/433) ======================= q-point: (-0.17 0.25 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.713 ( -6.819 11.704 -7.178) 15.330 3.355 ( 16.228 19.121 5.337) 25.641 3.948 ( -0.067 -1.973 -0.853) 2.150 5.057 ( 2.177 6.854 -0.202) 7.194 6.515 ( 2.184 8.234 -1.320) 8.620 7.401 ( -2.306 -1.832 -1.329) 3.231 7.516 ( -1.643 -2.158 -1.961) 3.347 8.257 ( -7.831 -15.776 9.307) 19.921 8.593 ( -2.183 4.255 -0.712) 4.835 8.704 ( -1.647 -9.489 2.549) 9.962 9.063 ( -2.516 -11.063 -5.396) 12.564 9.358 ( 8.119 -2.411 3.206) 9.056 9.534 ( -1.243 7.171 -9.306) 11.814 9.736 ( -4.011 1.347 0.700) 4.289 10.105 ( 2.296 0.455 1.556) 2.810 10.371 ( -3.678 5.136 -6.668) 9.185 10.642 ( -1.670 -7.671 -4.274) 8.938 11.186 ( -6.890 -16.140 -3.222) 17.843 11.246 ( 3.550 -0.604 2.522) 4.397 11.513 ( 1.555 -2.636 -2.391) 3.884 12.040 ( -1.579 -6.782 -2.615) 7.438 12.232 ( 4.337 -2.315 5.273) 7.210 12.470 ( 1.274 -4.396 1.374) 4.779 12.778 ( -2.808 8.490 1.113) 9.012 13.115 ( 11.552 6.032 -1.482) 13.116 13.731 ( -0.926 -3.608 0.779) 3.806 13.882 ( -7.760 -0.058 0.110) 7.761 14.100 ( 2.996 6.921 -0.877) 7.593 14.257 ( 2.037 11.052 2.905) 11.608 16.820 ( -10.164 -27.482 1.531) 29.341 18.672 ( -11.883 5.207 4.101) 13.606 19.202 ( -3.289 10.990 -6.784) 13.328 19.504 ( 9.828 10.871 5.498) 15.652 19.745 ( 19.080 10.283 -3.657) 21.980 22.690 ( -4.616 -18.016 -0.952) 18.622 23.754 ( -1.888 -0.746 1.680) 2.635 ======================= Grid point 790 (397/433) ======================= q-point: (-0.08 0.25 -0.55) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.521 ( 1.041 2.923 -9.729) 10.212 3.515 ( 19.447 17.337 3.207) 26.249 3.920 ( -2.451 -1.329 -6.671) 7.230 5.065 ( 4.524 3.496 0.417) 5.732 6.480 ( 4.097 9.266 1.430) 10.232 7.269 ( -8.451 1.454 -10.040) 13.204 7.546 ( -3.144 -9.265 1.532) 9.903 8.281 ( -12.245 -13.385 7.997) 19.825 8.480 ( -4.570 2.905 -4.124) 6.807 8.861 ( 5.414 -8.221 4.190) 10.698 9.018 ( -9.481 -3.643 -3.359) 10.698 9.301 ( -3.431 7.682 -6.455) 10.605 9.550 ( 4.454 -4.436 -6.008) 8.696 9.685 ( 1.549 0.305 -3.079) 3.460 10.136 ( -2.516 5.034 -6.935) 8.931 10.220 ( -3.050 -6.040 -0.131) 6.768 10.582 ( -5.893 -0.320 -7.164) 9.282 11.164 ( -8.959 -14.550 -3.836) 17.512 11.299 ( 1.273 1.827 0.141) 2.231 11.545 ( 0.353 -2.944 -2.220) 3.704 12.047 ( 0.231 -3.772 -5.358) 6.557 12.339 ( 4.532 2.190 1.480) 5.247 12.535 ( -0.694 0.562 6.068) 6.133 12.802 ( 6.198 -5.072 9.378) 12.332 13.283 ( 12.437 4.147 1.063) 13.154 13.701 ( -6.786 -1.141 3.306) 7.634 13.816 ( 1.463 -1.443 -4.313) 4.777 14.028 ( 0.130 13.218 5.791) 14.432 14.275 ( 5.023 3.025 2.506) 6.377 16.792 ( -21.177 -21.839 -4.257) 30.717 18.460 ( -9.065 7.309 6.334) 13.255 18.998 ( -3.300 8.208 -4.894) 10.110 19.684 ( 15.519 5.591 6.307) 17.660 20.008 ( 24.888 8.691 -4.650) 26.769 22.710 ( -10.315 -14.199 -3.159) 17.833 23.732 ( -2.833 0.187 3.541) 4.538 ======================= Grid point 795 (398/433) ======================= q-point: ( 0.33 0.33 -0.55) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 433 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.363 ( -10.699 0.000 8.065) 13.398 3.498 ( 1.982 -0.000 8.498) 8.726 3.645 ( 7.272 -0.000 -2.911) 7.833 5.167 ( 6.029 -0.000 -1.742) 6.276 6.429 ( -2.249 0.000 6.015) 6.421 6.898 ( -8.263 0.000 8.234) 11.666 7.165 ( 14.305 -0.000 11.817) 18.554 7.515 ( 2.303 -0.000 -3.787) 4.432 7.945 ( -0.486 0.000 -2.659) 2.703 8.488 ( 6.533 -0.000 -11.534) 13.256 8.553 ( 4.715 -0.000 -6.458) 7.996 8.993 ( 7.558 -0.000 5.227) 9.190 9.156 ( 3.536 -0.000 -13.794) 14.240 9.636 ( 6.024 -0.000 0.037) 6.024 10.257 ( 7.661 -0.000 11.195) 13.566 10.382 ( -2.281 0.000 2.658) 3.503 10.708 ( -7.276 0.000 6.507) 9.761 11.032 ( -18.040 0.000 -4.160) 18.513 11.421 ( -2.719 0.000 -1.297) 3.012 11.553 ( 8.218 -0.000 1.783) 8.409 11.682 ( -2.897 0.000 -2.915) 4.110 12.239 ( -7.037 0.000 -10.711) 12.816 12.253 ( 9.987 -0.000 2.817) 10.377 13.083 ( -5.180 0.000 5.837) 7.804 13.256 ( -5.117 0.000 -0.990) 5.212 13.359 ( -5.651 0.000 6.248) 8.424 14.440 ( 1.693 -0.000 -13.329) 13.436 14.533 ( -2.027 0.000 0.459) 2.079 14.736 ( -2.240 0.000 0.211) 2.250 15.203 ( 12.408 -0.000 4.798) 13.303 18.933 ( -0.982 0.000 2.144) 2.358 18.964 ( 9.262 -0.000 9.743) 13.443 20.519 ( -13.919 0.000 -2.070) 14.072 20.895 ( -10.798 0.000 4.048) 11.532 21.541 ( 10.835 -0.000 -14.284) 17.928 23.914 ( 1.153 -0.000 -1.337) 1.765 ======================= Grid point 796 (399/433) ======================= q-point: (-0.58 0.33 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.177 ( -3.491 16.586 8.480) 18.952 3.606 ( 3.428 0.768 11.673) 12.190 3.818 ( 3.808 -11.739 -0.967) 12.379 5.278 ( 7.931 0.786 -1.306) 8.076 6.465 ( 0.219 -2.435 5.673) 6.177 6.863 ( -1.738 -0.530 10.281) 10.440 7.414 ( 7.532 5.888 0.393) 9.568 7.590 ( 8.139 -11.202 2.676) 14.103 8.022 ( 6.655 -1.367 4.207) 7.991 8.533 ( 5.220 0.607 -8.944) 10.373 8.607 ( 5.664 -2.222 -5.725) 8.354 9.132 ( 6.346 2.550 2.102) 7.155 9.176 ( 5.887 -2.396 -5.145) 8.177 9.725 ( 4.694 1.615 1.831) 5.291 10.352 ( -2.356 3.181 6.337) 7.472 10.422 ( 3.572 0.880 7.815) 8.637 10.589 ( -11.964 -0.781 5.621) 13.242 10.711 ( -11.425 4.063 -2.124) 12.310 11.355 ( -5.080 -2.446 -2.891) 6.336 11.616 ( -2.607 1.217 -2.240) 3.646 11.683 ( 6.061 1.605 1.063) 6.360 12.087 ( -6.418 -6.468 -11.323) 14.534 12.414 ( 6.959 1.252 2.205) 7.406 13.042 ( -7.621 -3.015 9.551) 12.585 13.222 ( 4.677 0.601 -4.425) 6.467 13.350 ( -1.057 -3.221 5.578) 6.528 14.343 ( -1.190 1.515 -15.098) 15.221 14.467 ( -3.580 6.187 1.462) 7.296 14.704 ( -3.802 -4.273 -1.330) 5.872 15.458 ( 12.940 -1.594 5.190) 14.033 18.903 ( 0.493 3.423 -1.318) 3.700 19.176 ( 7.620 -0.268 8.917) 11.732 20.299 ( -13.980 0.208 7.062) 15.664 20.727 ( -8.649 4.052 -0.923) 9.596 21.619 ( 6.869 -5.395 -15.019) 17.374 23.898 ( -1.014 0.550 -3.062) 3.272 ======================= Grid point 797 (400/433) ======================= q-point: (-0.50 0.33 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 794 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.073 ( 3.889 16.436 8.894) 19.088 3.721 ( 2.696 0.912 11.637) 11.980 3.933 ( 0.047 -5.147 -0.763) 5.204 5.367 ( 5.743 4.024 -1.023) 7.087 6.522 ( -0.339 -2.558 4.306) 5.020 6.987 ( 4.828 -5.826 10.660) 13.073 7.434 ( 3.753 0.083 -7.033) 7.973 7.905 ( 12.955 -4.358 9.064) 16.400 8.202 ( 6.163 -8.130 3.605) 10.820 8.509 ( 0.521 4.898 -7.546) 9.012 8.701 ( 5.904 -1.670 -4.725) 7.745 9.205 ( 3.176 0.962 3.848) 5.081 9.297 ( 5.139 -3.452 1.673) 6.413 9.776 ( 1.945 -0.246 -0.758) 2.102 10.248 ( -6.297 7.555 4.985) 11.026 10.440 ( -1.955 4.411 7.356) 8.797 10.501 ( -1.009 -3.292 0.766) 3.528 10.621 ( -1.379 0.452 6.058) 6.230 11.265 ( -7.513 -4.650 -3.242) 9.411 11.547 ( -2.092 1.580 -2.254) 3.457 11.727 ( 1.216 1.429 -0.041) 1.877 12.017 ( -4.426 -10.773 -10.679) 15.802 12.463 ( 0.297 0.777 -2.185) 2.338 13.043 ( -1.792 -0.824 12.057) 12.218 13.298 ( 7.227 2.845 -3.470) 8.507 13.468 ( 5.757 -6.483 5.089) 10.054 14.183 ( -3.637 5.531 -15.321) 16.690 14.345 ( -4.272 4.993 1.227) 6.685 14.662 ( -4.860 -4.089 -2.713) 6.907 15.714 ( 9.944 -5.095 5.771) 12.575 18.879 ( 2.375 2.445 -4.414) 5.577 19.318 ( 5.706 5.206 9.661) 12.369 20.124 ( -12.541 1.544 8.980) 15.502 20.516 ( -6.886 9.725 -4.477) 12.729 21.719 ( 4.287 -13.755 -11.584) 18.488 23.843 ( -2.240 0.572 -3.500) 4.195 ======================= Grid point 798 (401/433) ======================= q-point: (-0.42 0.33 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.084 ( 8.175 13.691 7.451) 17.601 3.812 ( 1.364 0.939 9.674) 9.815 3.897 ( -3.355 4.473 -1.942) 5.919 5.369 ( 1.923 7.533 -0.767) 7.812 6.557 ( 0.057 -1.675 1.941) 2.565 7.218 ( 5.382 -9.162 9.210) 14.061 7.459 ( 1.812 -1.963 -4.319) 5.079 8.175 ( 11.303 -1.506 2.589) 11.693 8.362 ( -4.938 7.922 -3.295) 9.899 8.429 ( 6.087 -12.929 2.249) 14.466 8.755 ( 3.634 1.727 -3.565) 5.375 9.229 ( -5.405 -0.124 9.963) 11.335 9.432 ( 4.383 -6.071 0.701) 7.520 9.811 ( 2.886 -3.664 -5.307) 7.066 10.149 ( -2.809 4.075 5.401) 7.325 10.429 ( 3.038 6.350 5.577) 8.980 10.565 ( 0.660 -4.821 0.708) 4.917 10.665 ( 3.348 -0.041 5.960) 6.836 11.177 ( -6.933 -6.221 -1.039) 9.373 11.497 ( -0.662 0.631 -2.892) 3.033 11.724 ( -1.103 -2.521 -0.661) 2.830 12.004 ( -2.945 -11.222 -8.825) 14.577 12.417 ( -2.943 -2.330 -4.708) 6.022 13.121 ( 4.361 6.250 11.839) 14.080 13.324 ( 3.444 6.841 -2.469) 8.047 13.682 ( 6.303 -6.999 3.567) 10.072 13.948 ( -5.487 6.400 -13.097) 15.575 14.258 ( -2.086 3.383 0.022) 3.974 14.592 ( -4.627 -1.698 -2.787) 5.662 15.954 ( 5.267 -11.092 6.084) 13.704 18.882 ( 3.162 1.029 -5.322) 6.275 19.393 ( 4.110 8.941 12.040) 15.550 19.954 ( -8.304 5.225 4.801) 10.922 20.258 ( -5.397 14.800 -7.971) 17.655 21.892 ( 2.323 -20.995 -5.660) 21.868 23.784 ( -2.043 0.035 -2.475) 3.210 ======================= Grid point 799 (402/433) ======================= q-point: (-0.33 0.33 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 794 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.121 ( 4.780 11.489 2.077) 12.615 3.726 ( -2.762 13.028 1.517) 13.404 3.888 ( 2.238 0.146 2.945) 3.702 5.293 ( -0.404 9.003 -0.315) 9.017 6.584 ( 1.494 -0.590 -0.792) 1.791 7.388 ( -1.673 -7.368 4.537) 8.813 7.482 ( 1.254 -1.714 0.351) 2.152 8.156 ( -3.689 8.896 -1.300) 9.718 8.382 ( 5.021 -8.670 -1.132) 10.082 8.637 ( -1.214 -10.302 3.320) 10.892 8.770 ( 4.569 -1.356 -6.839) 8.336 9.201 ( -2.313 0.064 10.026) 10.289 9.539 ( 0.846 -5.488 0.017) 5.552 9.844 ( -2.559 -4.523 -2.872) 5.938 10.125 ( 0.864 3.543 3.419) 4.999 10.480 ( 3.970 2.284 0.905) 4.669 10.573 ( -0.207 2.117 0.936) 2.324 10.800 ( 4.016 -8.277 -1.180) 9.275 11.164 ( -1.929 -5.648 2.703) 6.552 11.477 ( 0.799 0.075 -3.253) 3.351 11.757 ( -0.434 -7.637 1.170) 7.738 12.028 ( -1.150 -9.995 -5.575) 11.503 12.387 ( -0.327 -3.179 -3.606) 4.818 13.150 ( 3.043 14.425 5.503) 15.736 13.269 ( 1.202 8.219 -1.892) 8.519 13.692 ( -4.514 -0.623 -4.772) 6.598 13.884 ( -0.168 -3.976 0.581) 4.022 14.206 ( 1.302 4.497 -1.462) 4.905 14.521 ( -1.907 2.794 -0.478) 3.417 16.170 ( -0.457 -18.065 5.150) 18.791 18.870 ( -1.989 0.731 -2.631) 3.379 19.435 ( 3.150 9.387 11.016) 14.812 19.851 ( 3.515 8.797 0.202) 9.475 19.968 ( -3.617 17.523 -9.263) 20.148 22.108 ( -0.483 -23.840 -1.430) 23.887 23.750 ( -1.144 -0.484 -0.484) 1.333 ======================= Grid point 800 (403/433) ======================= q-point: (-0.25 0.33 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.964 ( -6.594 13.767 -6.980) 16.785 3.669 ( 9.196 12.801 4.864) 16.495 3.925 ( 1.536 -0.187 -1.979) 2.513 5.201 ( -0.211 7.974 0.190) 7.979 6.606 ( 2.844 1.556 -2.490) 4.087 7.391 ( -4.243 -2.514 4.327) 6.561 7.482 ( -4.222 -1.923 -4.128) 6.210 8.066 ( -4.480 -1.287 5.034) 6.861 8.504 ( -0.132 -9.196 -4.019) 10.037 8.636 ( -2.913 -2.147 3.513) 5.044 8.836 ( 0.336 -9.854 -9.654) 13.799 9.315 ( 7.508 -1.531 6.390) 9.977 9.561 ( -2.447 -3.415 -2.841) 5.072 9.766 ( -8.749 -2.377 -0.086) 9.066 10.131 ( 0.792 4.468 5.699) 7.285 10.402 ( -6.502 1.603 -9.875) 11.931 10.629 ( 7.433 2.046 -1.871) 7.933 10.893 ( -2.813 -11.856 -5.505) 13.371 11.238 ( 3.036 -2.224 3.984) 5.480 11.483 ( 1.713 -0.553 -2.737) 3.276 11.866 ( 1.368 -10.031 0.699) 10.148 12.101 ( 1.346 -9.024 1.353) 9.223 12.419 ( 1.847 -2.135 -0.291) 2.838 13.019 ( -0.965 15.171 -1.338) 15.260 13.232 ( 5.664 5.690 -2.063) 8.289 13.674 ( -0.027 -1.762 4.131) 4.491 13.842 ( -8.416 -3.544 0.010) 9.131 14.203 ( 4.172 4.588 -2.191) 6.577 14.465 ( 0.439 8.375 3.013) 8.911 16.329 ( -7.273 -22.518 2.184) 23.764 18.758 ( -8.111 3.646 2.355) 9.200 19.398 ( -2.698 9.202 -3.069) 10.069 19.766 ( 5.084 16.217 3.202) 17.295 19.929 ( 16.586 8.625 -3.961) 19.110 22.292 ( -4.516 -22.947 -0.132) 23.388 23.744 ( -0.761 -0.270 1.650) 1.837 ======================= Grid point 801 (404/433) ======================= q-point: (-0.17 0.33 -0.55) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 794 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.664 ( -4.986 11.559 -11.278) 16.902 3.782 ( 11.129 8.791 5.687) 15.280 3.912 ( 1.733 1.668 -8.285) 8.627 5.148 ( 1.240 5.011 0.566) 5.193 6.617 ( 3.629 4.326 -1.901) 5.958 7.319 ( -7.193 3.096 -7.685) 10.972 7.395 ( -6.393 -7.115 4.237) 10.462 8.045 ( -7.651 -8.596 3.677) 12.081 8.493 ( -4.629 -2.365 -0.556) 5.228 8.710 ( 4.554 -6.124 -0.189) 7.634 8.850 ( -4.278 -11.258 -9.266) 15.195 9.450 ( -7.600 3.800 -3.802) 9.309 9.470 ( 2.987 -4.464 -4.644) 7.100 9.690 ( -1.365 -1.501 6.316) 6.634 10.095 ( -10.371 -0.473 0.597) 10.399 10.223 ( 1.442 3.867 -8.524) 9.471 10.662 ( 2.363 5.683 -8.961) 10.871 10.892 ( -5.095 -12.836 -4.240) 14.447 11.321 ( 2.373 0.464 2.442) 3.437 11.506 ( 1.566 -1.044 -1.839) 2.632 11.953 ( 1.670 -6.026 -6.165) 8.781 12.272 ( 2.866 -8.985 7.668) 12.155 12.473 ( 1.049 -3.941 2.959) 5.038 12.889 ( 2.154 10.684 2.130) 11.105 13.344 ( 12.220 1.446 -1.471) 12.393 13.674 ( -8.096 -0.752 5.175) 9.638 13.776 ( 0.347 -2.422 0.557) 2.510 14.210 ( 3.228 5.299 -0.225) 6.209 14.406 ( 0.472 10.036 5.122) 11.277 16.362 ( -14.897 -21.841 -2.761) 26.582 18.598 ( -7.114 6.752 5.471) 11.231 19.177 ( -5.181 10.032 -8.091) 13.891 19.835 ( 11.176 9.914 9.257) 17.575 20.163 ( 23.140 7.315 -5.817) 24.956 22.380 ( -9.597 -19.836 -1.008) 22.059 23.742 ( -1.210 0.754 3.372) 3.661 ======================= Grid point 802 (405/433) ======================= q-point: (-0.08 0.33 -0.55) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.510 ( 2.845 1.310 -11.463) 11.883 3.802 ( -4.179 -1.125 -7.656) 8.794 3.957 ( 14.441 11.368 -0.183) 18.380 5.149 ( 1.766 1.608 1.279) 2.710 6.627 ( 3.891 5.259 -0.101) 6.543 7.086 ( -8.765 3.168 -12.215) 15.364 7.378 ( -9.457 -6.682 8.330) 14.264 8.028 ( -6.557 -11.029 -1.292) 12.896 8.422 ( -1.567 3.253 -2.900) 4.631 8.757 ( -9.084 -4.598 -7.052) 12.385 8.854 ( -0.001 -11.352 -3.136) 11.778 9.211 ( -8.645 2.848 -8.477) 12.438 9.498 ( -1.827 -4.480 -1.861) 5.184 9.783 ( -2.051 -3.973 2.114) 4.946 9.849 ( -5.042 3.542 -9.046) 10.945 10.274 ( 5.417 -0.126 2.759) 6.081 10.502 ( -6.066 5.374 -7.396) 10.972 10.957 ( 2.272 -9.173 -4.486) 10.461 11.314 ( -1.896 2.465 -0.825) 3.217 11.522 ( 0.063 -0.566 -0.709) 0.910 11.973 ( 0.285 -4.172 -8.595) 9.558 12.355 ( -1.849 -3.386 0.216) 3.864 12.598 ( 4.105 -3.547 7.412) 9.185 12.958 ( 7.924 0.359 8.668) 11.750 13.512 ( 3.903 6.767 5.280) 9.429 13.592 ( -0.843 -6.104 2.105) 6.512 13.833 ( 4.527 -0.828 -3.153) 5.578 14.196 ( 1.423 10.653 5.957) 12.288 14.381 ( 1.861 2.531 4.138) 5.195 16.213 ( -20.896 -16.162 -8.155) 27.647 18.470 ( -3.507 8.120 5.527) 10.430 18.998 ( -2.673 6.624 -1.547) 7.308 20.026 ( 14.198 4.834 7.300) 16.681 20.455 ( 23.853 6.459 -6.641) 25.589 22.332 ( -15.392 -15.433 -2.878) 21.986 23.730 ( -1.440 1.708 4.486) 5.012 ======================= Grid point 808 (406/433) ======================= q-point: (-0.58 0.42 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 432 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.261 ( -0.981 0.000 7.806) 7.868 3.730 ( 2.776 -0.000 10.972) 11.318 3.854 ( 6.042 -0.000 -0.596) 6.071 5.410 ( 7.287 -0.000 -0.670) 7.318 6.494 ( 0.510 -0.000 4.839) 4.866 6.924 ( 2.565 -0.000 10.492) 10.801 7.440 ( 1.752 -0.000 -10.251) 10.400 7.852 ( 15.779 -0.000 15.447) 22.082 8.126 ( 4.412 -0.000 1.858) 4.787 8.585 ( 4.970 -0.000 -8.148) 9.544 8.654 ( 5.861 -0.000 -4.154) 7.184 9.215 ( 6.546 -0.000 -5.457) 8.522 9.271 ( 1.973 -0.000 7.667) 7.917 9.780 ( 0.315 -0.000 -0.747) 0.811 10.374 ( -0.632 0.000 3.499) 3.556 10.382 ( -12.678 0.000 4.311) 13.391 10.519 ( -0.147 0.000 10.704) 10.705 10.630 ( -1.162 0.000 3.675) 3.854 11.205 ( -6.966 0.000 -8.146) 10.718 11.566 ( -2.901 0.000 -0.556) 2.954 11.766 ( 2.271 -0.000 -1.391) 2.663 11.887 ( -5.346 0.000 -9.956) 11.301 12.473 ( -1.842 0.000 -2.734) 3.297 13.039 ( 2.390 -0.000 14.634) 14.828 13.328 ( 9.013 -0.000 -3.985) 9.855 13.395 ( 4.528 -0.000 5.108) 6.826 14.236 ( -2.109 0.000 -14.493) 14.645 14.433 ( -5.600 0.000 0.300) 5.608 14.579 ( -6.377 0.000 -1.458) 6.541 15.671 ( 9.690 -0.000 4.672) 10.758 18.903 ( 1.017 -0.000 -4.916) 5.021 19.371 ( 7.222 -0.000 10.766) 12.964 20.138 ( -11.911 0.000 10.189) 15.674 20.622 ( -5.405 0.000 -2.045) 5.778 21.571 ( 2.617 -0.000 -15.859) 16.074 23.849 ( -2.579 0.000 -3.430) 4.292 ======================= Grid point 810 (407/433) ======================= q-point: (-0.50 0.42 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.282 ( 2.950 5.884 5.088) 8.319 3.826 ( 1.950 0.457 8.321) 8.558 3.935 ( 2.615 0.243 -0.433) 2.662 5.483 ( 3.426 3.593 -0.094) 4.966 6.532 ( 0.729 -0.770 2.752) 2.949 7.070 ( 4.022 -4.674 9.931) 11.690 7.414 ( 0.649 -1.826 -7.644) 7.886 8.159 ( 8.522 1.350 5.739) 10.362 8.236 ( 7.473 -6.794 4.950) 11.248 8.554 ( 1.553 8.152 -6.633) 10.624 8.748 ( 4.882 -2.620 -3.343) 6.471 9.257 ( -3.775 2.894 6.780) 8.282 9.327 ( 2.613 -4.394 0.483) 5.135 9.766 ( 0.205 -1.009 -2.939) 3.114 10.228 ( -4.741 3.843 2.791) 6.711 10.412 ( -0.819 -4.556 3.254) 5.658 10.560 ( 0.308 1.569 7.980) 8.139 10.696 ( 4.711 1.847 6.438) 8.188 11.053 ( -6.959 -4.662 -8.500) 11.933 11.520 ( -1.824 1.235 0.812) 2.347 11.723 ( -2.000 2.319 -4.434) 5.389 11.820 ( -2.293 -7.646 -7.265) 10.794 12.383 ( -4.198 -1.022 -4.971) 6.586 13.231 ( 9.216 4.438 15.927) 18.928 13.424 ( 5.846 3.010 -2.934) 7.200 13.553 ( 6.897 -5.261 4.159) 9.620 14.068 ( -5.747 4.608 -15.005) 16.716 14.320 ( -3.747 3.210 0.341) 4.946 14.496 ( -6.269 -6.125 -1.683) 8.925 15.830 ( 4.617 -2.595 4.851) 7.182 18.894 ( 1.508 0.261 -4.658) 4.903 19.518 ( 4.820 3.519 9.858) 11.524 20.022 ( -6.798 1.787 6.394) 9.502 20.504 ( -3.086 8.771 -2.082) 9.528 21.556 ( 0.124 -11.355 -11.658) 16.274 23.785 ( -2.510 0.056 -2.472) 3.523 ======================= Grid point 811 (408/433) ======================= q-point: (-0.42 0.42 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.299 ( 3.127 6.647 0.958) 7.408 3.877 ( -0.595 2.252 4.932) 5.454 3.925 ( 1.497 4.093 -1.105) 4.496 5.453 ( -0.717 6.967 0.515) 7.022 6.568 ( 1.902 -0.774 -0.211) 2.064 7.223 ( -0.992 -7.743 8.118) 11.262 7.407 ( -0.719 -4.905 -4.302) 6.564 8.253 ( 2.778 -4.054 -2.758) 5.635 8.400 ( -1.948 7.853 0.259) 8.095 8.471 ( 5.631 -0.214 -1.271) 5.777 8.789 ( 1.238 0.316 -3.331) 3.568 9.205 ( -2.661 0.909 9.463) 9.872 9.412 ( -0.138 -6.627 0.210) 6.632 9.759 ( -3.448 -2.955 -0.277) 4.549 10.188 ( 3.220 3.109 -1.296) 4.660 10.475 ( 0.342 -5.131 3.324) 6.123 10.591 ( 0.947 3.008 2.582) 4.076 10.774 ( 3.656 2.439 1.028) 4.513 11.001 ( -2.889 -9.418 -1.428) 9.954 11.496 ( 0.546 1.929 -0.179) 2.013 11.669 ( -0.904 -1.719 -2.175) 2.916 11.841 ( 0.075 -9.068 -5.284) 10.495 12.336 ( 0.602 -1.898 -4.377) 4.809 13.374 ( 3.349 7.632 5.981) 10.258 13.440 ( 5.037 9.422 4.013) 11.413 13.671 ( -2.719 -2.512 -2.045) 4.229 13.839 ( -5.246 0.412 -6.949) 8.717 14.273 ( 1.180 2.564 -1.229) 3.079 14.478 ( -1.857 -6.114 -0.004) 6.390 15.934 ( -0.881 -6.849 4.606) 8.300 18.878 ( -1.177 0.195 -2.478) 2.751 19.582 ( 1.827 5.480 7.367) 9.362 19.978 ( 3.351 4.474 0.735) 5.638 20.314 ( -2.105 17.280 -3.547) 17.765 21.661 ( -1.380 -21.173 -4.157) 21.622 23.745 ( -1.155 -0.149 -0.504) 1.269 ======================= Grid point 812 (409/433) ======================= q-point: (-0.33 0.42 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.212 ( -3.004 11.309 -5.538) 12.946 3.834 ( 0.368 4.907 3.540) 6.062 3.942 ( 3.291 1.405 -2.642) 4.448 5.354 ( -2.637 7.540 0.843) 8.032 6.608 ( 3.434 -0.624 -3.229) 4.755 7.261 ( -7.811 -8.687 5.632) 12.969 7.422 ( -2.323 -4.679 -2.223) 5.678 8.178 ( -6.516 7.883 0.261) 10.231 8.392 ( 5.745 -1.723 -5.269) 7.983 8.494 ( -4.677 -7.498 -2.509) 9.187 8.767 ( -0.709 -0.290 -4.925) 4.985 9.296 ( 5.972 -0.344 6.362) 8.733 9.442 ( -4.207 -8.048 0.102) 9.082 9.690 ( -8.965 -3.011 3.407) 10.052 10.228 ( 5.630 4.074 -2.021) 7.237 10.488 ( -5.708 5.989 -0.250) 8.277 10.587 ( 3.374 -4.832 -2.397) 6.362 10.793 ( 2.312 -0.115 -6.897) 7.275 11.120 ( 3.396 -10.096 4.765) 11.669 11.494 ( 2.140 1.812 -2.090) 3.497 11.712 ( 1.921 -5.120 2.079) 5.851 11.927 ( 2.099 -8.633 -1.962) 9.099 12.381 ( 4.254 -1.703 -1.878) 4.952 13.296 ( -4.200 10.259 -1.608) 11.201 13.339 ( -0.845 7.766 -6.880) 10.410 13.670 ( 2.961 0.724 7.643) 8.229 13.763 ( -8.319 -3.828 1.095) 9.222 14.280 ( 3.694 3.338 -2.235) 5.457 14.537 ( 2.293 -1.167 2.828) 3.823 15.990 ( -6.125 -12.194 2.822) 13.935 18.812 ( -4.745 2.031 0.984) 5.254 19.548 ( -2.475 6.231 -0.782) 6.750 20.065 ( 13.704 6.265 -5.842) 16.161 20.115 ( 2.306 18.491 3.659) 18.990 21.831 ( -4.017 -24.085 0.528) 24.424 23.742 ( 0.146 0.032 1.661) 1.668 ======================= Grid point 813 (410/433) ======================= q-point: (-0.25 0.42 -0.55) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.938 ( -6.224 16.022 -10.293) 20.034 3.843 ( -0.181 0.471 0.864) 1.000 3.978 ( 6.695 2.059 -3.749) 7.945 5.251 ( -2.429 5.431 0.794) 6.002 6.652 ( 4.354 -0.073 -5.155) 6.748 7.228 ( -10.049 -9.470 3.056) 14.142 7.362 ( -5.265 0.263 -1.566) 5.499 7.995 ( -8.813 2.051 -0.510) 9.063 8.425 ( -0.124 -2.520 -1.411) 2.891 8.548 ( 0.835 -11.764 -4.576) 12.650 8.713 ( -2.504 -2.126 -6.897) 7.640 9.359 ( -4.547 -7.115 -3.494) 9.138 9.440 ( -5.207 -3.382 -5.120) 8.048 9.637 ( -1.633 -1.223 13.328) 13.483 10.230 ( -4.158 10.495 4.875) 12.296 10.290 ( 0.545 3.748 -10.999) 11.633 10.695 ( 2.008 -7.397 -4.728) 9.006 10.752 ( 1.811 3.137 -9.850) 10.495 11.297 ( 4.059 -3.988 5.013) 7.584 11.507 ( 2.674 1.209 -1.917) 3.505 11.825 ( 3.467 -6.450 -2.476) 7.730 12.061 ( 2.509 -10.994 6.164) 12.851 12.437 ( 0.835 -0.235 -0.314) 0.922 13.099 ( -2.160 9.886 -2.574) 10.441 13.330 ( 6.070 -2.325 -5.792) 8.706 13.647 ( -8.816 -3.923 0.238) 9.652 13.772 ( 3.538 3.836 12.221) 13.288 14.290 ( 3.260 3.810 -2.073) 5.426 14.571 ( 0.981 5.559 4.921) 7.489 15.992 ( -10.922 -15.810 -1.137) 19.249 18.713 ( -4.403 5.071 4.208) 7.925 19.363 ( -6.184 8.805 -8.497) 13.710 20.058 ( 7.032 13.199 7.851) 16.891 20.286 ( 20.636 5.563 -5.410) 22.047 21.967 ( -8.187 -22.563 1.741) 24.066 23.759 ( 0.383 0.968 3.265) 3.427 ======================= Grid point 814 (411/433) ======================= q-point: (-0.17 0.42 -0.55) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.649 ( -2.333 12.743 -11.548) 17.354 3.785 ( -4.318 -0.563 -6.825) 8.096 4.090 ( 9.495 2.104 0.066) 9.726 5.186 ( -1.531 2.112 0.994) 2.791 6.686 ( 3.729 0.888 -5.126) 6.401 7.100 ( -10.630 -2.644 -8.358) 13.779 7.295 ( -5.236 -1.595 8.480) 10.093 7.868 ( -6.634 -4.962 -2.578) 8.676 8.449 ( -0.297 -2.201 1.390) 2.620 8.589 ( -4.769 -10.280 -11.912) 16.442 8.683 ( -1.107 -5.873 -3.313) 6.833 9.224 ( -12.717 -2.366 -7.852) 15.132 9.355 ( -6.133 -7.973 -0.649) 10.079 9.716 ( -2.165 -1.466 2.996) 3.976 10.036 ( 0.743 12.939 -0.444) 12.968 10.305 ( 4.986 2.791 -0.876) 5.780 10.574 ( -7.108 2.502 -7.661) 10.746 10.836 ( 7.528 -3.533 -6.337) 10.456 11.352 ( -1.018 1.482 1.737) 2.500 11.530 ( 1.792 1.252 -0.323) 2.210 11.886 ( 1.377 -4.932 -9.390) 10.695 12.266 ( 0.977 -7.454 6.155) 9.716 12.450 ( 0.171 -7.263 5.224) 8.948 13.042 ( 4.688 5.810 2.270) 7.803 13.455 ( 2.392 -7.600 -3.340) 8.639 13.591 ( 2.476 0.201 -0.109) 2.487 13.857 ( 3.036 3.886 9.700) 10.882 14.300 ( 2.984 2.672 0.148) 4.008 14.521 ( -2.186 9.361 6.614) 11.669 15.907 ( -14.588 -14.909 -6.110) 21.735 18.625 ( -2.110 7.717 4.523) 9.190 19.139 ( -4.740 7.661 -5.270) 10.437 20.150 ( 9.468 7.771 8.888) 15.134 20.561 ( 22.488 4.680 -7.596) 24.194 21.998 ( -13.376 -18.839 1.041) 23.128 23.769 ( -0.084 2.182 3.988) 4.546 ======================= Grid point 815 (412/433) ======================= q-point: (-0.08 0.42 -0.55) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.507 ( 2.128 3.126 -9.468) 10.195 3.649 ( -6.312 -0.923 -9.695) 11.606 4.221 ( 8.233 3.414 1.230) 8.998 5.171 ( -0.556 -0.535 2.059) 2.199 6.690 ( 1.305 1.476 -4.207) 4.645 6.875 ( -9.672 0.205 -10.469) 14.255 7.302 ( -1.957 0.917 11.767) 11.964 7.830 ( -3.615 -7.902 -4.877) 9.965 8.452 ( 1.215 4.084 -5.052) 6.609 8.502 ( -8.382 -10.376 -6.285) 14.745 8.657 ( -7.782 -7.023 -7.004) 12.607 9.004 ( -8.931 -2.144 -5.883) 10.907 9.342 ( -5.961 -10.105 -1.406) 11.816 9.590 ( -6.321 3.771 -6.436) 9.778 10.016 ( 5.406 9.234 -1.415) 10.794 10.358 ( 1.305 0.033 2.802) 3.091 10.456 ( 1.648 3.111 1.982) 4.040 10.954 ( 6.785 -4.404 -7.119) 10.776 11.284 ( -3.668 3.053 -1.251) 4.934 11.530 ( -0.222 2.102 1.243) 2.453 11.854 ( -3.202 -4.530 -9.474) 10.978 12.256 ( -5.303 -2.742 -0.531) 5.993 12.678 ( 7.059 -9.460 8.816) 14.732 13.147 ( 8.048 1.719 5.075) 9.668 13.460 ( -5.203 -2.303 3.456) 6.657 13.730 ( 11.166 -2.127 -3.057) 11.771 13.904 ( 1.767 4.317 4.177) 6.261 14.341 ( 2.486 5.515 4.439) 7.503 14.434 ( -2.131 3.292 5.732) 6.945 15.726 ( -15.556 -9.936 -9.396) 20.712 18.543 ( -0.623 8.184 1.723) 8.387 19.022 ( -1.338 4.730 2.607) 5.564 20.319 ( 10.852 2.953 7.325) 13.422 20.836 ( 21.486 4.263 -8.940) 23.659 21.892 ( -18.701 -14.024 0.014) 23.376 23.766 ( -0.049 2.613 3.881) 4.679 ======================= Grid point 822 (413/433) ======================= q-point: ( 0.50 -0.50 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 433 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.364 ( 2.362 0.000 0.466) 2.408 3.893 ( 1.218 0.000 4.140) 4.316 3.969 ( 0.340 -0.000 -0.417) 0.538 5.527 ( -0.915 0.000 0.966) 1.330 6.560 ( 2.035 0.000 -0.074) 2.036 7.141 ( -0.597 0.000 9.515) 9.533 7.350 ( -1.242 0.000 -6.430) 6.549 8.209 ( 3.254 0.000 -4.927) 5.904 8.398 ( 2.782 0.000 6.564) 7.129 8.590 ( 1.504 0.000 -5.654) 5.851 8.769 ( 1.343 0.000 -2.826) 3.129 9.229 ( -3.173 0.000 7.868) 8.484 9.335 ( -0.372 -0.000 0.732) 0.822 9.733 ( -3.329 0.000 0.614) 3.385 10.233 ( 3.089 -0.000 -0.996) 3.246 10.401 ( 0.929 0.000 0.164) 0.943 10.623 ( 1.554 0.000 7.306) 7.470 10.812 ( 1.164 0.000 5.033) 5.165 10.891 ( -2.556 -0.000 -7.865) 8.270 11.526 ( -0.036 0.000 3.669) 3.669 11.677 ( -0.792 -0.000 -6.981) 7.026 11.717 ( 0.741 0.000 -4.069) 4.136 12.318 ( 1.026 0.000 -4.655) 4.767 13.460 ( 0.465 0.000 1.597) 1.663 13.543 ( 9.217 0.000 12.014) 15.142 13.619 ( 1.562 -0.000 1.326) 2.049 13.869 ( -10.489 -0.000 -13.899) 17.413 14.305 ( 0.911 -0.000 -0.978) 1.336 14.383 ( -1.682 0.000 0.519) 1.760 15.875 ( -1.020 0.000 4.384) 4.502 18.880 ( -0.923 0.000 -2.378) 2.551 19.636 ( 1.453 0.000 5.552) 5.739 20.021 ( 3.236 0.000 0.982) 3.381 20.523 ( -1.118 0.000 1.104) 1.571 21.413 ( -2.147 0.000 -7.345) 7.653 23.744 ( -1.162 0.000 -0.510) 1.269 ======================= Grid point 824 (414/433) ======================= q-point: (-0.42 0.50 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.370 ( 1.340 4.447 -3.883) 6.054 3.899 ( -1.563 2.532 0.450) 3.009 3.948 ( -0.789 -0.954 -1.326) 1.815 5.468 ( -4.617 3.542 1.540) 6.020 6.596 ( 3.409 -0.449 -3.662) 5.023 7.132 ( -7.966 -3.748 6.060) 10.688 7.331 ( -0.188 -3.395 -2.171) 4.034 8.236 ( 1.310 -0.399 -6.140) 6.291 8.341 ( -8.590 -1.716 -1.512) 8.889 8.538 ( 0.084 6.100 -4.905) 7.828 8.746 ( -3.236 -1.974 -3.149) 4.928 9.300 ( -2.501 -1.787 0.729) 3.159 9.316 ( 3.313 -1.473 6.134) 7.125 9.663 ( -6.587 -0.328 5.244) 8.426 10.301 ( 7.928 3.973 -4.396) 9.897 10.448 ( 1.973 -5.420 -0.811) 5.825 10.655 ( -0.487 6.705 0.906) 6.783 10.787 ( -1.714 -1.456 -3.484) 4.147 10.918 ( 3.393 -7.981 3.008) 9.179 11.544 ( 1.595 2.495 0.837) 3.077 11.662 ( 2.325 -0.629 -0.339) 2.433 11.786 ( 4.867 -5.237 -2.999) 7.753 12.358 ( 5.870 -0.656 -3.165) 6.701 13.391 ( -5.572 2.722 -0.055) 6.202 13.514 ( -9.221 6.774 -11.490) 16.215 13.624 ( -5.458 -5.009 -3.945) 8.394 13.772 ( 3.889 3.169 14.890) 15.712 14.335 ( 4.468 2.589 -1.546) 5.390 14.453 ( 4.402 -5.412 2.689) 7.477 15.852 ( -6.047 -2.979 3.169) 7.449 18.837 ( -2.832 0.638 0.285) 2.917 19.631 ( -2.650 2.232 -0.396) 3.487 20.141 ( 13.203 1.985 -4.353) 14.043 20.450 ( -0.381 13.003 2.165) 13.188 21.427 ( -3.283 -14.899 0.895) 15.283 23.743 ( 0.646 0.052 1.679) 1.799 ======================= Grid point 825 (415/433) ======================= q-point: (-0.33 0.50 -0.55) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 794 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.240 ( -2.265 14.105 -8.062) 16.403 3.849 ( -1.978 0.257 -0.559) 2.072 3.952 ( 0.339 -4.162 -3.482) 5.437 5.346 ( -5.939 4.080 1.220) 7.308 6.635 ( 3.972 -1.331 -7.030) 8.183 7.066 ( -8.578 -6.305 4.194) 11.442 7.340 ( -1.815 -2.047 -0.315) 2.754 8.045 ( -13.129 2.408 -4.755) 14.170 8.327 ( -0.741 -8.332 -8.054) 11.612 8.460 ( 0.511 3.498 -2.566) 4.368 8.674 ( -5.594 -2.753 -2.391) 6.677 9.224 ( -8.523 -5.964 -0.943) 10.445 9.387 ( -2.869 -1.366 -3.606) 4.807 9.654 ( 1.860 2.101 11.889) 12.215 10.343 ( 5.211 4.110 -4.373) 7.948 10.447 ( -6.553 8.090 2.386) 10.682 10.600 ( 6.385 -1.952 -6.533) 9.341 10.775 ( 1.825 -0.950 -9.283) 9.508 11.149 ( 7.210 -10.194 7.895) 14.773 11.549 ( 2.721 2.768 -1.567) 4.186 11.741 ( 3.466 -2.080 2.683) 4.851 11.890 ( 2.546 -6.465 -1.041) 7.026 12.446 ( 3.999 0.682 -1.419) 4.298 13.246 ( -6.847 5.078 -2.808) 8.975 13.290 ( -2.004 -0.828 -8.304) 8.582 13.544 ( -6.653 -5.722 -2.678) 9.175 13.883 ( 3.592 5.969 15.150) 16.675 14.367 ( 4.142 4.316 -1.541) 6.177 14.596 ( 3.954 -2.707 3.986) 6.233 15.776 ( -9.744 -6.636 0.249) 11.792 18.788 ( -2.045 2.698 3.036) 4.547 19.498 ( -6.352 4.897 -6.857) 10.552 20.308 ( 9.666 9.493 -6.565) 15.054 20.393 ( 11.708 7.686 4.998) 14.870 21.547 ( -6.044 -19.681 5.385) 21.280 23.776 ( 1.522 0.663 3.215) 3.618 ======================= Grid point 826 (416/433) ======================= q-point: (-0.25 0.50 -0.55) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.967 ( -3.095 19.260 -9.512) 21.703 3.781 ( -4.377 0.059 -6.021) 7.444 4.032 ( 3.782 -7.869 -0.623) 8.753 5.227 ( -5.185 1.996 0.782) 5.611 6.664 ( 2.461 -2.823 -8.081) 8.907 7.021 ( -5.418 -4.125 -0.163) 6.812 7.300 ( -2.690 1.640 1.125) 3.345 7.813 ( -9.977 -2.161 -3.806) 10.895 8.302 ( -5.206 -9.334 -9.694) 14.430 8.468 ( 0.442 -3.469 -2.581) 4.347 8.604 ( -4.744 -3.428 -0.573) 5.881 9.130 ( -9.490 -5.862 -0.897) 11.191 9.261 ( -8.832 -2.071 -3.373) 9.678 9.720 ( -0.169 1.482 2.327) 2.764 10.292 ( 0.901 13.273 4.604) 14.078 10.364 ( 3.706 2.998 -1.739) 5.074 10.624 ( -0.977 2.896 -8.864) 9.376 10.790 ( 6.753 -2.139 -8.010) 10.693 11.349 ( 2.601 -2.825 4.827) 6.168 11.565 ( 2.682 2.301 -0.504) 3.570 11.798 ( 1.642 -3.361 -7.613) 8.483 12.055 ( 4.293 -11.802 10.892) 16.624 12.410 ( -4.604 1.597 -1.783) 5.189 13.133 ( -0.907 3.149 1.067) 3.447 13.316 ( 3.915 -6.272 -7.050) 10.216 13.529 ( 1.836 -5.405 -3.000) 6.449 13.964 ( 2.367 5.984 14.979) 16.303 14.368 ( 2.289 4.730 -0.809) 5.317 14.654 ( -0.127 3.545 5.423) 6.480 15.666 ( -11.270 -9.597 -4.390) 15.440 18.755 ( -0.019 5.578 4.082) 6.912 19.276 ( -6.993 6.209 -7.940) 12.268 20.314 ( 5.576 8.933 5.571) 11.913 20.637 ( 20.434 3.317 -6.261) 21.627 21.633 ( -10.479 -18.279 6.207) 21.965 23.808 ( 1.141 1.809 3.610) 4.196 ======================= Grid point 827 (417/433) ======================= q-point: (-0.17 0.50 -0.55) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 794 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.702 ( -0.854 16.424 -8.109) 18.336 3.639 ( -7.080 -0.131 -8.123) 10.776 4.188 ( 5.137 -6.997 0.936) 8.731 5.158 ( -2.806 -0.776 1.234) 3.162 6.671 ( -0.189 -3.484 -6.064) 6.996 6.907 ( -5.583 3.683 -8.986) 11.202 7.305 ( 2.451 -0.894 5.859) 6.414 7.724 ( -2.787 -3.383 -1.438) 4.613 8.232 ( -8.903 -14.476 -12.793) 21.272 8.475 ( -1.270 -2.278 -1.379) 2.950 8.566 ( -5.070 -3.879 -0.687) 6.421 8.978 ( -9.826 -0.531 -3.052) 10.303 9.174 ( -5.711 -6.953 0.798) 9.033 9.638 ( -5.087 1.762 -5.054) 7.384 10.240 ( 2.687 12.626 -2.503) 13.149 10.387 ( 2.453 2.173 0.027) 3.277 10.526 ( 0.983 5.275 4.111) 6.760 10.889 ( 7.161 -2.512 -8.084) 11.088 11.353 ( -2.445 3.629 1.000) 4.489 11.576 ( 1.074 2.510 1.412) 3.073 11.774 ( -2.478 -3.819 -10.224) 11.192 12.220 ( -4.380 -1.476 0.795) 4.690 12.436 ( 5.124 -13.646 10.826) 18.157 13.173 ( 5.244 -0.196 3.359) 6.230 13.382 ( 1.517 -3.995 -2.569) 4.986 13.658 ( 8.921 -5.482 -7.949) 13.146 14.025 ( 1.665 6.707 13.007) 14.728 14.361 ( 1.031 1.651 2.146) 2.898 14.595 ( -3.633 8.417 5.917) 10.911 15.537 ( -10.477 -9.286 -8.254) 16.252 18.705 ( -0.205 8.355 -0.014) 8.357 19.106 ( -3.389 3.655 -1.210) 5.129 20.393 ( 6.549 4.464 7.604) 10.983 20.903 ( 20.528 2.841 -9.374) 22.746 21.612 ( -15.535 -14.538 5.784) 22.049 23.819 ( 0.441 2.697 2.938) 4.013 ======================= Grid point 828 (418/433) ======================= q-point: (-0.08 -0.50 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.535 ( -0.293 8.735 -4.588) 9.871 3.475 ( -7.363 -0.815 -5.997) 9.531 4.318 ( 2.889 -3.535 1.531) 4.815 5.165 ( 0.448 -2.039 2.058) 2.932 6.653 ( -2.174 -2.281 -3.192) 4.485 6.707 ( -4.640 4.932 -9.751) 11.872 7.446 ( 8.649 0.907 7.202) 11.291 7.732 ( 0.888 -0.952 -1.218) 1.783 8.134 ( -10.011 -15.474 -14.640) 23.537 8.432 ( -6.492 0.883 -0.166) 6.554 8.499 ( -1.952 -1.991 -2.827) 3.971 8.851 ( -4.290 -1.891 -2.201) 5.180 9.182 ( -2.689 -6.487 1.422) 7.165 9.507 ( -3.899 2.195 -4.956) 6.677 10.083 ( -3.369 7.031 -6.968) 10.456 10.439 ( 3.758 0.958 3.699) 5.359 10.598 ( 6.071 5.286 9.119) 12.163 10.961 ( 3.461 -3.433 -8.180) 9.522 11.251 ( -3.772 4.699 -0.802) 6.078 11.567 ( -0.085 3.906 2.322) 4.545 11.689 ( -4.013 -4.083 -8.367) 10.138 12.148 ( -4.555 -1.669 0.605) 4.889 12.746 ( 6.764 -12.263 9.286) 16.803 13.298 ( 5.176 0.075 3.441) 6.216 13.411 ( -0.006 -0.139 0.052) 0.149 13.805 ( 8.830 -7.072 -10.244) 15.262 14.024 ( -1.466 8.627 10.663) 13.794 14.417 ( 2.266 -2.965 3.868) 5.375 14.470 ( -3.456 9.144 3.300) 10.318 15.405 ( -7.908 -5.543 -7.856) 12.449 18.601 ( -1.193 6.878 -2.835) 7.534 19.072 ( 0.608 2.205 3.750) 4.392 20.519 ( 5.649 0.776 7.116) 9.119 21.146 ( 19.333 2.623 -11.495) 22.645 21.470 ( -19.564 -9.864 6.361) 22.815 23.814 ( 0.511 2.422 1.626) 2.962 ======================= Grid point 836 (419/433) ======================= q-point: ( 0.58 -0.42 -0.55) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 432 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.401 ( 3.156 -0.000 -6.461) 7.191 3.852 ( -6.553 0.000 -0.345) 6.562 3.886 ( -1.780 0.000 -4.823) 5.141 5.389 ( -7.598 0.000 1.502) 7.745 6.618 ( 3.274 -0.000 -7.616) 8.290 7.005 ( -7.325 0.000 4.061) 8.375 7.314 ( 0.511 -0.000 0.447) 0.679 8.077 ( -15.947 0.000 -6.789) 17.332 8.235 ( 1.952 -0.000 -9.054) 9.262 8.514 ( -3.642 0.000 -1.899) 4.107 8.632 ( -6.312 0.000 -2.028) 6.630 9.161 ( -8.491 0.000 0.664) 8.517 9.379 ( -3.239 0.000 -2.975) 4.398 9.681 ( 3.312 -0.000 10.354) 10.871 10.419 ( 0.713 -0.000 -1.897) 2.026 10.464 ( 8.923 -0.000 -3.817) 9.705 10.663 ( -2.833 0.000 -1.343) 3.136 10.725 ( 2.529 -0.000 -8.116) 8.501 11.020 ( 8.366 -0.000 8.562) 11.970 11.584 ( 1.903 -0.000 -0.893) 2.102 11.726 ( 3.774 -0.000 5.257) 6.471 11.824 ( 3.769 -0.000 -5.553) 6.711 12.453 ( 6.014 -0.000 -1.748) 6.263 13.273 ( -9.004 0.000 -0.020) 9.004 13.315 ( -6.945 0.000 -11.662) 13.573 13.474 ( -4.706 0.000 -2.903) 5.530 13.949 ( 2.833 -0.000 14.358) 14.635 14.437 ( 5.235 -0.000 -0.535) 5.263 14.530 ( 5.722 -0.000 3.448) 6.681 15.717 ( -9.748 0.000 0.772) 9.779 18.814 ( -1.105 0.000 2.562) 2.790 19.545 ( -6.332 0.000 -5.904) 8.657 20.372 ( 17.640 -0.000 -11.704) 21.170 20.532 ( 0.445 -0.000 6.442) 6.458 21.319 ( -4.339 0.000 8.644) 9.672 23.782 ( 1.934 -0.000 3.201) 3.740 ======================= Grid point 838 (420/433) ======================= q-point: (-0.33 0.58 -0.55) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.336 ( 1.969 16.709 -7.447) 18.400 3.775 ( -4.528 -2.928 -2.378) 5.893 3.825 ( -3.932 -9.514 -4.770) 11.346 5.257 ( -7.841 0.917 0.797) 7.935 6.609 ( 0.531 -1.993 -8.360) 8.610 6.967 ( 0.059 -1.404 0.648) 1.547 7.339 ( 1.940 1.703 1.148) 2.826 7.762 ( -15.350 -2.362 -8.824) 17.862 8.183 ( -3.254 -2.845 -12.032) 12.785 8.431 ( -4.775 -0.540 0.619) 4.846 8.540 ( -5.568 -2.509 0.997) 6.188 9.044 ( -8.045 -2.504 2.758) 8.866 9.246 ( -8.842 -0.078 -3.177) 9.396 9.752 ( -0.473 1.160 0.630) 1.402 10.410 ( 1.051 1.456 -1.936) 2.640 10.528 ( 3.803 9.855 7.449) 12.926 10.670 ( 3.418 1.261 -10.323) 10.947 10.740 ( 6.773 -3.010 -7.500) 10.544 11.244 ( 7.257 -5.723 7.821) 12.107 11.606 ( 2.330 1.438 -0.675) 2.820 11.783 ( -0.304 1.540 -5.768) 5.977 11.878 ( 3.635 -6.142 7.750) 10.536 12.454 ( -4.409 1.840 -2.684) 5.480 13.148 ( -6.392 -0.952 1.679) 6.677 13.247 ( 6.801 -0.808 -9.110) 11.397 13.435 ( 0.687 -3.236 -3.059) 4.506 14.050 ( 1.140 2.473 14.194) 14.453 14.473 ( 2.457 5.102 0.405) 5.677 14.653 ( 3.339 -2.539 3.732) 5.614 15.548 ( -10.938 -2.805 -3.163) 11.726 18.831 ( 1.598 2.053 3.947) 4.727 19.362 ( -8.436 2.362 -8.973) 12.541 20.462 ( 4.376 5.100 -4.311) 7.983 20.691 ( 16.735 2.038 -0.963) 16.886 21.345 ( -7.310 -9.598 12.079) 17.072 23.833 ( 1.865 0.699 3.416) 3.954 ======================= Grid point 839 (421/433) ======================= q-point: (-0.25 -0.42 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.097 ( -0.774 23.370 -5.523) 24.026 3.642 ( -7.459 0.316 -7.140) 10.330 3.954 ( 2.098 -16.992 -0.032) 17.121 5.146 ( -5.063 -0.412 0.674) 5.124 6.593 ( 0.060 -3.587 -6.111) 7.086 6.990 ( 2.770 3.787 -6.837) 8.292 7.304 ( -1.312 2.387 -2.608) 3.771 7.629 ( -1.715 -8.423 -1.076) 8.663 8.040 ( -7.983 -3.920 -12.750) 15.545 8.391 ( -4.672 -5.224 2.011) 7.292 8.497 ( -4.414 -2.981 1.809) 5.625 8.967 ( -7.067 -1.067 3.691) 8.044 9.088 ( -7.711 -1.968 -1.131) 8.038 9.668 ( -5.129 1.309 -4.552) 6.981 10.398 ( -1.640 0.696 -1.324) 2.220 10.464 ( -0.140 7.688 -10.615) 13.107 10.675 ( 5.752 9.179 10.909) 15.374 10.861 ( 9.065 -0.153 -7.326) 11.656 11.389 ( 1.116 -0.755 3.699) 3.937 11.622 ( 1.113 2.212 0.419) 2.511 11.710 ( -1.690 -2.663 -9.101) 9.632 12.114 ( 6.318 -9.358 11.878) 16.389 12.294 ( -8.732 -0.145 -0.855) 8.775 13.131 ( 0.541 -3.116 3.385) 4.632 13.348 ( 8.287 0.273 -7.245) 11.011 13.532 ( 7.464 -6.627 -5.602) 11.446 14.126 ( 1.200 3.440 14.384) 14.838 14.437 ( -0.854 5.548 1.805) 5.897 14.702 ( -0.769 2.409 4.314) 5.001 15.388 ( -8.803 -5.691 -7.773) 13.049 18.849 ( 1.883 6.089 0.965) 6.447 19.153 ( -6.887 1.254 -6.487) 9.543 20.478 ( 3.482 4.019 4.145) 6.742 20.948 ( 19.038 1.857 -7.591) 20.580 21.362 ( -11.905 -10.643 11.951) 19.946 23.863 ( 0.877 1.705 2.309) 3.001 ======================= Grid point 840 (422/433) ======================= q-point: (-0.17 -0.42 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.835 ( -1.601 21.164 -2.489) 21.370 3.468 ( -8.352 0.064 -4.105) 9.306 4.152 ( 2.316 -13.666 0.980) 13.895 5.121 ( 0.045 -2.174 1.289) 2.528 6.609 ( 1.877 -2.166 -4.101) 5.003 6.833 ( -5.198 8.031 -10.692) 14.347 7.373 ( 7.778 -6.817 -3.414) 10.891 7.764 ( 8.077 -1.896 5.645) 10.035 7.866 ( -9.150 -6.552 -13.001) 17.196 8.390 ( -4.162 -6.032 3.053) 7.939 8.452 ( -4.780 -1.653 0.423) 5.075 8.849 ( -5.941 1.651 0.225) 6.170 9.066 ( -1.840 -5.440 4.450) 7.265 9.541 ( -4.736 1.423 -4.488) 6.679 10.208 ( -8.399 4.536 -9.757) 13.650 10.444 ( 3.081 0.493 -1.468) 3.448 10.755 ( 5.187 9.146 10.825) 15.091 10.936 ( 5.174 1.850 -4.537) 7.126 11.357 ( -3.035 5.181 0.979) 6.084 11.607 ( -0.852 -1.866 -4.467) 4.916 11.658 ( -0.770 2.824 -2.560) 3.888 12.120 ( -5.357 -1.213 0.718) 5.540 12.475 ( 7.111 -14.626 11.486) 19.910 13.250 ( 4.515 -4.473 5.818) 8.616 13.416 ( 5.645 1.079 -6.270) 8.506 13.676 ( 6.796 -6.588 -9.065) 13.106 14.173 ( -0.587 6.461 10.218) 12.104 14.401 ( -0.068 1.473 5.055) 5.265 14.635 ( -3.544 7.345 2.447) 8.515 15.285 ( -4.736 -6.577 -8.331) 11.623 18.746 ( -2.878 7.945 -5.979) 10.351 19.085 ( -0.221 -1.112 0.089) 1.138 20.544 ( 2.547 1.595 8.060) 8.602 21.182 ( 14.980 0.852 -10.153) 18.116 21.297 ( -12.316 -7.391 11.088) 18.145 23.859 ( 0.154 2.149 0.413) 2.194 ======================= Grid point 841 (423/433) ======================= q-point: (-0.08 -0.42 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.610 ( -3.953 15.426 1.096) 15.962 3.340 ( -6.146 -0.575 2.471) 6.649 4.276 ( -1.779 -8.983 1.704) 9.315 5.187 ( 3.575 -1.812 0.804) 4.088 6.593 ( -4.088 3.513 -3.427) 6.387 6.675 ( 3.008 1.957 -5.593) 6.645 7.574 ( 8.539 -7.806 -4.027) 12.250 7.725 ( -4.983 -5.933 -12.656) 14.840 7.960 ( 10.472 4.263 9.324) 14.656 8.356 ( -3.870 1.263 2.317) 4.684 8.430 ( -0.459 -4.180 -0.513) 4.236 8.793 ( -0.828 -0.869 1.125) 1.645 9.146 ( 2.177 -4.087 4.167) 6.230 9.440 ( -3.262 1.072 -2.219) 4.089 10.002 ( -6.703 1.657 -4.533) 8.260 10.490 ( 2.390 -0.859 -0.873) 2.686 10.772 ( -1.044 2.558 0.769) 2.868 10.943 ( 0.520 5.122 2.802) 5.861 11.237 ( -3.714 5.590 -0.139) 6.712 11.563 ( -1.495 -2.107 -6.258) 6.770 11.646 ( 2.935 4.214 2.579) 5.746 12.102 ( -0.084 -1.080 2.581) 2.799 12.767 ( 3.627 -12.733 8.601) 15.788 13.355 ( 0.107 -0.307 3.815) 3.829 13.444 ( 3.137 1.683 -4.088) 5.421 13.804 ( 7.148 -7.679 -8.275) 13.362 14.097 ( -4.752 6.186 5.167) 9.357 14.443 ( 0.630 0.384 -2.291) 2.406 14.520 ( -0.978 6.481 3.856) 7.605 15.262 ( 0.064 -3.744 -2.296) 4.392 18.596 ( -3.030 4.369 -5.043) 7.329 19.109 ( 1.572 -0.838 -1.359) 2.241 20.598 ( -1.542 -0.402 6.742) 6.928 21.091 ( -18.786 -5.409 7.920) 21.092 21.459 ( 18.741 2.371 -6.069) 19.841 23.841 ( 0.420 1.435 -1.542) 2.148 ======================= Grid point 850 (424/433) ======================= q-point: (-0.33 -0.33 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 433 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.525 ( 9.995 -0.000 -7.202) 12.320 3.588 ( -9.383 0.000 2.775) 9.784 3.646 ( -7.647 0.000 -7.263) 10.546 5.142 ( -5.994 0.000 0.512) 6.015 6.556 ( 0.736 -0.000 -5.966) 6.011 7.026 ( 8.219 -0.000 -5.085) 9.665 7.407 ( -16.128 0.000 -12.157) 20.197 7.453 ( 8.066 -0.000 1.561) 8.216 8.026 ( -5.102 0.000 -10.881) 12.018 8.327 ( -7.763 0.000 4.256) 8.854 8.466 ( -3.791 0.000 2.572) 4.581 8.952 ( -5.238 0.000 7.053) 8.786 9.075 ( -9.231 0.000 -2.605) 9.591 9.682 ( -5.399 0.000 -4.218) 6.851 10.397 ( -2.568 0.000 -2.983) 3.936 10.543 ( -3.014 0.000 -13.853) 14.177 10.776 ( 6.567 -0.000 9.350) 11.426 10.883 ( 12.753 -0.000 -1.552) 12.847 11.354 ( 3.867 -0.000 5.277) 6.543 11.654 ( 3.088 -0.000 0.368) 3.110 11.678 ( -4.987 0.000 -8.844) 10.153 12.010 ( 6.942 -0.000 12.353) 14.170 12.305 ( -11.288 0.000 -2.658) 11.597 13.096 ( -0.218 0.000 2.548) 2.557 13.363 ( 11.667 -0.000 -9.020) 14.747 13.452 ( 5.310 -0.000 -3.238) 6.219 14.158 ( 0.712 -0.000 14.187) 14.205 14.511 ( -2.263 0.000 2.781) 3.586 14.710 ( 2.345 -0.000 2.717) 3.589 15.333 ( -9.136 0.000 -7.445) 11.785 18.913 ( 3.986 -0.000 2.929) 4.946 19.162 ( -9.564 0.000 -10.114) 13.919 20.523 ( 2.389 -0.000 0.655) 2.477 20.969 ( 17.943 -0.000 -5.514) 18.771 21.248 ( -9.921 0.000 15.128) 18.091 23.880 ( 1.052 -0.000 2.093) 2.343 ======================= Grid point 851 (425/433) ======================= q-point: (-0.25 -0.33 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.287 ( -4.240 23.525 0.680) 23.913 3.472 ( -8.922 0.104 -3.078) 9.438 3.812 ( 4.608 -20.207 -1.197) 20.760 5.091 ( -0.486 -0.804 0.865) 1.277 6.578 ( 4.930 -0.890 -4.339) 6.628 7.008 ( -7.659 9.548 -11.222) 16.606 7.220 ( 5.695 -8.753 -7.950) 13.125 7.607 ( 4.595 -5.936 -8.327) 11.211 7.931 ( 3.080 4.737 2.073) 6.018 8.261 ( -6.910 -5.539 6.826) 11.181 8.428 ( -3.400 -0.798 2.436) 4.258 8.899 ( -6.002 3.131 1.350) 6.903 8.975 ( -2.497 -3.997 6.500) 8.029 9.563 ( -5.074 0.721 -3.699) 6.320 10.234 ( -10.741 -0.528 -9.892) 14.612 10.483 ( 3.272 2.311 -5.418) 6.738 10.841 ( -0.218 0.788 -1.014) 1.303 11.066 ( 8.895 7.921 9.110) 14.995 11.408 ( -1.105 -0.085 3.186) 3.373 11.571 ( -1.834 -1.143 -8.048) 8.333 11.715 ( 4.040 1.992 0.546) 4.538 12.106 ( -8.483 -0.105 0.212) 8.487 12.243 ( 6.830 -7.631 11.751) 15.587 13.174 ( 5.145 -2.469 4.599) 7.329 13.449 ( 6.387 2.026 -9.040) 11.253 13.562 ( 6.799 -4.501 -5.512) 9.842 14.251 ( 1.213 1.698 11.341) 11.531 14.457 ( -3.628 2.885 4.544) 6.491 14.733 ( -0.703 2.567 1.940) 3.294 15.178 ( -4.448 -3.549 -9.504) 11.078 18.895 ( -5.056 7.060 -7.725) 11.623 19.028 ( 0.283 -4.546 -2.578) 5.234 20.571 ( 0.900 0.955 7.605) 7.717 21.155 ( -11.860 -2.460 11.734) 16.864 21.230 ( 16.400 -0.318 -5.764) 17.386 23.889 ( -0.008 0.858 -0.238) 0.891 ======================= Grid point 852 (426/433) ======================= q-point: (-0.17 -0.33 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 794 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.990 ( -6.397 22.111 3.102) 23.226 3.336 ( -7.182 -0.016 4.410) 8.428 4.026 ( -0.513 -16.139 0.598) 16.159 5.153 ( 5.273 -1.410 0.598) 5.491 6.658 ( 4.437 2.234 -3.197) 5.907 6.727 ( -5.896 3.732 -8.369) 10.896 7.400 ( 7.793 -8.699 -7.972) 14.141 7.595 ( 1.203 -5.547 -13.376) 14.530 8.071 ( 8.613 5.860 13.585) 17.120 8.304 ( 0.226 -5.790 7.451) 9.438 8.404 ( 0.854 0.561 0.132) 1.030 8.803 ( -2.266 1.827 1.262) 3.173 9.067 ( 2.700 -3.732 8.492) 9.661 9.465 ( -3.284 1.419 -1.875) 4.039 10.008 ( -10.022 -1.128 -7.010) 12.282 10.499 ( 3.608 2.032 -2.771) 4.982 10.770 ( -6.165 -1.603 -4.091) 7.570 11.122 ( 2.198 10.764 9.615) 14.599 11.349 ( -4.733 4.702 0.917) 6.734 11.517 ( -1.037 -2.246 -7.231) 7.643 11.746 ( 4.256 5.591 2.361) 7.413 12.073 ( 0.941 -1.957 3.653) 4.249 12.513 ( 5.147 -12.145 9.783) 16.422 13.331 ( 4.075 -2.192 7.310) 8.651 13.447 ( 2.898 -0.445 -9.782) 10.212 13.672 ( 6.154 -5.017 -7.508) 10.928 14.223 ( -6.089 5.694 5.253) 9.854 14.447 ( 0.778 0.399 -0.720) 1.133 14.661 ( -2.400 6.730 1.696) 7.344 15.169 ( 2.927 -5.311 -2.421) 6.529 18.686 ( -5.904 4.484 -8.371) 11.182 19.071 ( 2.090 -2.605 -4.458) 5.570 20.602 ( -3.402 0.627 9.528) 10.137 21.001 ( -18.065 -3.700 11.699) 21.838 21.495 ( 20.155 1.322 -6.155) 21.115 23.867 ( -0.261 1.080 -2.693) 2.914 ======================= Grid point 853 (427/433) ======================= q-point: (-0.08 -0.33 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.686 ( -9.972 18.601 6.126) 21.977 3.301 ( -3.434 -0.693 12.307) 12.796 4.106 ( -7.260 -12.975 1.836) 14.981 5.247 ( 4.153 0.133 -1.881) 4.562 6.530 ( -4.825 1.646 1.952) 5.459 6.766 ( 7.021 1.896 -6.058) 9.465 7.467 ( 1.837 -6.957 -11.705) 13.740 7.732 ( 12.378 -3.891 -4.200) 13.638 8.185 ( 0.374 0.797 11.402) 11.436 8.352 ( 0.560 -0.665 4.819) 4.897 8.554 ( 15.946 6.352 2.481) 17.344 8.818 ( 2.446 -0.491 4.344) 5.009 9.226 ( 7.515 -2.226 5.443) 9.542 9.409 ( -1.190 2.055 1.840) 3.004 9.865 ( -6.361 -2.373 -0.589) 6.815 10.510 ( 0.151 0.678 -2.085) 2.197 10.637 ( -7.499 -2.549 -7.355) 10.809 11.062 ( -3.104 10.359 8.374) 13.677 11.227 ( -2.944 3.845 -0.447) 4.863 11.502 ( -0.339 -2.304 -2.510) 3.424 11.787 ( 4.937 6.051 3.480) 8.550 12.161 ( 4.671 0.194 4.636) 6.584 12.724 ( -0.238 -11.092 6.244) 12.731 13.344 ( -1.859 -0.176 -1.587) 2.451 13.498 ( 4.134 1.736 -2.547) 5.156 13.799 ( 6.335 -8.077 -6.674) 12.244 14.058 ( -8.345 5.853 0.728) 10.219 14.373 ( -4.148 -0.595 -10.195) 11.022 14.595 ( -1.322 4.713 2.147) 5.345 15.346 ( 12.128 -1.011 8.094) 14.615 18.533 ( -3.332 1.440 -6.281) 7.255 19.087 ( 1.108 -2.467 -7.234) 7.723 20.534 ( -10.100 -0.231 4.706) 11.145 20.783 ( -20.546 -3.932 11.747) 23.992 21.796 ( 21.476 3.335 -2.403) 21.865 23.838 ( 0.467 0.403 -4.465) 4.507 ======================= Grid point 863 (428/433) ======================= q-point: (-0.25 -0.25 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 432 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.313 ( -11.111 0.000 7.213) 13.247 3.317 ( -8.590 0.000 4.108) 9.521 3.785 ( 4.906 -0.000 -2.270) 5.406 5.139 ( 5.920 -0.000 0.493) 5.940 6.676 ( 9.423 -0.000 -4.165) 10.302 6.778 ( -13.146 0.000 -8.139) 15.462 7.302 ( 10.078 -0.000 -9.218) 13.658 7.540 ( 3.230 -0.000 -12.722) 13.126 8.165 ( -6.440 0.000 10.735) 12.519 8.206 ( 15.111 -0.000 12.313) 19.492 8.409 ( 2.085 -0.000 0.791) 2.230 8.831 ( -2.775 0.000 -0.726) 2.868 9.024 ( 2.689 -0.000 12.086) 12.382 9.483 ( -2.893 0.000 -1.510) 3.263 9.988 ( -10.758 0.000 -8.001) 13.407 10.532 ( 4.342 -0.000 -4.183) 6.030 10.746 ( -8.382 0.000 -3.613) 9.127 11.256 ( 1.157 -0.000 9.580) 9.649 11.387 ( -3.380 0.000 2.981) 4.506 11.490 ( -2.195 0.000 -8.108) 8.400 11.821 ( 5.764 -0.000 0.856) 5.827 12.041 ( 0.876 -0.000 5.351) 5.422 12.378 ( 5.626 -0.000 9.659) 11.178 13.301 ( 6.669 -0.000 7.186) 9.804 13.444 ( 0.620 -0.000 -11.992) 12.008 13.623 ( 6.123 -0.000 -4.914) 7.851 14.282 ( -5.507 0.000 5.201) 7.575 14.454 ( -0.592 0.000 -0.565) 0.819 14.737 ( -2.138 0.000 0.694) 2.248 15.104 ( 4.243 -0.000 -2.365) 4.858 18.737 ( -8.025 0.000 -9.803) 12.669 19.038 ( 3.357 -0.000 -5.432) 6.386 20.611 ( -3.911 0.000 10.700) 11.392 20.963 ( -17.839 0.000 12.822) 21.969 21.508 ( 20.547 -0.000 -6.030) 21.413 23.878 ( -0.502 0.000 -3.093) 3.134 ======================= Grid point 864 (429/433) ======================= q-point: (-0.17 -0.25 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.055 ( -12.242 17.018 8.191) 22.507 3.272 ( -6.490 -3.337 13.110) 15.004 3.846 ( -5.237 -11.094 0.603) 12.283 5.250 ( 6.063 0.128 -2.040) 6.398 6.561 ( -7.824 1.151 0.493) 7.924 6.781 ( 5.332 0.032 -7.437) 9.151 7.370 ( 6.923 -2.762 -10.059) 12.520 7.665 ( 14.410 -2.110 -4.518) 15.249 8.163 ( -1.728 -1.540 10.198) 10.457 8.363 ( 0.760 0.721 6.596) 6.679 8.649 ( 19.868 2.826 6.171) 20.996 8.820 ( 1.177 0.442 2.850) 3.115 9.191 ( 8.317 -1.045 9.813) 12.906 9.452 ( 0.449 1.734 1.270) 2.195 9.820 ( -6.031 -1.786 -1.830) 6.550 10.531 ( -7.019 1.400 -3.720) 8.066 10.588 ( -2.272 -2.234 -5.148) 6.055 11.231 ( -3.878 4.927 4.177) 7.534 11.310 ( -4.289 4.929 0.748) 6.576 11.451 ( -0.913 -3.090 -0.559) 3.271 11.897 ( 5.216 4.381 1.940) 7.083 12.154 ( 4.914 -0.791 7.682) 9.153 12.535 ( 2.643 -6.532 6.879) 9.847 13.340 ( -2.506 -0.212 -5.474) 6.024 13.492 ( 8.409 -1.308 0.431) 8.521 13.685 ( 4.296 -2.676 -6.803) 8.479 14.161 ( -9.228 3.333 3.019) 10.266 14.364 ( -5.294 -0.250 -13.101) 14.132 14.670 ( -4.127 2.393 0.152) 4.773 15.319 ( 16.615 -1.143 10.378) 19.623 18.560 ( -5.199 0.961 -9.150) 10.567 19.046 ( 1.847 -1.344 -8.431) 8.735 20.546 ( -10.925 0.933 8.160) 13.668 20.717 ( -21.295 -2.383 10.785) 23.989 21.840 ( 22.399 1.176 -1.079) 22.455 23.845 ( 0.026 0.249 -5.243) 5.249 ======================= Grid point 865 (430/433) ======================= q-point: (-0.08 -0.25 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.705 ( -15.039 18.826 10.416) 26.251 3.323 ( -4.236 -5.082 18.774) 19.905 3.823 ( -11.746 -12.544 2.369) 17.347 5.267 ( -1.071 0.985 -4.441) 4.673 6.531 ( 0.733 -0.097 9.759) 9.787 6.759 ( -1.778 -3.595 -10.456) 11.199 7.512 ( 13.184 1.015 -6.591) 14.775 7.915 ( 13.124 -1.445 2.488) 13.436 8.251 ( 4.189 -1.726 4.241) 6.206 8.426 ( 5.329 0.725 4.335) 6.908 8.874 ( 7.146 1.453 1.677) 7.483 8.946 ( 10.313 4.419 12.114) 16.511 9.354 ( 3.464 0.877 3.134) 4.753 9.536 ( 10.401 0.971 6.454) 12.279 9.797 ( -0.137 2.341 5.237) 5.738 10.346 ( -9.899 -6.878 -6.581) 13.733 10.553 ( -1.014 2.699 -4.914) 5.697 11.147 ( -1.191 8.406 4.001) 9.385 11.212 ( -1.984 2.616 0.275) 3.294 11.469 ( -1.594 -2.266 3.627) 4.565 11.937 ( 3.618 5.572 3.131) 7.344 12.273 ( 3.493 -0.774 5.560) 6.612 12.640 ( -1.682 -6.974 2.433) 7.576 13.296 ( 0.776 -1.362 -6.677) 6.858 13.570 ( 1.915 4.096 -2.242) 5.047 13.772 ( 4.744 -7.860 -6.114) 11.031 13.955 ( -11.019 5.737 -0.435) 12.431 14.188 ( -6.510 -3.650 -13.097) 15.074 14.563 ( -6.073 1.743 -1.028) 6.401 15.745 ( 24.900 3.085 16.147) 29.837 18.453 ( -1.121 -0.806 -7.735) 7.857 19.025 ( 0.150 -1.758 -9.067) 9.237 20.320 ( -18.210 0.588 2.792) 18.432 20.456 ( -21.832 -4.954 9.832) 24.451 22.192 ( 21.478 3.650 2.551) 21.935 23.819 ( 1.171 -0.070 -6.085) 6.197 ======================= Grid point 876 (431/433) ======================= q-point: (-0.17 -0.17 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 433 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.992 ( -14.535 0.000 9.342) 17.278 3.187 ( -11.478 0.000 19.099) 22.283 3.687 ( -7.687 0.000 3.720) 8.540 5.278 ( -1.050 0.000 -4.782) 4.896 6.532 ( 0.429 -0.000 10.444) 10.453 6.715 ( -4.353 0.000 -11.982) 12.748 7.525 ( 16.394 -0.000 -4.885) 17.106 7.905 ( 15.964 -0.000 1.039) 15.997 8.205 ( 1.415 -0.000 6.530) 6.681 8.456 ( 7.268 -0.000 1.809) 7.489 8.878 ( 3.067 -0.000 4.750) 5.654 8.999 ( 13.108 -0.000 11.648) 17.536 9.379 ( 5.560 -0.000 5.173) 7.594 9.520 ( 4.202 -0.000 4.459) 6.127 9.848 ( 11.235 -0.000 6.417) 12.938 10.258 ( -15.943 0.000 -7.973) 17.825 10.582 ( 0.307 -0.000 -4.290) 4.301 11.188 ( -1.954 0.000 -2.787) 3.403 11.318 ( -0.883 0.000 2.546) 2.695 11.418 ( -3.040 0.000 7.436) 8.033 12.007 ( 4.103 -0.000 1.738) 4.456 12.249 ( 0.748 -0.000 7.042) 7.081 12.566 ( 0.641 -0.000 3.965) 4.017 13.278 ( 1.878 -0.000 -9.902) 10.079 13.637 ( 6.913 -0.000 3.716) 7.849 13.667 ( 0.798 -0.000 -8.207) 8.246 14.013 ( -12.359 0.000 0.023) 12.359 14.153 ( -7.447 0.000 -16.037) 17.682 14.580 ( -7.001 0.000 -1.214) 7.105 15.775 ( 27.266 -0.000 17.227) 32.252 18.446 ( -1.808 0.000 -9.383) 9.555 19.008 ( 0.743 -0.000 -9.366) 9.396 20.360 ( -17.098 0.000 5.376) 17.923 20.374 ( -24.719 0.000 8.069) 26.003 22.228 ( 21.993 -0.000 3.361) 22.248 23.819 ( 1.116 -0.000 -6.381) 6.478 ======================= Grid point 877 (432/433) ======================= q-point: (-0.08 -0.17 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 792 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.681 ( -16.749 17.428 11.607) 26.814 3.142 ( -18.495 -17.599 15.803) 30.025 3.655 ( -2.184 -1.589 9.985) 10.344 5.177 ( -6.617 0.114 -3.977) 7.721 6.555 ( -6.062 -2.519 -11.409) 13.163 6.696 ( 7.203 -1.561 15.812) 17.446 7.750 ( 13.388 4.321 -3.413) 14.476 8.157 ( 10.192 2.987 7.401) 12.945 8.304 ( 5.478 -8.428 1.630) 10.183 8.618 ( 14.418 4.031 -2.461) 15.172 8.988 ( 6.195 -0.843 4.982) 7.994 9.241 ( 9.358 4.517 13.951) 17.396 9.418 ( -0.684 2.125 6.116) 6.511 9.633 ( -2.223 -3.583 8.863) 9.814 9.908 ( -5.793 5.988 -9.061) 12.309 10.198 ( 10.133 -6.717 0.690) 12.176 10.550 ( 3.593 4.207 -2.589) 6.108 11.161 ( -1.225 -2.131 -0.712) 2.559 11.301 ( 3.218 8.551 3.960) 9.958 11.464 ( 1.113 -2.356 7.113) 7.575 12.051 ( 2.263 4.337 2.773) 5.623 12.275 ( -2.662 -4.366 1.425) 5.308 12.582 ( -1.643 -2.049 0.697) 2.717 13.275 ( 2.535 -0.172 -8.063) 8.454 13.562 ( -5.344 6.014 -8.399) 11.630 13.761 ( -5.491 -5.140 3.350) 8.234 13.783 ( -2.708 -0.787 -6.838) 7.397 13.984 ( -3.757 -2.034 -11.248) 12.032 14.439 ( -8.513 0.265 -1.460) 8.641 16.380 ( 33.499 4.107 18.322) 38.403 18.404 ( 2.932 -1.432 -8.766) 9.354 18.956 ( -1.093 -0.384 -7.702) 7.789 19.988 ( -24.363 -0.025 4.214) 24.725 20.085 ( -22.217 -4.025 4.338) 22.992 22.582 ( 18.422 2.507 4.841) 19.212 23.809 ( 2.193 -0.009 -5.954) 6.345 ======================= Grid point 889 (433/433) ======================= q-point: (-0.08 -0.08 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 2.71e-05 Number of triplets: 432 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.600 ( -14.137 0.000 8.486) 16.489 2.738 ( -22.846 0.000 14.862) 27.255 3.747 ( 3.235 -0.000 14.119) 14.485 5.030 ( -8.120 0.000 -2.382) 8.463 6.364 ( -6.063 0.000 -10.446) 12.078 6.963 ( 11.991 -0.000 18.330) 21.904 7.947 ( 8.363 -0.000 -1.957) 8.589 8.208 ( -5.178 0.000 1.260) 5.329 8.474 ( 13.721 -0.000 9.576) 16.732 8.909 ( 20.760 -0.000 -10.206) 23.133 9.114 ( 0.881 -0.000 11.426) 11.459 9.446 ( -3.581 0.000 12.175) 12.691 9.464 ( -12.849 0.000 -4.134) 13.498 9.505 ( 9.102 -0.000 12.839) 15.738 9.836 ( 3.977 -0.000 -8.692) 9.559 10.201 ( -5.056 0.000 -4.857) 7.011 10.834 ( 20.977 -0.000 3.279) 21.232 11.111 ( -3.297 0.000 3.962) 5.155 11.429 ( 4.695 -0.000 2.829) 5.482 11.604 ( 11.897 -0.000 4.671) 12.781 12.124 ( 1.109 -0.000 3.426) 3.601 12.164 ( -5.862 0.000 -3.071) 6.618 12.530 ( -3.534 0.000 -0.342) 3.550 13.219 ( -6.828 0.000 -6.778) 9.620 13.471 ( -11.083 0.000 -3.642) 11.666 13.478 ( -4.793 0.000 -10.686) 11.711 13.816 ( 2.057 -0.000 -0.218) 2.069 13.906 ( 1.493 -0.000 -7.265) 7.417 14.286 ( -8.612 0.000 -0.971) 8.667 17.099 ( 36.697 -0.000 14.736) 39.546 18.428 ( 7.260 -0.000 -8.622) 11.272 18.883 ( -3.566 0.000 -4.224) 5.528 19.589 ( -25.557 0.000 5.379) 26.117 19.716 ( -21.172 0.000 0.398) 21.176 22.888 ( 13.131 -0.000 4.557) 13.899 23.818 ( 2.480 -0.000 -4.457) 5.100 =================== 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 3/57024 10.0 1646.657 2319.403 2653.992 0.000 678.468 0.000 3/57024 20.0 593.899 845.465 815.519 0.000 133.762 0.000 3/57024 30.0 272.976 372.419 353.972 0.000 51.953 0.000 3/57024 40.0 146.229 199.083 185.163 0.000 26.348 0.000 3/57024 50.0 86.348 117.233 108.327 0.000 15.500 0.000 3/57024 60.0 54.604 73.246 68.003 0.000 9.728 0.000 3/57024 70.0 36.752 48.458 45.362 0.000 6.419 0.000 3/57024 80.0 26.207 33.923 32.026 0.000 4.466 0.000 3/57024 90.0 19.666 25.013 23.796 0.000 3.272 0.000 3/57024 100.0 15.413 19.290 18.479 0.000 2.511 0.000 3/57024 110.0 12.523 15.449 14.890 0.000 2.005 0.000 3/57024 120.0 10.481 12.763 12.370 0.000 1.655 0.000 3/57024 130.0 8.988 10.816 10.537 0.000 1.403 0.000 3/57024 140.0 7.862 9.360 9.161 0.000 1.215 0.000 3/57024 150.0 6.990 8.241 8.100 0.000 1.072 0.000 3/57024 160.0 6.299 7.360 7.262 0.000 0.959 0.000 3/57024 170.0 5.740 6.652 6.586 0.000 0.868 0.000 3/57024 180.0 5.280 6.072 6.031 0.000 0.794 0.000 3/57024 190.0 4.896 5.590 5.567 0.000 0.732 0.000 3/57024 200.0 4.570 5.183 5.175 0.000 0.679 0.000 3/57024 210.0 4.290 4.835 4.838 0.000 0.634 0.000 3/57024 220.0 4.047 4.535 4.547 0.000 0.595 0.000 3/57024 230.0 3.833 4.272 4.291 0.000 0.560 0.000 3/57024 240.0 3.645 4.042 4.066 0.000 0.530 0.000 3/57024 250.0 3.476 3.836 3.865 0.000 0.503 0.000 3/57024 260.0 3.325 3.653 3.685 0.000 0.479 0.000 3/57024 270.0 3.188 3.488 3.523 0.000 0.457 0.000 3/57024 280.0 3.064 3.339 3.375 0.000 0.437 0.000 3/57024 290.0 2.950 3.203 3.241 0.000 0.419 0.000 3/57024 300.0 2.846 3.079 3.118 0.000 0.403 0.000 3/57024 310.0 2.749 2.965 3.004 0.000 0.387 0.000 3/57024 320.0 2.660 2.859 2.899 0.000 0.373 0.000 3/57024 330.0 2.577 2.762 2.802 0.000 0.360 0.000 3/57024 340.0 2.499 2.671 2.712 0.000 0.348 0.000 3/57024 350.0 2.426 2.587 2.627 0.000 0.337 0.000 3/57024 360.0 2.358 2.508 2.549 0.000 0.326 0.000 3/57024 370.0 2.294 2.435 2.475 0.000 0.316 0.000 3/57024 380.0 2.234 2.365 2.405 0.000 0.307 0.000 3/57024 390.0 2.176 2.300 2.340 0.000 0.298 0.000 3/57024 400.0 2.122 2.239 2.278 0.000 0.290 0.000 3/57024 410.0 2.071 2.181 2.219 0.000 0.282 0.000 3/57024 420.0 2.022 2.126 2.164 0.000 0.275 0.000 3/57024 430.0 1.976 2.073 2.111 0.000 0.268 0.000 3/57024 440.0 1.932 2.024 2.061 0.000 0.262 0.000 3/57024 450.0 1.889 1.977 2.014 0.000 0.255 0.000 3/57024 460.0 1.849 1.932 1.968 0.000 0.249 0.000 3/57024 470.0 1.811 1.889 1.925 0.000 0.244 0.000 3/57024 480.0 1.774 1.848 1.884 0.000 0.238 0.000 3/57024 490.0 1.738 1.809 1.844 0.000 0.233 0.000 3/57024 500.0 1.704 1.772 1.806 0.000 0.228 0.000 3/57024 510.0 1.672 1.736 1.770 0.000 0.223 0.000 3/57024 520.0 1.640 1.702 1.735 0.000 0.219 0.000 3/57024 530.0 1.610 1.669 1.702 0.000 0.214 0.000 3/57024 540.0 1.581 1.637 1.670 0.000 0.210 0.000 3/57024 550.0 1.553 1.607 1.639 0.000 0.206 0.000 3/57024 560.0 1.526 1.577 1.609 0.000 0.202 0.000 3/57024 570.0 1.500 1.549 1.580 0.000 0.199 0.000 3/57024 580.0 1.474 1.522 1.553 0.000 0.195 0.000 3/57024 590.0 1.450 1.496 1.526 0.000 0.192 0.000 3/57024 600.0 1.426 1.470 1.500 0.000 0.188 0.000 3/57024 610.0 1.404 1.446 1.475 0.000 0.185 0.000 3/57024 620.0 1.382 1.422 1.451 0.000 0.182 0.000 3/57024 630.0 1.360 1.399 1.428 0.000 0.179 0.000 3/57024 640.0 1.339 1.377 1.405 0.000 0.176 0.000 3/57024 650.0 1.319 1.355 1.384 0.000 0.173 0.000 3/57024 660.0 1.300 1.335 1.363 0.000 0.170 0.000 3/57024 670.0 1.281 1.315 1.342 0.000 0.168 0.000 3/57024 680.0 1.262 1.295 1.322 0.000 0.165 0.000 3/57024 690.0 1.245 1.276 1.303 0.000 0.163 0.000 3/57024 700.0 1.227 1.258 1.284 0.000 0.160 0.000 3/57024 710.0 1.210 1.240 1.266 0.000 0.158 0.000 3/57024 720.0 1.194 1.222 1.248 0.000 0.156 0.000 3/57024 730.0 1.178 1.206 1.231 0.000 0.154 0.000 3/57024 740.0 1.162 1.189 1.214 0.000 0.152 0.000 3/57024 750.0 1.147 1.173 1.198 0.000 0.149 0.000 3/57024 760.0 1.132 1.158 1.182 0.000 0.147 0.000 3/57024 770.0 1.118 1.143 1.167 0.000 0.145 0.000 3/57024 780.0 1.104 1.128 1.152 0.000 0.144 0.000 3/57024 790.0 1.090 1.113 1.137 0.000 0.142 0.000 3/57024 800.0 1.077 1.099 1.123 0.000 0.140 0.000 3/57024 810.0 1.064 1.086 1.109 0.000 0.138 0.000 3/57024 820.0 1.051 1.072 1.096 0.000 0.136 0.000 3/57024 830.0 1.039 1.060 1.082 0.000 0.135 0.000 3/57024 840.0 1.027 1.047 1.069 0.000 0.133 0.000 3/57024 850.0 1.015 1.034 1.057 0.000 0.132 0.000 3/57024 860.0 1.003 1.022 1.044 0.000 0.130 0.000 3/57024 870.0 0.992 1.011 1.032 0.000 0.128 0.000 3/57024 880.0 0.981 0.999 1.021 0.000 0.127 0.000 3/57024 890.0 0.970 0.988 1.009 0.000 0.126 0.000 3/57024 900.0 0.959 0.977 0.998 0.000 0.124 0.000 3/57024 910.0 0.949 0.966 0.987 0.000 0.123 0.000 3/57024 920.0 0.939 0.956 0.976 0.000 0.121 0.000 3/57024 930.0 0.929 0.945 0.966 0.000 0.120 0.000 3/57024 940.0 0.919 0.935 0.956 0.000 0.119 0.000 3/57024 950.0 0.910 0.925 0.945 0.000 0.117 0.000 3/57024 960.0 0.901 0.916 0.936 0.000 0.116 0.000 3/57024 970.0 0.891 0.906 0.926 0.000 0.115 0.000 3/57024 980.0 0.882 0.897 0.917 0.000 0.114 0.000 3/57024 990.0 0.874 0.888 0.907 0.000 0.113 0.000 3/57024 1000.0 0.865 0.879 0.898 0.000 0.112 0.000 3/57024 Thermal conductivity related properties were written into "kappa-m121211.hdf5". Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-07 20:44:29]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|