----------------------------- ------- calculate fc2 ------- ----------------------------- _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1 -------------------------[time 2026-01-08 00:22:19]------------------------- Compiled with OpenMP support (max 32 threads). Running in phonopy.load mode. Python version 3.14.2 Spglib version 2.6.1 Crystal structure was read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". Unit of length: angstrom Settings: Supercell: [2 2 1] Primitive matrix: [ 0.66666667 -0.33333333 -0.33333333] [ 0.33333333 0.33333333 -0.66666667] [0.33333333 0.33333333 0.33333333] Spacegroup: R-3 (148) Number of symmetry operations in supercell: 72 ------------------------------ primitive cell ------------------------------ Lattice vectors: a 2.556744488796710 1.476137118855870 4.799506686666660 b -2.556744488796705 1.476137118855870 4.799506686666660 c 0.000000000000003 -2.952274237711744 4.799506686666660 Atomic positions (fractional): *1 F 0.77955957651467 0.38873768987254 0.06514355481555 18.998 2 F 0.38873768987253 0.06514355481555 0.77955957651467 18.998 3 F 0.93485644518445 0.22044042348533 0.61126231012747 18.998 4 F 0.61126231012747 0.93485644518446 0.22044042348533 18.998 5 F 0.22044042348533 0.61126231012747 0.93485644518445 18.998 6 F 0.06514355481555 0.77955957651467 0.38873768987253 18.998 *7 Pd 0.00000000000000 0.00000000000000 0.00000000000000 106.420 *8 Cd 0.50000000000000 0.50000000000000 0.50000000000000 112.411 -------------------------------- unit cell --------------------------------- Lattice vectors: a 5.113488977593416 0.000000000000000 0.000000000000000 b -2.556744488796708 4.428411356567614 0.000000000000000 c 0.000000000000000 0.000000000000000 14.398520059999997 Atomic positions (fractional): *1 F 0.03507930278042 0.67933671891870 0.74448027373425 18.998 > 1 2 F 0.64425741613828 0.96492069721958 0.74448027373425 18.998 > 2 3 F 0.01267005225204 0.31092408280495 0.92218639293242 18.998 > 3 4 F 0.68907591719505 0.70174596944709 0.92218639293242 18.998 > 4 5 F 0.29825403055291 0.98732994774796 0.92218639293242 18.998 > 5 6 F 0.32066328108130 0.35574258386172 0.74448027373425 18.998 > 6 7 F 0.70174596944709 0.01267005225204 0.07781360706758 18.998 > 1 8 F 0.31092408280495 0.29825403055291 0.07781360706758 18.998 > 2 9 F 0.67933671891870 0.64425741613828 0.25551972626575 18.998 > 3 10 F 0.35574258386172 0.03507930278042 0.25551972626575 18.998 > 4 11 F 0.96492069721958 0.32066328108130 0.25551972626575 18.998 > 5 12 F 0.98732994774796 0.68907591719505 0.07781360706758 18.998 > 6 13 F 0.36841263611376 0.34600338558537 0.41114694040092 18.998 > 1 14 F 0.97759074947162 0.63158736388625 0.41114694040092 18.998 > 2 15 F 0.34600338558537 0.97759074947162 0.58885305959908 18.998 > 3 16 F 0.02240925052838 0.36841263611376 0.58885305959908 18.998 > 4 17 F 0.63158736388625 0.65399661441463 0.58885305959908 18.998 > 5 18 F 0.65399661441463 0.02240925052838 0.41114694040092 18.998 > 6 *19 Pd 0.00000000000000 0.00000000000000 0.00000000000000 106.420 > 7 20 Pd 0.66666666666667 0.33333333333333 0.33333333333333 106.420 > 7 21 Pd 0.33333333333333 0.66666666666667 0.66666666666667 106.420 > 7 *22 Cd 0.66666666666667 0.33333333333333 0.83333333333333 112.411 > 8 23 Cd 0.33333333333333 0.66666666666667 0.16666666666667 112.411 > 8 24 Cd 0.00000000000000 0.00000000000000 0.50000000000000 112.411 > 8 -------------------------------- super cell -------------------------------- Lattice vectors: a 10.226977955186833 0.000000000000000 0.000000000000000 b -5.113488977593416 8.856822713135228 0.000000000000000 c 0.000000000000000 0.000000000000000 14.398520059999997 Atomic positions (fractional): *1 F 0.01753965139021 0.33966835945935 0.74448027373425 18.998 > 1 2 F 0.51753965139021 0.33966835945935 0.74448027373425 18.998 > 1 3 F 0.01753965139021 0.83966835945935 0.74448027373425 18.998 > 1 4 F 0.51753965139021 0.83966835945935 0.74448027373425 18.998 > 1 5 F 0.32212870806914 0.48246034860979 0.74448027373425 18.998 > 2 6 F 0.82212870806914 0.48246034860979 0.74448027373425 18.998 > 2 7 F 0.32212870806914 0.98246034860979 0.74448027373425 18.998 > 2 8 F 0.82212870806914 0.98246034860979 0.74448027373425 18.998 > 2 9 F 0.00633502612602 0.15546204140247 0.92218639293242 18.998 > 3 10 F 0.50633502612602 0.15546204140247 0.92218639293242 18.998 > 3 11 F 0.00633502612602 0.65546204140247 0.92218639293242 18.998 > 3 12 F 0.50633502612602 0.65546204140247 0.92218639293242 18.998 > 3 13 F 0.34453795859753 0.35087298472354 0.92218639293242 18.998 > 4 14 F 0.84453795859753 0.35087298472354 0.92218639293242 18.998 > 4 15 F 0.34453795859753 0.85087298472354 0.92218639293242 18.998 > 4 16 F 0.84453795859753 0.85087298472354 0.92218639293242 18.998 > 4 17 F 0.14912701527646 0.49366497387398 0.92218639293242 18.998 > 5 18 F 0.64912701527646 0.49366497387398 0.92218639293242 18.998 > 5 19 F 0.14912701527646 0.99366497387398 0.92218639293242 18.998 > 5 20 F 0.64912701527646 0.99366497387398 0.92218639293242 18.998 > 5 21 F 0.16033164054065 0.17787129193086 0.74448027373425 18.998 > 6 22 F 0.66033164054065 0.17787129193086 0.74448027373425 18.998 > 6 23 F 0.16033164054065 0.67787129193086 0.74448027373425 18.998 > 6 24 F 0.66033164054065 0.67787129193086 0.74448027373425 18.998 > 6 25 F 0.35087298472354 0.00633502612602 0.07781360706758 18.998 > 1 26 F 0.85087298472354 0.00633502612602 0.07781360706758 18.998 > 1 27 F 0.35087298472354 0.50633502612602 0.07781360706758 18.998 > 1 28 F 0.85087298472354 0.50633502612602 0.07781360706758 18.998 > 1 29 F 0.15546204140247 0.14912701527646 0.07781360706758 18.998 > 2 30 F 0.65546204140247 0.14912701527646 0.07781360706758 18.998 > 2 31 F 0.15546204140247 0.64912701527646 0.07781360706758 18.998 > 2 32 F 0.65546204140247 0.64912701527646 0.07781360706758 18.998 > 2 33 F 0.33966835945935 0.32212870806914 0.25551972626575 18.998 > 3 34 F 0.83966835945935 0.32212870806914 0.25551972626575 18.998 > 3 35 F 0.33966835945935 0.82212870806914 0.25551972626575 18.998 > 3 36 F 0.83966835945935 0.82212870806914 0.25551972626575 18.998 > 3 37 F 0.17787129193086 0.01753965139021 0.25551972626575 18.998 > 4 38 F 0.67787129193086 0.01753965139021 0.25551972626575 18.998 > 4 39 F 0.17787129193086 0.51753965139021 0.25551972626575 18.998 > 4 40 F 0.67787129193086 0.51753965139021 0.25551972626575 18.998 > 4 41 F 0.48246034860979 0.16033164054065 0.25551972626575 18.998 > 5 42 F 0.98246034860979 0.16033164054065 0.25551972626575 18.998 > 5 43 F 0.48246034860979 0.66033164054065 0.25551972626575 18.998 > 5 44 F 0.98246034860979 0.66033164054065 0.25551972626575 18.998 > 5 45 F 0.49366497387398 0.34453795859753 0.07781360706758 18.998 > 6 46 F 0.99366497387398 0.34453795859753 0.07781360706758 18.998 > 6 47 F 0.49366497387398 0.84453795859753 0.07781360706758 18.998 > 6 48 F 0.99366497387398 0.84453795859753 0.07781360706758 18.998 > 6 49 F 0.18420631805688 0.17300169279269 0.41114694040092 18.998 > 1 50 F 0.68420631805688 0.17300169279269 0.41114694040092 18.998 > 1 51 F 0.18420631805688 0.67300169279269 0.41114694040092 18.998 > 1 52 F 0.68420631805688 0.67300169279269 0.41114694040092 18.998 > 1 53 F 0.48879537473581 0.31579368194312 0.41114694040092 18.998 > 2 54 F 0.98879537473581 0.31579368194312 0.41114694040092 18.998 > 2 55 F 0.48879537473581 0.81579368194312 0.41114694040092 18.998 > 2 56 F 0.98879537473581 0.81579368194312 0.41114694040092 18.998 > 2 57 F 0.17300169279269 0.48879537473581 0.58885305959908 18.998 > 3 58 F 0.67300169279269 0.48879537473581 0.58885305959908 18.998 > 3 59 F 0.17300169279269 0.98879537473581 0.58885305959908 18.998 > 3 60 F 0.67300169279269 0.98879537473581 0.58885305959908 18.998 > 3 61 F 0.01120462526419 0.18420631805688 0.58885305959908 18.998 > 4 62 F 0.51120462526419 0.18420631805688 0.58885305959908 18.998 > 4 63 F 0.01120462526419 0.68420631805688 0.58885305959908 18.998 > 4 64 F 0.51120462526419 0.68420631805688 0.58885305959908 18.998 > 4 65 F 0.31579368194312 0.32699830720731 0.58885305959908 18.998 > 5 66 F 0.81579368194312 0.32699830720731 0.58885305959908 18.998 > 5 67 F 0.31579368194312 0.82699830720731 0.58885305959908 18.998 > 5 68 F 0.81579368194312 0.82699830720731 0.58885305959908 18.998 > 5 69 F 0.32699830720731 0.01120462526419 0.41114694040092 18.998 > 6 70 F 0.82699830720731 0.01120462526419 0.41114694040092 18.998 > 6 71 F 0.32699830720731 0.51120462526419 0.41114694040092 18.998 > 6 72 F 0.82699830720731 0.51120462526419 0.41114694040092 18.998 > 6 *73 Pd 0.00000000000000 0.00000000000000 0.00000000000000 106.420 > 7 74 Pd 0.50000000000000 0.00000000000000 0.00000000000000 106.420 > 7 75 Pd 0.00000000000000 0.50000000000000 0.00000000000000 106.420 > 7 76 Pd 0.50000000000000 0.50000000000000 0.00000000000000 106.420 > 7 77 Pd 0.33333333333333 0.16666666666667 0.33333333333333 106.420 > 7 78 Pd 0.83333333333333 0.16666666666667 0.33333333333333 106.420 > 7 79 Pd 0.33333333333333 0.66666666666667 0.33333333333333 106.420 > 7 80 Pd 0.83333333333333 0.66666666666667 0.33333333333333 106.420 > 7 81 Pd 0.16666666666667 0.33333333333333 0.66666666666667 106.420 > 7 82 Pd 0.66666666666667 0.33333333333333 0.66666666666667 106.420 > 7 83 Pd 0.16666666666667 0.83333333333333 0.66666666666667 106.420 > 7 84 Pd 0.66666666666667 0.83333333333333 0.66666666666667 106.420 > 7 *85 Cd 0.33333333333333 0.16666666666667 0.83333333333333 112.411 > 8 86 Cd 0.83333333333333 0.16666666666667 0.83333333333333 112.411 > 8 87 Cd 0.33333333333333 0.66666666666667 0.83333333333333 112.411 > 8 88 Cd 0.83333333333333 0.66666666666667 0.83333333333333 112.411 > 8 89 Cd 0.16666666666667 0.33333333333333 0.16666666666667 112.411 > 8 90 Cd 0.66666666666667 0.33333333333333 0.16666666666667 112.411 > 8 91 Cd 0.16666666666667 0.83333333333333 0.16666666666667 112.411 > 8 92 Cd 0.66666666666667 0.83333333333333 0.16666666666667 112.411 > 8 93 Cd 0.00000000000000 0.00000000000000 0.50000000000000 112.411 > 8 94 Cd 0.50000000000000 0.00000000000000 0.50000000000000 112.411 > 8 95 Cd 0.00000000000000 0.50000000000000 0.50000000000000 112.411 > 8 96 Cd 0.50000000000000 0.50000000000000 0.50000000000000 112.411 > 8 ---------------------------------------------------------------------------- NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". --------------------------- Dielectric constant ---------------------------- 3.3810135 0.0000001 0.0000000 -0.0000001 3.3810135 0.0000000 0.0000000 0.0000000 3.6292818 -------------------------- Born effective charges -------------------------- 1 F -1.2947324 -0.1598795 0.7361129 -0.2212115 -0.5166731 0.2069509 0.7387001 0.1393479 -0.9648545 2 F -0.5461707 -0.2109708 -0.1888317 -0.2723028 -1.2652348 -0.7409679 -0.2486712 -0.7094070 -0.9648545 3 F -0.8762052 0.4628483 -0.5472811 0.4015162 -0.9352003 0.5340170 -0.4900289 0.5700591 -0.9648545 4 F -0.5461707 -0.2109708 -0.1888317 -0.2723028 -1.2652348 -0.7409679 -0.2486712 -0.7094070 -0.9648545 5 F -1.2947324 -0.1598795 0.7361129 -0.2212115 -0.5166731 0.2069509 0.7387001 0.1393479 -0.9648545 6 F -0.8762052 0.4628483 -0.5472811 0.4015162 -0.9352003 0.5340170 -0.4900289 0.5700591 -0.9648545 7 Pd 2.8027933 -0.5404068 -0.0000000 0.5404068 2.8027933 0.0000000 -0.0000000 0.0000000 2.8226848 8 Cd 2.6314231 0.3564106 -0.0000000 -0.3564106 2.6314231 0.0000000 -0.0000000 0.0000000 2.9664423 ---------------------------------------------------------------------------- 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: 4920/4920 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 620 Number of blocks in projector: 296 Finding block diagonal structure in projector. Using scipy connected_components. Number of blocks in projector (Sum rule): 7 --- Eigsh_solver_block: 1 / 7 --- Block_size: 284 Use standard eigh solver. --- Eigsh_solver_block: 2 / 7 --- Block_size: 252 Use standard eigh solver. --- Eigsh_solver_block: 3 / 7 --- Block_size: 80 Use standard eigh solver. --- Eigsh_solver_block: 4 / 7 --- Block_size: 1 Use standard eigh solver. --- Eigsh_solver_block: 5 / 7 --- Block_size: 1 Use standard eigh solver. --- Eigsh_solver_block: 6 / 7 --- Block_size: 1 Use standard eigh solver. --- Eigsh_solver_block: 7 / 7 --- Block_size: 1 Use standard eigh solver. Tree of FC basis block matrices: - (620, 606), data: False |-- (1, 1), data: True |-- (1, 1), data: True |-- (1, 1), data: True |-- (1, 1), data: True |-- (80, 77), data: True |-- (252, 248), data: True |-- (284, 277), data: True ----- Solver_atoms: 1 -- 96 / 96 Time (Solver_compr_matrix_reshape): 0.008 Solver_block: 100 / 160 - Time: 0.177 Solver_block: 160 / 160 - Time: 0.119 Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 0.308 --------------------------------- Symfc end -------------------------------- Max drift of force constants: -0.00000000 (zz) -0.00000000 (zz) Permutation basis: 288/288 Permutation basis: 4920/4920 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 620 Number of blocks in projector: 296 Finding block diagonal structure in projector. Using scipy connected_components. Number of blocks in projector (Sum rule): 7 --- Eigsh_solver_block: 1 / 7 --- Block_size: 284 Use standard eigh solver. --- Eigsh_solver_block: 2 / 7 --- Block_size: 252 Use standard eigh solver. --- Eigsh_solver_block: 3 / 7 --- Block_size: 80 Use standard eigh solver. --- Eigsh_solver_block: 4 / 7 --- Block_size: 1 Use standard eigh solver. --- Eigsh_solver_block: 5 / 7 --- Block_size: 1 Use standard eigh solver. --- Eigsh_solver_block: 6 / 7 --- Block_size: 1 Use standard eigh solver. --- Eigsh_solver_block: 7 / 7 --- Block_size: 1 Use standard eigh solver. Tree of FC basis block matrices: - (620, 606), data: False |-- (1, 1), data: True |-- (1, 1), data: True |-- (1, 1), data: True |-- (1, 1), data: True |-- (80, 77), data: True |-- (252, 248), data: True |-- (284, 277), data: True Max drift after symmetrization by symfc projector: -0.00000000 (xx) -0.00000000 (xx) Force constants are written into "force_constants.hdf5". ---------------------------------------------------------------------------- One of the following run modes may be specified for phonon calculations. - Mesh sampling (MESH, --mesh) - Q-points (QPOINTS, --qpoints) - Band structure (BAND, --band) - Animation (ANIME, --anime) - Modulation (MODULATION, --modulation) - Characters of Irreps (IRREPS, --irreps) - Create displacements (CREATE_DISPLACEMENTS, -d) ---------------------------------------------------------------------------- Summary of calculation was written in "phonopy.yaml". -------------------------[time 2026-01-08 00:22:26]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate fc3 ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 00:22:26]------------------------- Compiled with OpenMP support (max 32 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: force constants HDF5 data compression filter: gzip Crystal structure was read from "phono3py_mlp_eval_fc3_disp.yaml.xz". Supercell (dim): [2 2 1] Primitive matrix: [ 0.66666667 -0.33333333 -0.33333333] [ 0.33333333 0.33333333 -0.66666667] [0.33333333 0.33333333 0.33333333] Spacegroup: R-3 (148) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 2.556744488796710 1.476137118855870 4.799506686666660 b -2.556744488796705 1.476137118855870 4.799506686666660 c 0.000000000000003 -2.952274237711744 4.799506686666660 Atomic positions (fractional): 1 F 0.77955957651467 0.38873768987254 0.06514355481555 18.998 2 F 0.38873768987253 0.06514355481555 0.77955957651467 18.998 3 F 0.93485644518445 0.22044042348533 0.61126231012747 18.998 4 F 0.61126231012747 0.93485644518446 0.22044042348533 18.998 5 F 0.22044042348533 0.61126231012747 0.93485644518445 18.998 6 F 0.06514355481555 0.77955957651467 0.38873768987253 18.998 7 Pd 0.00000000000000 0.00000000000000 0.00000000000000 106.420 8 Cd 0.50000000000000 0.50000000000000 0.50000000000000 112.411 -------------------------------- supercell --------------------------------- Lattice vectors: a 10.226977955186833 0.000000000000000 0.000000000000000 b -5.113488977593416 8.856822713135228 0.000000000000000 c 0.000000000000000 0.000000000000000 14.398520059999997 Atomic positions (fractional): 1 F 0.01753965139021 0.33966835945935 0.74448027373425 18.998 > 1 2 F 0.51753965139021 0.33966835945935 0.74448027373425 18.998 > 1 3 F 0.01753965139021 0.83966835945935 0.74448027373425 18.998 > 1 4 F 0.51753965139021 0.83966835945935 0.74448027373425 18.998 > 1 5 F 0.32212870806914 0.48246034860979 0.74448027373425 18.998 > 5 6 F 0.82212870806914 0.48246034860979 0.74448027373425 18.998 > 5 7 F 0.32212870806914 0.98246034860979 0.74448027373425 18.998 > 5 8 F 0.82212870806914 0.98246034860979 0.74448027373425 18.998 > 5 9 F 0.00633502612602 0.15546204140247 0.92218639293242 18.998 > 9 10 F 0.50633502612602 0.15546204140247 0.92218639293242 18.998 > 9 11 F 0.00633502612602 0.65546204140247 0.92218639293242 18.998 > 9 12 F 0.50633502612602 0.65546204140247 0.92218639293242 18.998 > 9 13 F 0.34453795859753 0.35087298472354 0.92218639293242 18.998 > 13 14 F 0.84453795859753 0.35087298472354 0.92218639293242 18.998 > 13 15 F 0.34453795859753 0.85087298472354 0.92218639293242 18.998 > 13 16 F 0.84453795859753 0.85087298472354 0.92218639293242 18.998 > 13 17 F 0.14912701527646 0.49366497387398 0.92218639293242 18.998 > 17 18 F 0.64912701527646 0.49366497387398 0.92218639293242 18.998 > 17 19 F 0.14912701527646 0.99366497387398 0.92218639293242 18.998 > 17 20 F 0.64912701527646 0.99366497387398 0.92218639293242 18.998 > 17 21 F 0.16033164054065 0.17787129193086 0.74448027373425 18.998 > 21 22 F 0.66033164054065 0.17787129193086 0.74448027373425 18.998 > 21 23 F 0.16033164054065 0.67787129193086 0.74448027373425 18.998 > 21 24 F 0.66033164054065 0.67787129193086 0.74448027373425 18.998 > 21 25 F 0.35087298472354 0.00633502612602 0.07781360706758 18.998 > 1 26 F 0.85087298472354 0.00633502612602 0.07781360706758 18.998 > 1 27 F 0.35087298472354 0.50633502612602 0.07781360706758 18.998 > 1 28 F 0.85087298472354 0.50633502612602 0.07781360706758 18.998 > 1 29 F 0.15546204140247 0.14912701527646 0.07781360706758 18.998 > 5 30 F 0.65546204140247 0.14912701527646 0.07781360706758 18.998 > 5 31 F 0.15546204140247 0.64912701527646 0.07781360706758 18.998 > 5 32 F 0.65546204140247 0.64912701527646 0.07781360706758 18.998 > 5 33 F 0.33966835945935 0.32212870806914 0.25551972626575 18.998 > 9 34 F 0.83966835945935 0.32212870806914 0.25551972626575 18.998 > 9 35 F 0.33966835945935 0.82212870806914 0.25551972626575 18.998 > 9 36 F 0.83966835945935 0.82212870806914 0.25551972626575 18.998 > 9 37 F 0.17787129193086 0.01753965139021 0.25551972626575 18.998 > 13 38 F 0.67787129193086 0.01753965139021 0.25551972626575 18.998 > 13 39 F 0.17787129193086 0.51753965139021 0.25551972626575 18.998 > 13 40 F 0.67787129193086 0.51753965139021 0.25551972626575 18.998 > 13 41 F 0.48246034860979 0.16033164054065 0.25551972626575 18.998 > 17 42 F 0.98246034860979 0.16033164054065 0.25551972626575 18.998 > 17 43 F 0.48246034860979 0.66033164054065 0.25551972626575 18.998 > 17 44 F 0.98246034860979 0.66033164054065 0.25551972626575 18.998 > 17 45 F 0.49366497387398 0.34453795859753 0.07781360706758 18.998 > 21 46 F 0.99366497387398 0.34453795859753 0.07781360706758 18.998 > 21 47 F 0.49366497387398 0.84453795859753 0.07781360706758 18.998 > 21 48 F 0.99366497387398 0.84453795859753 0.07781360706758 18.998 > 21 49 F 0.18420631805688 0.17300169279269 0.41114694040092 18.998 > 1 50 F 0.68420631805688 0.17300169279269 0.41114694040092 18.998 > 1 51 F 0.18420631805688 0.67300169279269 0.41114694040092 18.998 > 1 52 F 0.68420631805688 0.67300169279269 0.41114694040092 18.998 > 1 53 F 0.48879537473581 0.31579368194312 0.41114694040092 18.998 > 5 54 F 0.98879537473581 0.31579368194312 0.41114694040092 18.998 > 5 55 F 0.48879537473581 0.81579368194312 0.41114694040092 18.998 > 5 56 F 0.98879537473581 0.81579368194312 0.41114694040092 18.998 > 5 57 F 0.17300169279269 0.48879537473581 0.58885305959908 18.998 > 9 58 F 0.67300169279269 0.48879537473581 0.58885305959908 18.998 > 9 59 F 0.17300169279269 0.98879537473581 0.58885305959908 18.998 > 9 60 F 0.67300169279269 0.98879537473581 0.58885305959908 18.998 > 9 61 F 0.01120462526419 0.18420631805688 0.58885305959908 18.998 > 13 62 F 0.51120462526419 0.18420631805688 0.58885305959908 18.998 > 13 63 F 0.01120462526419 0.68420631805688 0.58885305959908 18.998 > 13 64 F 0.51120462526419 0.68420631805688 0.58885305959908 18.998 > 13 65 F 0.31579368194312 0.32699830720731 0.58885305959908 18.998 > 17 66 F 0.81579368194312 0.32699830720731 0.58885305959908 18.998 > 17 67 F 0.31579368194312 0.82699830720731 0.58885305959908 18.998 > 17 68 F 0.81579368194312 0.82699830720731 0.58885305959908 18.998 > 17 69 F 0.32699830720731 0.01120462526419 0.41114694040092 18.998 > 21 70 F 0.82699830720731 0.01120462526419 0.41114694040092 18.998 > 21 71 F 0.32699830720731 0.51120462526419 0.41114694040092 18.998 > 21 72 F 0.82699830720731 0.51120462526419 0.41114694040092 18.998 > 21 73 Pd 0.00000000000000 0.00000000000000 0.00000000000000 106.420 > 73 74 Pd 0.50000000000000 0.00000000000000 0.00000000000000 106.420 > 73 75 Pd 0.00000000000000 0.50000000000000 0.00000000000000 106.420 > 73 76 Pd 0.50000000000000 0.50000000000000 0.00000000000000 106.420 > 73 77 Pd 0.33333333333333 0.16666666666667 0.33333333333333 106.420 > 73 78 Pd 0.83333333333333 0.16666666666667 0.33333333333333 106.420 > 73 79 Pd 0.33333333333333 0.66666666666667 0.33333333333333 106.420 > 73 80 Pd 0.83333333333333 0.66666666666667 0.33333333333333 106.420 > 73 81 Pd 0.16666666666667 0.33333333333333 0.66666666666667 106.420 > 73 82 Pd 0.66666666666667 0.33333333333333 0.66666666666667 106.420 > 73 83 Pd 0.16666666666667 0.83333333333333 0.66666666666667 106.420 > 73 84 Pd 0.66666666666667 0.83333333333333 0.66666666666667 106.420 > 73 85 Cd 0.33333333333333 0.16666666666667 0.83333333333333 112.411 > 85 86 Cd 0.83333333333333 0.16666666666667 0.83333333333333 112.411 > 85 87 Cd 0.33333333333333 0.66666666666667 0.83333333333333 112.411 > 85 88 Cd 0.83333333333333 0.66666666666667 0.83333333333333 112.411 > 85 89 Cd 0.16666666666667 0.33333333333333 0.16666666666667 112.411 > 85 90 Cd 0.66666666666667 0.33333333333333 0.16666666666667 112.411 > 85 91 Cd 0.16666666666667 0.83333333333333 0.16666666666667 112.411 > 85 92 Cd 0.66666666666667 0.83333333333333 0.16666666666667 112.411 > 85 93 Cd 0.00000000000000 0.00000000000000 0.50000000000000 112.411 > 85 94 Cd 0.50000000000000 0.00000000000000 0.50000000000000 112.411 > 85 95 Cd 0.00000000000000 0.50000000000000 0.50000000000000 112.411 > 85 96 Cd 0.50000000000000 0.50000000000000 0.50000000000000 112.411 > 85 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz". --------------------------- Dielectric constant ---------------------------- 3.3810135 0.0000001 0.0000000 -0.0000001 3.3810135 0.0000000 0.0000000 0.0000000 3.6292818 -------------------------- Born effective charges -------------------------- 1 F -1.2947324 -0.1598795 0.7361129 -0.2212115 -0.5166731 0.2069509 0.7387001 0.1393479 -0.9648545 2 F -0.5461707 -0.2109708 -0.1888317 -0.2723028 -1.2652348 -0.7409679 -0.2486712 -0.7094070 -0.9648545 3 F -0.8762052 0.4628483 -0.5472811 0.4015162 -0.9352003 0.5340170 -0.4900289 0.5700591 -0.9648545 4 F -0.5461707 -0.2109708 -0.1888317 -0.2723028 -1.2652348 -0.7409679 -0.2486712 -0.7094070 -0.9648545 5 F -1.2947324 -0.1598795 0.7361129 -0.2212115 -0.5166731 0.2069509 0.7387001 0.1393479 -0.9648545 6 F -0.8762052 0.4628483 -0.5472811 0.4015162 -0.9352003 0.5340170 -0.4900289 0.5700591 -0.9648545 7 Pd 2.8027933 -0.5404068 -0.0000000 0.5404068 2.8027933 0.0000000 -0.0000000 0.0000000 2.8226848 8 Cd 2.6314231 0.3564106 -0.0000000 -0.3564106 2.6314231 0.0000000 -0.0000000 0.0000000 2.9664423 ---------------------------------------------------------------------------- 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] [-0.0050 0.0087 0.0000] [ 0.0050 -0.0087 0.0000] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100] Computing fc3[ 73, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100] Computing fc3[ 85, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100] Expanding fc3. Symmetrizing fc3 by traditional approach (N=3). Symmetrizing fc2 by traditional approach (N=3). Max drift of fc3: -0.00000002 (xxx) -0.00000002 (xxx) -0.00000002 (xxx) fc3 was written into "fc3.hdf5". Max drift of fc2: 0.00000016 (yx) 0.00000016 (yx) fc2 was written into "fc2.hdf5". --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperatures: 0.0 300.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 ----------- None of ph-ph interaction calculation was performed. ----------- Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-08 00:22:34]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate LTC ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 00:22:34]------------------------- Compiled with OpenMP support (max 32 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: conductivity-RTA HDF5 data compression filter: gzip Crystal structure was read from "phono3py.yaml". Supercell (dim): [2 2 1] Primitive matrix: [ 0.66666667 -0.33333333 -0.33333333] [ 0.33333333 0.33333333 -0.66666667] [0.33333333 0.33333333 0.33333333] Spacegroup: R-3 (148) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 2.556744488796710 1.476137118855870 4.799506686666660 b -2.556744488796705 1.476137118855870 4.799506686666660 c 0.000000000000003 -2.952274237711744 4.799506686666660 Atomic positions (fractional): 1 F 0.77955957651467 0.38873768987254 0.06514355481555 18.998 2 F 0.38873768987253 0.06514355481555 0.77955957651467 18.998 3 F 0.93485644518445 0.22044042348533 0.61126231012747 18.998 4 F 0.61126231012747 0.93485644518446 0.22044042348533 18.998 5 F 0.22044042348533 0.61126231012747 0.93485644518445 18.998 6 F 0.06514355481555 0.77955957651467 0.38873768987253 18.998 7 Pd 0.00000000000000 0.00000000000000 0.00000000000000 106.420 8 Cd 0.50000000000000 0.50000000000000 0.50000000000000 112.411 -------------------------------- supercell --------------------------------- Lattice vectors: a 10.226977955186833 0.000000000000000 0.000000000000000 b -5.113488977593416 8.856822713135228 0.000000000000000 c 0.000000000000000 0.000000000000000 14.398520059999997 Atomic positions (fractional): 1 F 0.01753965139021 0.33966835945935 0.74448027373425 18.998 > 1 2 F 0.51753965139021 0.33966835945935 0.74448027373425 18.998 > 1 3 F 0.01753965139021 0.83966835945935 0.74448027373425 18.998 > 1 4 F 0.51753965139021 0.83966835945935 0.74448027373425 18.998 > 1 5 F 0.32212870806914 0.48246034860979 0.74448027373425 18.998 > 5 6 F 0.82212870806914 0.48246034860979 0.74448027373425 18.998 > 5 7 F 0.32212870806914 0.98246034860979 0.74448027373425 18.998 > 5 8 F 0.82212870806914 0.98246034860979 0.74448027373425 18.998 > 5 9 F 0.00633502612602 0.15546204140247 0.92218639293242 18.998 > 9 10 F 0.50633502612602 0.15546204140247 0.92218639293242 18.998 > 9 11 F 0.00633502612602 0.65546204140247 0.92218639293242 18.998 > 9 12 F 0.50633502612602 0.65546204140247 0.92218639293242 18.998 > 9 13 F 0.34453795859753 0.35087298472354 0.92218639293242 18.998 > 13 14 F 0.84453795859753 0.35087298472354 0.92218639293242 18.998 > 13 15 F 0.34453795859753 0.85087298472354 0.92218639293242 18.998 > 13 16 F 0.84453795859753 0.85087298472354 0.92218639293242 18.998 > 13 17 F 0.14912701527646 0.49366497387398 0.92218639293242 18.998 > 17 18 F 0.64912701527646 0.49366497387398 0.92218639293242 18.998 > 17 19 F 0.14912701527646 0.99366497387398 0.92218639293242 18.998 > 17 20 F 0.64912701527646 0.99366497387398 0.92218639293242 18.998 > 17 21 F 0.16033164054065 0.17787129193086 0.74448027373425 18.998 > 21 22 F 0.66033164054065 0.17787129193086 0.74448027373425 18.998 > 21 23 F 0.16033164054065 0.67787129193086 0.74448027373425 18.998 > 21 24 F 0.66033164054065 0.67787129193086 0.74448027373425 18.998 > 21 25 F 0.35087298472354 0.00633502612602 0.07781360706758 18.998 > 1 26 F 0.85087298472354 0.00633502612602 0.07781360706758 18.998 > 1 27 F 0.35087298472354 0.50633502612602 0.07781360706758 18.998 > 1 28 F 0.85087298472354 0.50633502612602 0.07781360706758 18.998 > 1 29 F 0.15546204140247 0.14912701527646 0.07781360706758 18.998 > 5 30 F 0.65546204140247 0.14912701527646 0.07781360706758 18.998 > 5 31 F 0.15546204140247 0.64912701527646 0.07781360706758 18.998 > 5 32 F 0.65546204140247 0.64912701527646 0.07781360706758 18.998 > 5 33 F 0.33966835945935 0.32212870806914 0.25551972626575 18.998 > 9 34 F 0.83966835945935 0.32212870806914 0.25551972626575 18.998 > 9 35 F 0.33966835945935 0.82212870806914 0.25551972626575 18.998 > 9 36 F 0.83966835945935 0.82212870806914 0.25551972626575 18.998 > 9 37 F 0.17787129193086 0.01753965139021 0.25551972626575 18.998 > 13 38 F 0.67787129193086 0.01753965139021 0.25551972626575 18.998 > 13 39 F 0.17787129193086 0.51753965139021 0.25551972626575 18.998 > 13 40 F 0.67787129193086 0.51753965139021 0.25551972626575 18.998 > 13 41 F 0.48246034860979 0.16033164054065 0.25551972626575 18.998 > 17 42 F 0.98246034860979 0.16033164054065 0.25551972626575 18.998 > 17 43 F 0.48246034860979 0.66033164054065 0.25551972626575 18.998 > 17 44 F 0.98246034860979 0.66033164054065 0.25551972626575 18.998 > 17 45 F 0.49366497387398 0.34453795859753 0.07781360706758 18.998 > 21 46 F 0.99366497387398 0.34453795859753 0.07781360706758 18.998 > 21 47 F 0.49366497387398 0.84453795859753 0.07781360706758 18.998 > 21 48 F 0.99366497387398 0.84453795859753 0.07781360706758 18.998 > 21 49 F 0.18420631805688 0.17300169279269 0.41114694040092 18.998 > 1 50 F 0.68420631805688 0.17300169279269 0.41114694040092 18.998 > 1 51 F 0.18420631805688 0.67300169279269 0.41114694040092 18.998 > 1 52 F 0.68420631805688 0.67300169279269 0.41114694040092 18.998 > 1 53 F 0.48879537473581 0.31579368194312 0.41114694040092 18.998 > 5 54 F 0.98879537473581 0.31579368194312 0.41114694040092 18.998 > 5 55 F 0.48879537473581 0.81579368194312 0.41114694040092 18.998 > 5 56 F 0.98879537473581 0.81579368194312 0.41114694040092 18.998 > 5 57 F 0.17300169279269 0.48879537473581 0.58885305959908 18.998 > 9 58 F 0.67300169279269 0.48879537473581 0.58885305959908 18.998 > 9 59 F 0.17300169279269 0.98879537473581 0.58885305959908 18.998 > 9 60 F 0.67300169279269 0.98879537473581 0.58885305959908 18.998 > 9 61 F 0.01120462526419 0.18420631805688 0.58885305959908 18.998 > 13 62 F 0.51120462526419 0.18420631805688 0.58885305959908 18.998 > 13 63 F 0.01120462526419 0.68420631805688 0.58885305959908 18.998 > 13 64 F 0.51120462526419 0.68420631805688 0.58885305959908 18.998 > 13 65 F 0.31579368194312 0.32699830720731 0.58885305959908 18.998 > 17 66 F 0.81579368194312 0.32699830720731 0.58885305959908 18.998 > 17 67 F 0.31579368194312 0.82699830720731 0.58885305959908 18.998 > 17 68 F 0.81579368194312 0.82699830720731 0.58885305959908 18.998 > 17 69 F 0.32699830720731 0.01120462526419 0.41114694040092 18.998 > 21 70 F 0.82699830720731 0.01120462526419 0.41114694040092 18.998 > 21 71 F 0.32699830720731 0.51120462526419 0.41114694040092 18.998 > 21 72 F 0.82699830720731 0.51120462526419 0.41114694040092 18.998 > 21 73 Pd 0.00000000000000 0.00000000000000 0.00000000000000 106.420 > 73 74 Pd 0.50000000000000 0.00000000000000 0.00000000000000 106.420 > 73 75 Pd 0.00000000000000 0.50000000000000 0.00000000000000 106.420 > 73 76 Pd 0.50000000000000 0.50000000000000 0.00000000000000 106.420 > 73 77 Pd 0.33333333333333 0.16666666666667 0.33333333333333 106.420 > 73 78 Pd 0.83333333333333 0.16666666666667 0.33333333333333 106.420 > 73 79 Pd 0.33333333333333 0.66666666666667 0.33333333333333 106.420 > 73 80 Pd 0.83333333333333 0.66666666666667 0.33333333333333 106.420 > 73 81 Pd 0.16666666666667 0.33333333333333 0.66666666666667 106.420 > 73 82 Pd 0.66666666666667 0.33333333333333 0.66666666666667 106.420 > 73 83 Pd 0.16666666666667 0.83333333333333 0.66666666666667 106.420 > 73 84 Pd 0.66666666666667 0.83333333333333 0.66666666666667 106.420 > 73 85 Cd 0.33333333333333 0.16666666666667 0.83333333333333 112.411 > 85 86 Cd 0.83333333333333 0.16666666666667 0.83333333333333 112.411 > 85 87 Cd 0.33333333333333 0.66666666666667 0.83333333333333 112.411 > 85 88 Cd 0.83333333333333 0.66666666666667 0.83333333333333 112.411 > 85 89 Cd 0.16666666666667 0.33333333333333 0.16666666666667 112.411 > 85 90 Cd 0.66666666666667 0.33333333333333 0.16666666666667 112.411 > 85 91 Cd 0.16666666666667 0.83333333333333 0.16666666666667 112.411 > 85 92 Cd 0.66666666666667 0.83333333333333 0.16666666666667 112.411 > 85 93 Cd 0.00000000000000 0.00000000000000 0.50000000000000 112.411 > 85 94 Cd 0.50000000000000 0.00000000000000 0.50000000000000 112.411 > 85 95 Cd 0.00000000000000 0.50000000000000 0.50000000000000 112.411 > 85 96 Cd 0.50000000000000 0.50000000000000 0.50000000000000 112.411 > 85 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py.yaml". --------------------------- Dielectric constant ---------------------------- 3.3810135 0.0000001 0.0000000 -0.0000001 3.3810135 0.0000000 0.0000000 0.0000000 3.6292818 -------------------------- Born effective charges -------------------------- 1 F -1.2947324 -0.1598795 0.7361129 -0.2212115 -0.5166731 0.2069509 0.7387001 0.1393479 -0.9648545 2 F -0.5461707 -0.2109708 -0.1888317 -0.2723028 -1.2652348 -0.7409679 -0.2486712 -0.7094070 -0.9648545 3 F -0.8762052 0.4628483 -0.5472811 0.4015162 -0.9352003 0.5340170 -0.4900289 0.5700591 -0.9648545 4 F -0.5461707 -0.2109708 -0.1888317 -0.2723028 -1.2652348 -0.7409679 -0.2486712 -0.7094070 -0.9648545 5 F -1.2947324 -0.1598795 0.7361129 -0.2212115 -0.5166731 0.2069509 0.7387001 0.1393479 -0.9648545 6 F -0.8762052 0.4628483 -0.5472811 0.4015162 -0.9352003 0.5340170 -0.4900289 0.5700591 -0.9648545 7 Pd 2.8027933 -0.5404068 -0.0000000 0.5404068 2.8027933 0.0000000 -0.0000000 0.0000000 2.8226848 8 Cd 2.6314231 0.3564106 -0.0000000 -0.3564106 2.6314231 0.0000000 -0.0000000 0.0000000 2.9664423 ---------------------------------------------------------------------------- fc3 was read from "fc3.hdf5". fc2 was read from "fc2.hdf5". ----------------------------- Force constants ------------------------------ Max drift of fc3: -0.00000002 (xxx) -0.00000002 (xxx) -0.00000002 (xxx) Max drift of fc2: -0.00000000 (xx) -0.00000000 (xx) --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperature: 0.0 10.0 20.0 30.0 40.0 ... 1000.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 Length for sampling mesh generation: 50.00 Generating grid system ... [ 12 12 12 ] 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: 0.87, Number of G-points: 297, Lambda: 0.17 Running harmonic phonon calculations... -------------------- Lattice thermal conductivity (RTA) -------------------- ======================= Grid point 0 (1/294) ======================= q-point: ( 0.00 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 294 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 3.502 ( 0.000 0.000 0.000) 0.000 3.502 ( 0.000 0.000 0.000) 0.000 3.965 ( 0.000 0.000 0.000) 0.000 4.086 ( 0.000 0.000 0.000) 0.000 4.086 ( 0.000 0.000 0.000) 0.000 5.757 ( 0.000 0.000 0.000) 0.000 6.345 ( 0.000 0.000 0.000) 0.000 6.345 ( 0.000 0.000 0.000) 0.000 7.080 ( 0.000 0.000 0.000) 0.000 7.499 ( 0.000 0.000 0.000) 0.000 7.499 ( 0.000 0.000 0.000) 0.000 7.899 ( 0.000 0.000 0.000) 0.000 9.142 ( 0.000 0.000 0.000) 0.000 9.890 ( 0.000 0.000 0.000) 0.000 9.890 ( 0.000 0.000 0.000) 0.000 16.057 ( 0.000 0.000 0.000) 0.000 16.057 ( 0.000 0.000 0.000) 0.000 17.071 ( 0.000 0.000 0.000) 0.000 17.241 ( 0.000 0.000 0.000) 0.000 17.241 ( 0.000 0.000 0.000) 0.000 17.405 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 1 (2/294) ======================= q-point: ( 0.08 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.341 ( -3.373 30.295 20.770) 36.886 0.513 ( 24.576 10.813 0.960) 26.867 0.583 ( 29.849 1.870 11.650) 32.096 3.326 ( -13.371 -5.294 -4.078) 14.947 3.440 ( -1.191 -8.897 -1.892) 9.173 4.038 ( -0.455 6.581 3.146) 7.308 4.161 ( 5.907 1.222 3.028) 6.749 4.635 ( -8.216 -4.781 -4.055) 10.335 5.723 ( -2.732 -1.475 1.455) 3.429 6.336 ( -0.328 -0.396 -1.438) 1.527 6.455 ( 5.740 3.691 1.850) 7.071 7.086 ( 0.063 0.065 1.714) 1.716 7.497 ( 0.928 -1.007 -1.165) 1.797 7.545 ( 3.175 2.328 2.950) 4.920 7.923 ( 1.945 1.320 -0.053) 2.351 9.119 ( -4.137 -2.822 3.714) 6.235 9.872 ( -0.214 -2.860 -1.427) 3.203 10.035 ( -2.845 1.471 -5.792) 6.618 16.066 ( 1.431 0.475 -1.484) 2.115 16.088 ( 1.624 1.645 3.073) 3.846 17.054 ( -1.255 -0.518 -0.839) 1.596 17.243 ( -0.192 1.939 -2.829) 3.435 17.370 ( -1.084 0.162 -3.435) 3.605 18.820 ( -1.099 -3.436 7.636) 8.445 ======================= Grid point 2 (3/294) ======================= q-point: ( 0.17 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 868 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.705 ( -1.314 29.567 20.975) 36.276 1.009 ( 22.931 13.213 -3.283) 26.668 1.132 ( 27.509 -0.969 14.293) 31.016 2.999 ( -15.643 -6.353 -5.022) 17.615 3.297 ( -1.603 -12.915 -2.702) 13.292 4.083 ( -3.975 5.896 1.142) 7.202 4.258 ( 1.619 -0.032 0.644) 1.742 4.378 ( -9.936 -6.427 -7.089) 13.794 5.685 ( -1.641 -0.333 1.616) 2.327 6.321 ( 0.485 -0.570 -1.776) 1.927 6.611 ( 5.744 4.766 3.270) 8.149 7.102 ( -0.226 -0.017 4.081) 4.088 7.506 ( 2.852 -0.736 -2.465) 3.841 7.675 ( 6.350 3.336 5.157) 8.835 7.978 ( 2.693 2.080 -0.474) 3.435 9.014 ( -6.280 -4.199 1.132) 7.639 9.802 ( -1.944 -4.813 -5.631) 7.658 9.956 ( -5.152 1.491 -1.613) 5.600 16.098 ( 3.116 1.035 -2.619) 4.200 16.170 ( 2.654 2.792 5.428) 6.656 17.019 ( -1.684 -0.122 -1.388) 2.186 17.227 ( -1.255 1.262 -4.787) 5.107 17.317 ( -4.080 -0.172 0.117) 4.085 18.814 ( 0.670 -4.241 4.358) 6.118 ======================= Grid point 3 (4/294) ======================= q-point: ( 0.25 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.089 ( 0.233 27.648 20.528) 34.436 1.455 ( 19.028 15.253 -8.674) 25.884 1.612 ( 23.123 -4.362 15.657) 28.264 2.672 ( -13.108 -5.985 -3.004) 14.720 3.125 ( -1.557 -14.449 -2.975) 14.834 3.928 ( -12.423 -6.395 -5.624) 15.061 4.188 ( -4.666 4.159 -1.692) 6.475 4.259 ( -3.204 -2.667 -2.597) 4.911 5.682 ( -0.241 0.984 1.176) 1.552 6.325 ( 1.641 -0.331 -1.316) 2.130 6.754 ( 4.140 4.549 2.408) 6.605 7.127 ( -0.429 0.121 6.687) 6.702 7.555 ( 5.571 0.378 -3.481) 6.580 7.864 ( 8.596 3.022 6.718) 11.321 8.036 ( 2.210 2.382 -0.871) 3.363 8.854 ( -8.183 -5.128 0.380) 9.665 9.649 ( -5.898 -3.970 -9.618) 11.961 9.891 ( -3.484 -0.181 1.309) 3.726 16.159 ( 4.922 1.585 -3.136) 6.047 16.280 ( 2.798 3.283 6.568) 7.857 16.982 ( -1.806 0.222 -1.666) 2.467 17.170 ( -2.249 -1.521 -4.129) 4.942 17.237 ( -6.035 0.810 -0.426) 6.103 18.815 ( 1.487 -4.087 3.317) 5.470 ======================= Grid point 4 (5/294) ======================= q-point: ( 0.33 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 868 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.447 ( -0.126 22.556 18.180) 28.970 1.794 ( 12.252 13.013 -9.534) 20.257 1.920 ( 9.174 -4.207 4.670) 11.121 2.512 ( 1.670 -3.817 7.406) 8.498 2.943 ( -1.503 -14.929 -2.994) 15.301 3.640 ( -9.160 -7.024 -5.192) 12.657 4.084 ( -9.110 -0.912 -8.469) 12.472 4.176 ( -3.776 1.826 1.863) 4.590 5.703 ( 0.447 1.338 0.867) 1.656 6.347 ( 1.803 -0.119 -0.762) 1.961 6.854 ( 2.518 3.241 0.631) 4.152 7.169 ( -0.213 0.923 7.598) 7.657 7.655 ( 8.068 1.448 -3.483) 8.906 8.056 ( 5.385 -1.686 5.505) 7.883 8.100 ( 4.500 6.152 0.586) 7.645 8.666 ( -8.603 -5.435 0.823) 10.209 9.440 ( -8.162 -2.771 -10.493) 13.579 9.850 ( -1.882 -1.126 1.562) 2.693 16.249 ( 6.105 1.808 -2.896) 6.995 16.390 ( 2.109 3.231 6.126) 7.240 16.944 ( -1.492 -0.299 -1.944) 2.469 17.087 ( -3.348 -3.577 0.210) 4.904 17.136 ( -5.966 1.771 -3.827) 7.306 18.823 ( 1.557 -3.025 2.432) 4.182 ======================= Grid point 5 (6/294) ======================= q-point: ( 0.42 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.666 ( -2.142 8.550 8.586) 12.305 1.899 ( -2.489 1.656 0.275) 3.003 2.040 ( 7.088 10.294 -5.810) 13.783 2.689 ( 9.522 -5.575 5.195) 12.196 2.787 ( 1.612 -8.388 3.440) 9.209 3.468 ( -2.839 -4.658 -1.220) 5.590 3.845 ( -11.151 -0.891 -9.264) 14.525 4.150 ( -2.331 1.285 0.963) 2.831 5.725 ( 0.420 0.854 0.515) 1.082 6.367 ( 1.036 -0.027 -0.348) 1.094 6.906 ( 1.171 1.488 -0.123) 1.898 7.216 ( 0.005 1.140 4.959) 5.089 7.794 ( 8.221 2.115 -2.353) 8.809 8.089 ( 1.034 -1.692 1.468) 2.467 8.243 ( 1.305 4.078 1.063) 4.412 8.524 ( -2.672 -4.172 3.999) 6.367 9.230 ( -7.359 -1.665 -8.476) 11.348 9.826 ( -0.799 -0.877 0.923) 1.503 16.346 ( 5.058 1.267 -1.788) 5.512 16.473 ( 0.979 2.487 3.750) 4.605 16.912 ( 0.544 -1.473 -2.633) 3.066 16.994 ( -6.588 -1.685 4.807) 8.327 17.054 ( -1.682 0.760 -5.508) 5.809 18.834 ( 0.967 -1.557 1.310) 2.253 ======================= Grid point 6 (7/294) ======================= q-point: (-0.50 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 436 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.687 ( 0.000 0.000 0.000) 0.000 1.895 ( 0.000 -0.000 0.000) 0.000 2.154 ( 0.000 0.000 0.000) 0.000 2.644 ( 0.000 0.000 0.000) 0.000 2.895 ( 0.000 0.000 0.000) 0.000 3.429 ( 0.000 0.000 0.000) 0.000 3.690 ( -0.000 0.000 -0.000) 0.000 4.139 ( 0.000 0.000 -0.000) 0.000 5.735 ( 0.000 0.000 0.000) 0.000 6.375 ( 0.000 0.000 0.000) 0.000 6.922 ( 0.000 0.000 0.000) 0.000 7.238 ( 0.000 0.000 0.000) 0.000 7.884 ( 0.000 0.000 0.000) 0.000 8.091 ( 0.000 0.000 0.000) 0.000 8.237 ( 0.000 0.000 0.000) 0.000 8.530 ( 0.000 0.000 0.000) 0.000 9.123 ( 0.000 0.000 0.000) 0.000 9.818 ( 0.000 0.000 0.000) 0.000 16.393 ( 0.000 0.000 0.000) 0.000 16.505 ( 0.000 0.000 0.000) 0.000 16.917 ( -0.000 0.000 0.000) 0.000 16.923 ( 0.000 -0.000 -0.000) 0.000 17.029 ( 0.000 -0.000 0.000) 0.000 18.839 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 14 (8/294) ======================= q-point: ( 0.08 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.288 ( 17.735 14.672 0.498) 23.023 0.356 ( 3.348 5.441 21.141) 22.085 0.861 ( -6.667 30.415 23.153) 38.802 3.402 ( 0.127 -6.774 -5.562) 8.766 3.430 ( -6.634 -7.311 0.356) 9.879 4.033 ( 5.325 -0.637 4.925) 7.281 4.107 ( -0.413 3.752 -2.532) 4.545 4.616 ( -0.041 -9.196 -6.417) 11.213 5.729 ( 0.154 -4.071 1.952) 4.518 6.378 ( -1.225 1.214 3.154) 3.595 6.409 ( 1.459 4.739 -2.445) 5.529 7.090 ( 0.081 -1.202 2.273) 2.573 7.494 ( -2.356 -0.238 -0.234) 2.379 7.579 ( 1.087 5.676 5.319) 7.854 7.921 ( 0.093 2.204 -0.384) 2.239 9.148 ( -0.703 -7.154 4.752) 8.618 9.849 ( -3.673 -1.953 -4.400) 6.055 9.992 ( 4.342 0.864 -7.432) 8.650 16.052 ( -0.259 0.004 -0.734) 0.779 16.111 ( 0.701 3.284 3.443) 4.810 17.047 ( 0.287 -1.503 -1.359) 2.046 17.275 ( 4.095 3.093 -0.103) 5.133 17.360 ( -0.357 3.781 -4.699) 6.042 18.820 ( -3.691 -9.567 6.568) 12.178 ======================= Grid point 15 (9/294) ======================= q-point: ( 0.17 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.756 ( 21.362 -0.980 24.511) 32.528 0.788 ( 23.586 16.483 -6.130) 29.421 1.183 ( -4.423 29.026 22.451) 36.961 3.152 ( -14.223 -3.570 -11.541) 18.661 3.215 ( -6.110 -14.634 2.748) 16.094 4.169 ( 2.390 4.162 -4.246) 6.408 4.173 ( 6.521 -1.014 4.682) 8.091 4.404 ( -7.914 -9.560 -8.934) 15.292 5.694 ( -0.422 -3.577 1.036) 3.747 6.340 ( -3.008 1.757 -0.312) 3.497 6.556 ( 7.656 3.752 2.077) 8.775 7.098 ( 1.329 -2.768 3.114) 4.373 7.462 ( -0.190 -0.571 -1.234) 1.373 7.705 ( 1.555 8.307 7.307) 11.172 7.959 ( 1.992 2.765 -0.794) 3.499 9.050 ( -4.057 -7.220 1.035) 8.346 9.760 ( -1.799 -2.414 -6.271) 6.956 9.991 ( -0.407 -1.197 -3.535) 3.754 16.054 ( 1.250 0.027 -1.183) 1.721 16.197 ( 2.140 4.444 4.786) 6.873 17.022 ( -0.469 -1.310 -1.595) 2.117 17.318 ( -4.328 5.265 1.426) 6.963 17.359 ( -0.907 1.488 -2.417) 2.980 18.722 ( 1.608 -10.252 0.934) 10.420 ======================= Grid point 16 (10/294) ======================= q-point: ( 0.25 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.231 ( 20.734 8.155 6.618) 23.242 1.273 ( 22.407 6.055 6.231) 24.033 1.513 ( -1.988 24.303 20.806) 32.054 2.816 ( -14.236 -3.795 -8.985) 17.257 3.001 ( -3.609 -15.347 -0.005) 15.766 4.038 ( -12.398 -8.841 -6.317) 16.486 4.226 ( 1.053 -0.989 -5.233) 5.428 4.265 ( -0.587 1.617 0.856) 1.922 5.672 ( 1.031 -2.357 -0.666) 2.657 6.323 ( -0.930 1.929 -0.307) 2.163 6.719 ( 6.335 3.270 2.058) 7.420 7.117 ( 2.641 -4.545 4.308) 6.796 7.471 ( 2.744 0.519 -2.056) 3.468 7.866 ( 2.954 8.176 8.465) 12.134 8.020 ( 2.532 3.145 -1.273) 4.233 8.904 ( -5.384 -7.718 -0.413) 9.420 9.652 ( -4.321 -1.709 -7.610) 8.916 9.935 ( -2.421 -1.930 -1.045) 3.268 16.083 ( 3.287 0.435 -1.871) 3.808 16.310 ( 2.617 4.517 5.661) 7.701 16.989 ( -0.934 -1.394 -1.698) 2.387 17.266 ( -7.912 5.212 -0.596) 9.493 17.321 ( -3.763 0.048 0.132) 3.765 18.689 ( 5.750 -9.811 -1.129) 11.428 ======================= Grid point 17 (11/294) ======================= q-point: ( 0.33 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.634 ( 15.621 11.803 -5.429) 20.317 1.676 ( 15.413 2.027 7.497) 17.259 1.783 ( 0.079 11.833 16.803) 20.551 2.567 ( -7.555 -0.412 -1.307) 7.679 2.819 ( -2.117 -12.664 0.357) 12.845 3.716 ( -11.521 -8.550 -4.135) 14.931 4.149 ( -5.193 -0.563 -8.182) 9.708 4.252 ( -2.937 0.387 1.353) 3.256 5.673 ( 2.385 -1.996 -1.997) 3.696 6.340 ( 0.380 2.456 0.157) 2.490 6.837 ( 3.594 2.696 0.716) 4.549 7.147 ( 3.853 -5.764 3.742) 7.879 7.542 ( 5.823 1.947 -1.094) 6.237 8.033 ( 2.840 4.302 5.874) 7.815 8.093 ( 3.677 5.292 1.135) 6.544 8.730 ( -6.622 -7.732 -0.234) 10.183 9.499 ( -7.495 0.203 -8.868) 11.613 9.877 ( -2.078 -2.402 1.013) 3.334 16.149 ( 5.386 0.812 -2.101) 5.838 16.424 ( 2.229 3.972 5.489) 7.133 16.939 ( -1.666 -2.961 -2.030) 3.958 17.175 ( -7.470 4.307 -0.709) 8.652 17.242 ( -5.942 -0.106 0.193) 5.946 18.703 ( 6.864 -8.021 -1.655) 10.686 ======================= Grid point 18 (12/294) ======================= q-point: ( 0.42 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.765 ( -2.185 -0.663 -1.118) 2.543 1.886 ( 3.742 -3.473 0.461) 5.126 1.955 ( 9.420 7.662 -6.183) 13.626 2.627 ( 6.542 6.508 11.152) 14.475 2.724 ( -1.429 -4.254 6.847) 8.187 3.487 ( -6.096 -6.548 0.574) 8.964 3.964 ( -9.980 0.656 -10.519) 14.515 4.202 ( -3.234 -1.176 0.782) 3.529 5.683 ( 2.931 -2.490 -2.700) 4.699 6.374 ( 0.187 3.025 0.395) 3.056 6.899 ( 1.493 1.366 0.331) 2.051 7.168 ( 4.102 -6.131 -0.280) 7.382 7.682 ( 8.074 3.149 1.240) 8.754 8.082 ( 0.194 0.907 0.379) 1.002 8.260 ( 4.794 6.001 5.206) 9.278 8.550 ( -6.080 -7.610 0.819) 9.775 9.324 ( -9.007 2.534 -7.881) 12.234 9.837 ( -1.125 -2.070 1.762) 2.942 16.245 ( 6.582 0.812 -1.597) 6.821 16.510 ( 0.529 2.880 3.899) 4.876 16.859 ( -0.975 -5.050 -2.950) 5.929 17.115 ( -5.170 5.082 0.961) 7.313 17.133 ( -7.071 -0.231 0.371) 7.084 18.734 ( 6.348 -6.045 -2.271) 9.055 ======================= Grid point 19 (13/294) ======================= q-point: ( 0.50 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.670 ( -2.740 -5.424 -4.931) 7.825 1.825 ( 1.024 -8.810 -3.634) 9.584 2.073 ( 5.090 -0.645 -7.481) 9.071 2.765 ( -2.360 9.835 9.238) 13.698 2.892 ( 5.972 5.399 9.019) 12.089 3.401 ( 0.500 -6.214 6.337) 8.889 3.763 ( -8.101 4.345 -9.486) 13.210 4.143 ( -1.952 -2.444 0.166) 3.132 5.686 ( 2.774 -3.304 -2.962) 5.233 6.402 ( -0.888 3.377 0.551) 3.535 6.921 ( 0.257 -0.279 0.731) 0.824 7.156 ( 3.532 -6.331 -5.221) 8.934 7.857 ( 6.669 3.601 2.865) 8.102 8.085 ( 0.076 -0.214 0.520) 0.568 8.309 ( -6.864 -0.034 2.920) 7.460 8.476 ( 4.170 -3.035 -0.696) 5.205 9.195 ( -6.106 5.053 -2.198) 8.225 9.820 ( -0.305 -1.144 1.395) 1.830 16.346 ( 5.213 0.193 -0.345) 5.228 16.523 ( -2.254 -0.426 0.628) 2.378 16.813 ( 3.107 -3.275 -3.453) 5.683 17.023 ( -6.155 -0.466 1.422) 6.335 17.108 ( -3.812 5.992 3.388) 7.869 18.764 ( 5.234 -4.406 -3.340) 7.613 ======================= Grid point 20 (14/294) ======================= q-point: (-0.42 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.482 ( -2.527 -15.688 -11.950) 19.882 1.816 ( 5.330 -1.117 0.228) 5.451 2.047 ( -0.840 -6.558 0.921) 6.676 2.866 ( -4.837 1.643 -0.531) 5.136 2.926 ( -7.144 14.805 -0.828) 16.459 3.459 ( 5.044 -2.025 7.776) 9.487 3.767 ( 5.428 6.677 2.435) 8.943 4.101 ( 0.146 -3.056 -0.351) 3.079 5.676 ( 2.258 -3.960 -2.794) 5.346 6.414 ( -2.061 3.375 0.901) 4.055 6.908 ( -0.893 -2.319 0.404) 2.517 7.111 ( 3.040 -5.645 -8.234) 10.436 7.916 ( -4.815 0.065 2.978) 5.662 8.119 ( 0.815 3.385 -0.752) 3.562 8.220 ( -1.371 -5.010 4.958) 7.181 8.486 ( 1.336 0.858 -7.349) 7.518 9.228 ( 2.107 5.972 6.121) 8.807 9.819 ( 0.284 -0.291 0.414) 0.581 16.388 ( -0.499 -1.730 1.578) 2.394 16.456 ( -2.153 -2.680 -2.954) 4.533 16.855 ( 5.874 -0.101 -3.735) 6.962 16.958 ( -2.075 -0.362 2.285) 3.108 17.139 ( -3.098 6.245 6.226) 9.347 18.782 ( 4.108 -3.120 -4.727) 6.997 ======================= Grid point 21 (15/294) ======================= q-point: (-0.33 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.172 ( -4.528 -20.449 -14.616) 25.540 1.882 ( -3.689 -7.189 6.497) 10.368 1.988 ( 1.631 -0.585 3.373) 3.792 2.626 ( -13.735 4.570 -13.437) 19.751 3.041 ( 1.934 10.219 0.141) 10.401 3.608 ( 7.461 3.601 7.298) 11.040 3.998 ( 9.157 5.202 7.397) 12.869 4.087 ( 2.376 -2.951 -0.844) 3.881 5.656 ( 1.764 -4.060 -2.083) 4.892 6.410 ( -3.026 3.013 1.456) 4.512 6.848 ( -1.876 -4.677 -1.976) 5.413 7.068 ( 2.778 -3.440 -7.361) 8.586 7.803 ( -8.713 -0.633 1.987) 8.959 8.102 ( -2.790 -2.861 1.817) 4.390 8.160 ( -5.941 0.024 -3.100) 6.701 8.551 ( 8.683 3.182 -3.005) 9.724 9.408 ( 6.947 5.065 9.126) 12.538 9.826 ( 0.853 -0.007 -0.869) 1.218 16.316 ( -3.813 -4.968 1.107) 6.360 16.386 ( -3.286 -0.304 -3.419) 4.752 16.917 ( 2.636 -0.450 0.189) 2.680 16.999 ( 6.057 0.669 -0.461) 6.111 17.193 ( -2.628 6.138 8.013) 10.430 18.785 ( 3.295 -2.142 -6.185) 7.328 ======================= Grid point 22 (16/294) ======================= q-point: (-0.25 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.801 ( -6.877 -20.434 -12.929) 25.140 1.655 ( -15.202 -15.197 12.719) 24.976 1.917 ( -16.292 5.549 -11.235) 20.554 2.554 ( 7.280 7.017 -4.013) 10.879 3.172 ( 5.566 5.744 -2.258) 8.311 3.851 ( 11.075 5.863 7.137) 14.421 4.078 ( 2.106 -3.170 0.427) 3.830 4.222 ( 6.523 3.409 3.847) 8.305 5.639 ( 1.633 -3.161 -0.949) 3.683 6.391 ( -3.390 2.335 1.860) 4.517 6.745 ( -2.676 -5.150 -3.637) 6.849 7.052 ( 2.456 -1.759 -4.808) 5.678 7.675 ( -7.408 0.953 0.085) 7.470 7.954 ( -8.472 -6.300 -0.609) 10.575 8.082 ( -4.214 2.532 -1.506) 5.141 8.735 ( 10.372 2.950 -0.907) 10.821 9.629 ( 7.912 4.032 9.100) 12.715 9.835 ( 1.596 -0.444 -2.290) 2.827 16.215 ( -3.363 -4.246 0.253) 5.423 16.297 ( -5.043 -0.048 -2.418) 5.593 16.955 ( 2.065 -0.424 1.748) 2.739 17.117 ( 7.559 -0.161 -0.533) 7.579 17.256 ( -2.516 5.903 8.210) 10.420 18.779 ( 2.902 -1.546 -7.419) 8.115 ======================= Grid point 23 (17/294) ======================= q-point: (-0.17 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.452 ( -9.632 -11.650 -3.773) 15.580 1.277 ( -21.332 -16.837 13.348) 30.277 1.526 ( -26.172 6.679 -16.558) 31.682 2.825 ( 15.488 7.233 0.947) 17.120 3.293 ( 7.815 0.023 -4.628) 9.082 4.044 ( -1.260 3.368 3.962) 5.350 4.171 ( 13.104 -1.075 2.382) 13.362 4.324 ( 2.783 1.425 1.064) 3.303 5.644 ( 1.932 -1.288 -0.009) 2.322 6.369 ( -2.447 1.337 1.340) 3.093 6.631 ( -4.158 -3.378 -2.295) 5.828 7.056 ( 2.035 -0.887 -2.372) 3.249 7.587 ( -4.885 3.051 -2.694) 6.359 7.753 ( -8.712 -5.452 0.518) 10.290 8.026 ( -4.021 0.750 -0.287) 4.101 8.912 ( 8.847 1.925 -0.946) 9.104 9.830 ( 4.066 3.957 5.228) 7.714 9.847 ( 5.247 -2.245 -0.954) 5.786 16.136 ( -2.521 -2.157 -0.548) 3.363 16.202 ( -5.150 -0.194 -0.490) 5.177 16.996 ( 1.988 -0.059 1.542) 2.516 17.220 ( 5.526 -1.908 1.322) 5.994 17.314 ( -1.985 5.508 6.385) 8.663 18.767 ( 2.735 -1.303 -7.800) 8.368 ======================= Grid point 24 (18/294) ======================= q-point: (-0.08 0.08 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.336 ( -11.301 18.262 19.087) 28.732 0.818 ( -24.428 -17.517 14.504) 33.375 1.036 ( -30.040 7.860 -16.211) 35.028 3.153 ( 15.779 5.427 0.352) 16.690 3.352 ( 8.099 -7.485 -8.146) 13.710 4.069 ( -3.091 5.632 5.993) 8.786 4.212 ( -3.880 -3.466 -0.349) 5.214 4.492 ( 13.109 0.036 -0.330) 13.113 5.677 ( 2.619 -0.047 0.535) 2.674 6.352 ( -0.711 -0.226 -0.730) 1.044 6.527 ( -6.104 0.250 1.175) 6.221 7.071 ( 1.139 -0.087 0.047) 1.143 7.531 ( -2.689 2.733 -6.108) 7.212 7.598 ( -6.082 -3.082 4.350) 8.088 7.966 ( -3.630 0.370 0.016) 3.649 9.040 ( 6.164 0.117 -0.706) 6.206 9.848 ( 2.302 -0.672 -3.735) 4.439 9.992 ( 5.293 0.550 4.507) 6.973 16.087 ( -1.752 0.578 -1.496) 2.375 16.127 ( -4.054 -0.590 2.041) 4.577 17.034 ( 1.762 -0.012 0.627) 1.870 17.266 ( 0.900 -1.414 2.086) 2.676 17.366 ( 0.570 1.614 2.366) 2.920 18.760 ( 2.358 -0.159 -4.732) 5.290 ======================= Grid point 26 (19/294) ======================= q-point: ( 0.08 0.17 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.366 ( -12.426 -4.223 19.215) 23.269 0.678 ( -19.587 9.299 1.251) 21.718 1.377 ( -6.879 27.530 21.386) 35.533 3.146 ( 14.984 -7.414 -3.336) 17.047 3.418 ( 1.087 -4.656 -0.295) 4.790 4.014 ( 0.369 0.594 -0.306) 0.763 4.182 ( -5.543 -1.682 -3.715) 6.881 4.420 ( 6.645 -8.152 -7.409) 12.865 5.682 ( 0.926 -4.587 1.059) 4.798 6.360 ( 3.121 3.034 0.401) 4.371 6.523 ( -7.377 1.953 0.921) 7.687 7.093 ( -1.113 -2.660 2.654) 3.919 7.537 ( -1.265 2.709 -1.230) 3.233 7.675 ( -1.847 5.791 8.496) 10.446 7.962 ( -1.697 3.796 -0.348) 4.173 9.070 ( 3.968 -6.703 1.758) 7.985 9.840 ( 0.783 -4.843 -11.075) 12.113 9.887 ( 1.768 0.239 0.079) 1.786 16.065 ( -1.655 0.671 -1.256) 2.183 16.175 ( -1.549 3.571 4.895) 6.254 17.003 ( 1.199 -2.197 -2.508) 3.544 17.216 ( 3.853 3.993 -5.322) 7.689 17.355 ( 2.356 -0.988 2.528) 3.594 18.837 ( -3.186 -5.868 3.231) 7.418 ======================= Grid point 27 (20/294) ======================= q-point: ( 0.17 0.17 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 868 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.562 ( 16.400 14.262 -0.075) 21.734 0.687 ( 5.247 4.630 19.425) 20.647 1.648 ( -5.306 25.181 19.911) 32.538 3.161 ( -1.085 -9.860 -5.566) 11.375 3.258 ( -9.410 -9.388 -2.205) 13.474 4.066 ( 3.559 -0.354 1.119) 3.748 4.145 ( 4.050 2.465 -4.506) 6.541 4.338 ( -1.259 -8.332 -7.540) 11.308 5.645 ( 0.726 -6.010 -0.473) 6.072 6.433 ( -5.442 2.125 -1.293) 5.984 6.480 ( 6.102 3.037 3.477) 7.652 7.066 ( 0.084 -3.919 2.209) 4.499 7.491 ( -3.579 0.387 -0.275) 3.610 7.808 ( 2.408 8.136 7.425) 11.274 7.979 ( -1.309 4.960 0.356) 5.143 9.017 ( -1.101 -9.455 -0.182) 9.521 9.735 ( -1.266 -1.472 -7.257) 7.512 9.930 ( 2.841 -1.322 -2.583) 4.061 16.044 ( -0.571 0.256 -0.919) 1.112 16.245 ( 0.950 5.309 5.238) 7.519 16.988 ( 1.150 -2.552 -2.344) 3.651 17.326 ( 4.975 4.479 -4.413) 8.018 17.397 ( 1.169 1.604 2.694) 3.346 18.666 ( -6.689 -10.931 0.536) 12.827 ======================= Grid point 28 (21/294) ======================= q-point: ( 0.25 0.17 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.999 ( 20.874 5.600 9.470) 23.595 1.047 ( 17.377 10.104 7.060) 21.305 1.887 ( -4.276 18.222 15.757) 24.466 2.956 ( -12.175 -0.717 -10.633) 16.180 2.973 ( -7.964 -13.884 4.112) 16.526 4.055 ( -4.811 -10.693 -8.159) 14.285 4.148 ( 2.959 -0.996 -1.537) 3.480 4.278 ( 1.338 2.765 -1.080) 3.256 5.599 ( 1.811 -5.496 -3.131) 6.579 6.376 ( -3.019 2.222 -0.750) 3.823 6.640 ( 7.486 1.924 3.623) 8.536 7.049 ( 1.378 -5.182 2.192) 5.793 7.457 ( -0.791 0.878 -0.081) 1.185 7.959 ( 3.036 6.313 3.438) 7.803 8.022 ( -0.480 6.312 2.672) 6.871 8.888 ( -3.074 -9.105 -0.761) 9.640 9.669 ( -2.618 0.721 -5.717) 6.329 9.919 ( 0.179 -2.701 -2.015) 3.374 16.044 ( 1.004 0.366 -1.105) 1.537 16.351 ( 1.749 5.559 5.234) 7.833 16.963 ( 0.516 -2.802 -2.265) 3.640 17.358 ( -0.838 1.334 -2.258) 2.753 17.436 ( -3.856 4.714 1.750) 6.336 18.497 ( 1.285 -12.413 -2.096) 12.654 ======================= Grid point 29 (22/294) ======================= q-point: ( 0.33 0.17 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 868 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.423 ( 19.411 1.240 8.575) 21.257 1.453 ( 16.789 10.430 0.150) 19.766 1.980 ( -4.748 2.104 4.952) 7.176 2.682 ( -9.154 -6.526 -1.860) 11.395 2.858 ( -6.207 6.103 6.971) 11.152 3.779 ( -9.596 -10.479 -4.898) 15.029 4.147 ( -0.640 0.158 -6.894) 6.925 4.296 ( -1.492 -0.278 1.500) 2.134 5.569 ( 3.557 -4.758 -5.480) 8.082 6.370 ( -0.471 2.745 0.103) 2.787 6.786 ( 6.090 1.145 2.333) 6.622 7.036 ( 2.466 -6.881 1.764) 7.519 7.489 ( 2.991 2.193 0.482) 3.740 8.046 ( 2.563 2.675 -1.492) 3.993 8.124 ( 1.636 6.793 5.175) 8.695 8.747 ( -4.609 -7.259 0.795) 8.635 9.583 ( -5.956 2.858 -5.840) 8.817 9.876 ( -0.843 -3.273 -0.096) 3.381 16.075 ( 3.177 0.748 -1.449) 3.571 16.460 ( 1.806 4.835 4.803) 7.051 16.917 ( -0.934 -4.055 -2.377) 4.792 17.318 ( -3.836 1.912 -3.443) 5.497 17.372 ( -9.281 3.216 4.072) 10.633 18.457 ( 8.807 -11.113 -3.822) 14.686 ======================= Grid point 30 (23/294) ======================= q-point: ( 0.42 0.17 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.692 ( 8.451 -4.732 4.143) 10.535 1.756 ( 11.799 9.465 -9.852) 18.052 1.852 ( -3.930 -10.226 -4.407) 11.808 2.591 ( 3.784 -4.326 9.310) 10.941 2.937 ( -6.109 16.384 12.580) 21.541 3.530 ( -7.156 -8.413 -0.945) 11.085 4.049 ( -6.168 1.562 -9.801) 11.685 4.246 ( -3.668 -2.691 1.915) 4.936 5.559 ( 4.695 -4.615 -6.391) 9.175 6.406 ( 0.637 3.566 0.748) 3.699 6.880 ( 3.183 1.018 0.607) 3.396 7.017 ( 3.529 -8.558 -0.377) 9.264 7.601 ( 6.624 3.179 1.986) 7.611 8.086 ( 0.855 1.724 -1.760) 2.607 8.244 ( 4.988 2.365 2.261) 5.965 8.609 ( -7.065 -4.529 3.341) 9.033 9.468 ( -8.470 5.391 -5.536) 11.465 9.838 ( -0.613 -3.114 1.748) 3.623 16.145 ( 5.372 1.009 -1.432) 5.651 16.550 ( 0.988 3.742 3.680) 5.340 16.820 ( -2.707 -6.426 -3.151) 7.652 17.236 ( -5.776 1.559 -2.779) 6.597 17.289 ( -7.649 4.302 5.414) 10.312 18.500 ( 10.462 -9.106 -4.802) 14.677 ======================= Grid point 31 (24/294) ======================= q-point: ( 0.50 0.17 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 868 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.615 ( -5.339 -12.494 -6.879) 15.229 1.705 ( 1.929 -5.094 -3.508) 6.479 1.925 ( 7.652 2.316 -9.701) 12.570 2.788 ( 10.411 -0.415 14.422) 17.792 3.068 ( -4.973 15.430 11.001) 19.591 3.387 ( -2.521 -6.632 2.203) 7.429 3.888 ( -8.577 4.495 -9.948) 13.883 4.166 ( -3.595 -3.153 2.031) 5.195 5.558 ( 4.869 -4.905 -5.905) 9.090 6.456 ( -0.036 4.430 0.975) 4.537 6.918 ( 0.331 -0.352 0.948) 1.064 6.984 ( 4.331 -8.319 -4.877) 10.571 7.777 ( 8.743 3.365 3.252) 9.916 8.089 ( -0.363 0.172 -1.117) 1.187 8.343 ( 6.556 -3.279 -2.110) 7.628 8.471 ( -9.419 -0.577 4.942) 10.652 9.365 ( -8.174 7.692 -2.428) 11.484 9.819 ( -0.119 -2.339 2.211) 3.220 16.247 ( 6.512 0.793 -0.753) 6.603 16.574 ( -3.711 -0.218 0.904) 3.825 16.720 ( 1.568 -4.341 -3.040) 5.527 17.131 ( -6.641 -0.268 0.245) 6.651 17.274 ( -5.178 7.406 5.457) 10.556 18.556 ( 9.628 -7.710 -5.857) 13.654 ======================= Grid point 32 (25/294) ======================= q-point: (-0.42 0.17 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.356 ( -6.342 -12.989 -7.465) 16.268 1.717 ( 5.338 -0.093 -2.031) 5.712 1.960 ( 3.568 -3.852 -4.774) 7.097 2.952 ( -1.100 0.624 7.759) 7.861 3.166 ( -6.260 12.396 -0.716) 13.905 3.349 ( 5.865 -7.921 6.227) 11.658 3.809 ( -1.170 7.420 -3.516) 8.293 4.109 ( -2.768 -0.622 3.477) 4.487 5.556 ( 4.384 -5.117 -4.403) 8.048 6.494 ( -1.610 4.975 1.271) 5.382 6.880 ( -0.136 -6.385 -2.598) 6.895 6.967 ( 3.138 -2.633 -4.280) 5.925 7.948 ( 4.232 1.963 2.026) 5.086 8.089 ( 2.757 -0.066 1.007) 2.936 8.293 ( -6.284 -6.308 4.464) 9.961 8.416 ( 0.893 1.798 -6.118) 6.439 9.341 ( -3.758 8.465 2.846) 9.689 9.812 ( 0.225 -1.701 1.378) 2.201 16.348 ( 4.807 -0.265 0.794) 4.879 16.461 ( -4.523 -4.339 -2.335) 6.688 16.751 ( 4.575 0.636 -2.685) 5.343 17.030 ( -5.438 -0.771 1.873) 5.803 17.310 ( -4.259 8.409 7.086) 11.792 18.597 ( 8.284 -6.665 -7.026) 12.744 ======================= Grid point 33 (26/294) ======================= q-point: (-0.33 0.17 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 868 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.084 ( -9.377 -9.658 -4.692) 14.256 1.844 ( 7.078 2.163 0.542) 7.421 1.937 ( 2.141 -6.961 2.680) 7.760 2.829 ( -13.607 1.078 -6.350) 15.055 3.118 ( -4.722 5.905 -4.727) 8.917 3.481 ( 11.135 -4.752 4.224) 12.822 3.940 ( 8.198 4.222 2.535) 9.564 4.112 ( -2.549 5.009 6.045) 8.254 5.556 ( 3.670 -4.700 -2.100) 6.322 6.509 ( -3.311 4.654 1.826) 5.996 6.789 ( -0.089 -6.561 -5.328) 8.453 6.973 ( 2.102 -1.290 -2.518) 3.524 7.923 ( -5.538 -0.197 -1.569) 5.759 8.156 ( -5.708 -7.752 6.818) 11.797 8.192 ( 1.867 3.497 -0.230) 3.971 8.426 ( 5.407 1.734 -6.577) 8.689 9.432 ( 2.227 7.000 6.099) 9.548 9.806 ( 0.511 -1.669 -0.197) 1.756 16.326 ( -3.661 -4.657 -0.759) 5.972 16.408 ( 0.202 -0.035 -0.415) 0.463 16.831 ( 5.916 1.679 -3.427) 7.040 16.976 ( -1.573 -1.108 3.317) 3.835 17.367 ( -3.994 8.138 8.038) 12.116 18.620 ( 6.957 -5.517 -7.955) 11.921 ======================= Grid point 34 (27/294) ======================= q-point: (-0.25 0.17 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.840 ( -12.774 -0.738 3.401) 13.239 1.793 ( -8.107 -11.253 10.219) 17.227 2.041 ( 2.846 3.369 -0.868) 4.495 2.581 ( -9.194 6.331 -11.834) 16.268 3.082 ( 1.946 -2.000 -6.497) 7.071 3.663 ( 14.488 -3.363 0.773) 14.894 4.086 ( 3.220 0.684 4.135) 5.286 4.205 ( 2.091 7.753 4.733) 9.322 5.568 ( 3.064 -3.132 0.594) 4.422 6.488 ( -4.429 2.092 0.910) 4.983 6.711 ( -0.674 -2.836 -3.048) 4.218 6.983 ( 1.975 -0.880 -1.835) 2.835 7.801 ( -7.330 1.659 -4.329) 8.673 8.018 ( -6.900 -8.081 5.902) 12.155 8.176 ( -4.395 3.154 -3.079) 6.225 8.571 ( 11.141 1.514 -1.392) 11.330 9.594 ( 5.932 4.498 6.271) 9.734 9.795 ( 1.028 -1.885 -1.871) 2.848 16.228 ( -3.173 -2.492 -1.364) 4.259 16.373 ( -4.065 -0.292 0.763) 4.146 16.918 ( 4.135 0.910 -1.198) 4.400 17.005 ( 4.409 -1.106 2.409) 5.145 17.418 ( -3.772 6.410 7.263) 10.396 18.632 ( 5.689 -3.795 -7.989) 10.516 ======================= Grid point 35 (28/294) ======================= q-point: (-0.17 0.17 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 868 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.741 ( -13.210 14.663 15.623) 25.171 1.533 ( -17.539 -14.993 15.816) 27.974 1.884 ( -19.638 6.059 -12.950) 24.292 2.653 ( 12.057 6.557 -2.570) 13.963 3.067 ( 7.342 -7.232 -10.150) 14.465 3.894 ( 17.213 -3.612 -0.712) 17.602 4.145 ( -0.582 3.342 5.077) 6.106 4.308 ( 1.741 2.191 0.527) 2.848 5.605 ( 2.471 -0.691 2.428) 3.533 6.420 ( -3.583 -0.954 -1.799) 4.122 6.679 ( -2.911 1.743 2.467) 4.195 7.004 ( 2.375 -0.264 -0.565) 2.456 7.681 ( -6.115 3.820 -8.064) 10.817 7.855 ( -8.489 -6.666 6.942) 12.833 8.109 ( -4.802 1.866 -1.700) 5.425 8.757 ( 10.696 0.368 -0.674) 10.723 9.744 ( 4.931 -0.634 -0.217) 4.977 9.806 ( 3.991 0.553 1.734) 4.387 16.162 ( -2.704 0.437 -1.517) 3.131 16.295 ( -5.600 -0.630 2.119) 6.021 16.971 ( 2.254 0.150 0.857) 2.416 17.103 ( 6.892 -1.540 1.359) 7.191 17.438 ( -3.376 2.568 3.817) 5.706 18.650 ( 4.470 -0.853 -5.937) 7.481 ======================= Grid point 36 (29/294) ======================= q-point: (-0.08 0.17 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.857 ( -10.377 25.329 22.138) 35.204 1.145 ( -23.296 -16.161 18.055) 33.613 1.485 ( -26.087 7.988 -14.432) 30.864 2.907 ( 14.508 -3.626 -2.713) 15.198 3.089 ( 10.472 -1.692 -9.112) 13.984 4.098 ( 10.881 -5.929 -0.282) 12.394 4.207 ( 1.557 3.327 3.431) 5.026 4.319 ( 1.741 -1.066 -2.774) 3.444 5.654 ( 1.574 0.550 2.368) 2.896 6.350 ( -1.722 -1.184 -2.751) 3.455 6.659 ( -5.359 3.238 4.836) 7.911 7.052 ( 2.338 0.752 2.459) 3.475 7.572 ( -4.829 2.140 -8.383) 9.909 7.727 ( -7.345 -0.601 7.099) 10.233 8.037 ( -4.447 0.721 -0.758) 4.568 8.909 ( 8.716 -1.383 -0.329) 8.831 9.765 ( 3.560 -1.163 -5.209) 6.416 9.921 ( 5.461 -1.138 3.008) 6.338 16.127 ( -2.432 2.932 -2.420) 4.513 16.216 ( -5.203 -0.865 4.396) 6.866 17.007 ( 1.729 -0.294 0.304) 1.780 17.199 ( 5.440 -1.999 1.640) 6.023 17.390 ( -2.808 -3.060 -2.223) 4.711 18.706 ( 3.813 3.118 -0.694) 4.974 ======================= Grid point 38 (30/294) ======================= q-point: ( 0.08 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.711 ( -21.511 -9.536 21.435) 31.829 1.093 ( -22.353 7.800 -6.282) 24.494 1.824 ( -4.936 21.266 16.140) 27.150 2.832 ( 14.376 -3.669 1.073) 14.875 3.319 ( 6.878 -0.906 -1.082) 7.021 3.965 ( 6.106 -4.650 -6.609) 10.128 4.091 ( 0.485 -8.132 -5.888) 10.051 4.289 ( 2.479 -1.537 -2.201) 3.654 5.642 ( -1.177 -4.431 -0.266) 4.592 6.357 ( 1.459 3.804 0.151) 4.077 6.664 ( -7.231 0.581 1.432) 7.394 7.109 ( -2.375 -3.815 3.369) 5.616 7.576 ( -0.329 4.990 -0.973) 5.095 7.835 ( -6.096 3.745 6.605) 9.737 8.036 ( -1.303 6.102 1.464) 6.409 8.925 ( 6.256 -7.200 0.222) 9.540 9.664 ( 6.176 -3.672 -11.216) 13.321 9.881 ( -0.177 -1.785 0.890) 2.002 16.107 ( -3.368 1.553 -1.598) 4.039 16.275 ( -2.732 3.084 5.604) 6.955 16.949 ( 0.314 -2.627 -3.334) 4.256 17.162 ( 2.926 3.296 -6.752) 8.063 17.298 ( 4.797 -3.207 5.296) 7.833 18.844 ( -1.650 -3.644 1.122) 4.154 ======================= Grid point 39 (31/294) ======================= q-point: ( 0.17 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.573 ( -2.366 6.425 11.113) 13.053 0.875 ( -10.484 5.947 7.326) 14.105 2.021 ( -3.243 16.068 12.632) 20.695 3.014 ( 7.694 -1.593 2.168) 8.151 3.276 ( -4.783 -8.921 -1.316) 10.207 3.970 ( 5.024 -10.810 -10.488) 15.878 4.044 ( 4.176 3.456 -1.832) 5.722 4.277 ( -0.247 -0.983 -3.287) 3.440 5.568 ( -0.266 -7.368 -1.439) 7.512 6.434 ( 2.710 3.698 -0.295) 4.594 6.563 ( -6.212 0.882 2.692) 6.828 7.051 ( -1.428 -4.339 2.051) 5.008 7.564 ( -4.162 1.820 -1.028) 4.657 7.859 ( 0.899 3.505 4.029) 5.415 8.093 ( -2.332 7.864 3.662) 8.983 8.912 ( 2.210 -9.483 -0.807) 9.770 9.657 ( 3.673 -1.338 -8.501) 9.356 9.881 ( 0.944 -0.790 -0.159) 1.241 16.066 ( -2.154 0.755 -0.803) 2.420 16.325 ( -0.228 5.484 5.781) 7.972 16.917 ( 1.490 -3.147 -3.739) 5.109 17.250 ( 6.007 6.417 -6.627) 11.008 17.373 ( 3.858 -2.458 5.929) 7.489 18.696 ( -7.980 -9.918 -1.100) 12.777 ======================= Grid point 40 (32/294) ======================= q-point: ( 0.25 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.826 ( 13.696 13.670 0.332) 19.354 0.977 ( 7.450 3.825 16.905) 18.866 2.130 ( -3.448 4.979 5.485) 8.170 3.024 ( -9.586 -10.269 1.000) 14.084 3.081 ( -4.713 5.825 1.455) 7.633 3.893 ( 4.381 -11.426 -9.202) 15.311 4.119 ( 1.069 0.680 0.034) 1.268 4.268 ( 1.729 3.127 -3.230) 4.816 5.484 ( 1.216 -8.470 -4.043) 9.464 6.433 ( -2.874 0.864 -2.813) 4.114 6.593 ( 3.373 2.301 6.310) 7.516 7.008 ( -0.263 -4.218 1.498) 4.484 7.504 ( -3.573 1.253 -0.099) 3.787 7.940 ( 3.240 2.640 -0.090) 4.180 8.143 ( -2.039 6.152 3.026) 7.153 8.836 ( -0.747 -7.536 0.681) 7.604 9.665 ( 1.328 1.762 -4.743) 5.231 9.878 ( 0.495 -1.817 -1.353) 2.318 16.043 ( -0.886 0.519 -0.635) 1.207 16.423 ( 0.585 6.716 5.641) 8.790 16.891 ( 2.038 -4.062 -3.828) 5.942 17.346 ( 2.686 3.550 -4.722) 6.489 17.463 ( 4.588 1.013 3.340) 5.765 18.432 ( -8.415 -12.650 -1.996) 15.324 ======================= Grid point 41 (33/294) ======================= q-point: ( 0.33 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.196 ( 16.849 7.456 3.193) 18.700 1.301 ( 14.469 6.281 9.251) 18.286 2.044 ( -6.084 -7.159 -2.487) 9.719 2.738 ( -9.866 -9.623 -3.224) 14.154 3.148 ( -6.340 16.613 12.183) 21.554 3.747 ( -2.936 -11.900 -6.418) 13.836 4.122 ( -0.082 1.292 -3.691) 3.911 4.313 ( 0.654 0.997 0.531) 1.305 5.411 ( 3.646 -7.858 -7.465) 11.436 6.396 ( -0.775 0.932 -0.970) 1.553 6.712 ( 5.085 0.034 5.123) 7.218 6.976 ( 0.063 -3.842 0.812) 3.928 7.489 ( -0.061 2.274 0.352) 2.301 8.007 ( 3.216 1.696 -1.659) 3.997 8.174 ( -0.020 1.961 -0.291) 1.982 8.770 ( -2.789 -3.167 4.019) 5.828 9.664 ( -2.489 4.080 -2.956) 5.620 9.849 ( -0.178 -2.801 -0.998) 2.979 16.043 ( 0.865 0.752 -0.861) 1.434 16.522 ( 0.210 6.193 4.648) 7.746 16.857 ( 1.190 -4.929 -3.454) 6.135 17.356 ( -1.184 1.218 -2.267) 2.833 17.527 ( -2.115 2.960 1.553) 3.955 18.226 ( 1.211 -12.586 -3.224) 13.049 ======================= Grid point 42 (34/294) ======================= q-point: ( 0.42 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.507 ( 12.908 -0.290 3.583) 13.399 1.601 ( 11.203 6.476 -3.541) 13.416 1.820 ( -7.107 -10.407 -5.010) 13.562 2.559 ( -0.875 -5.704 3.992) 7.017 3.291 ( -6.392 18.210 12.675) 23.089 3.533 ( -5.994 -10.640 -2.659) 12.499 4.087 ( -2.691 2.536 -7.107) 8.012 4.296 ( -3.252 -2.004 3.054) 4.891 5.373 ( 5.983 -6.551 -9.355) 12.893 6.416 ( 1.753 1.481 0.616) 2.377 6.804 ( 4.711 -2.645 2.340) 5.888 6.944 ( -0.443 -2.937 0.221) 2.979 7.553 ( 4.072 3.328 1.043) 5.361 8.059 ( 2.722 1.219 -2.164) 3.685 8.178 ( 2.309 -2.849 -2.222) 4.288 8.722 ( -5.355 0.187 5.569) 7.728 9.623 ( -6.328 6.382 -2.926) 9.452 9.819 ( 0.159 -3.321 1.157) 3.521 16.078 ( 3.129 1.183 -1.112) 3.525 16.596 ( 0.282 4.340 2.852) 5.200 16.781 ( -2.064 -6.270 -2.990) 7.247 17.312 ( -3.793 0.488 -1.472) 4.098 17.487 ( -7.072 4.366 4.030) 9.237 18.198 ( 10.335 -10.654 -5.445) 15.810 ======================= Grid point 43 (35/294) ======================= q-point: ( 0.50 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.549 ( -3.276 -10.583 -3.356) 11.576 1.638 ( -1.037 -2.358 -2.981) 3.940 1.761 ( 8.452 2.962 -9.785) 13.265 2.681 ( 11.187 -0.592 13.061) 17.207 3.342 ( -5.639 -8.632 3.232) 10.805 3.394 ( -5.876 12.420 4.220) 14.373 4.002 ( -6.380 4.173 -7.614) 10.775 4.230 ( -4.432 -1.362 4.829) 6.694 5.371 ( 6.892 -5.489 -8.497) 12.241 6.479 ( 2.576 2.453 1.383) 3.817 6.832 ( 2.990 -5.592 -1.932) 6.629 6.917 ( -0.436 -0.889 0.587) 1.151 7.690 ( 7.412 3.404 1.960) 8.388 8.080 ( 0.462 0.063 -2.105) 2.156 8.187 ( 5.423 -5.317 -2.293) 7.933 8.650 ( -8.165 1.349 4.422) 9.383 9.558 ( -7.601 7.802 -1.973) 11.069 9.805 ( 0.319 -3.086 2.475) 3.968 16.154 ( 5.272 1.367 -0.989) 5.536 16.641 ( -3.212 -7.738 -3.465) 9.066 16.651 ( -0.679 3.549 1.830) 4.050 17.230 ( -5.597 -0.460 -0.015) 5.615 17.468 ( -5.494 7.421 6.057) 11.043 18.256 ( 12.064 -9.422 -7.057) 16.856 ======================= Grid point 44 (36/294) ======================= q-point: ( 0.58 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.362 ( -7.202 -5.023 -1.046) 8.843 1.626 ( 3.423 0.365 -3.303) 4.770 1.820 ( 5.304 -2.324 -7.802) 9.717 2.954 ( 9.649 1.020 11.686) 15.189 3.218 ( 0.131 -10.636 1.895) 10.805 3.380 ( -8.324 7.497 -1.450) 11.296 3.887 ( -5.755 3.228 -5.623) 8.670 4.212 ( -3.375 4.123 6.677) 8.542 5.392 ( 6.478 -4.595 -5.545) 9.686 6.552 ( 1.569 3.880 1.601) 4.481 6.780 ( 0.082 -5.868 -4.104) 7.162 6.919 ( 1.015 -0.731 -0.058) 1.252 7.866 ( 8.568 2.372 2.109) 9.137 8.063 ( 0.079 -1.941 -0.249) 1.958 8.214 ( 5.009 -5.068 -2.532) 7.562 8.533 ( -9.707 1.787 1.526) 9.987 9.515 ( -5.972 8.109 0.610) 10.089 9.794 ( 0.283 -3.136 1.750) 3.602 16.258 ( 6.251 0.917 -0.186) 6.320 16.482 ( -5.031 -5.802 -2.117) 7.966 16.699 ( 2.022 2.455 -0.739) 3.265 17.128 ( -6.146 -1.043 1.267) 6.361 17.504 ( -4.393 8.458 6.985) 11.817 18.321 ( 11.263 -8.121 -7.630) 15.844 ======================= Grid point 45 (37/294) ======================= q-point: (-0.33 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.221 ( -9.863 2.606 4.594) 11.188 1.734 ( 8.729 3.638 -0.857) 9.495 1.825 ( 4.004 -5.084 -3.336) 7.281 2.997 ( -8.765 -2.409 2.739) 9.493 3.190 ( 1.736 -5.430 -7.863) 9.712 3.303 ( -0.184 0.177 1.753) 1.772 3.873 ( 3.778 2.396 0.142) 4.476 4.256 ( -2.627 6.617 5.740) 9.146 5.432 ( 5.470 -3.255 -1.484) 6.535 6.615 ( -1.503 5.681 2.515) 6.392 6.694 ( -0.015 -5.301 -4.908) 7.224 6.930 ( 1.437 -0.828 -0.644) 1.779 7.957 ( -0.574 0.082 -3.046) 3.101 8.098 ( 5.706 -5.228 6.893) 10.364 8.224 ( 2.530 -0.833 -1.721) 3.171 8.404 ( -7.114 2.194 -2.773) 7.944 9.530 ( -2.239 7.208 3.039) 8.137 9.771 ( 0.427 -3.848 -0.259) 3.881 16.340 ( -1.461 -3.638 1.864) 4.341 16.371 ( 2.053 0.255 -2.368) 3.145 16.757 ( 3.303 2.845 -2.599) 5.075 17.036 ( -4.646 -1.521 2.761) 5.614 17.547 ( -4.018 6.497 5.949) 9.682 18.385 ( 9.581 -5.439 -6.632) 12.860 ======================= Grid point 46 (38/294) ======================= q-point: (-0.25 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.156 ( -11.524 11.561 11.858) 20.176 1.809 ( 0.531 -6.562 2.984) 7.228 1.946 ( 10.775 3.969 1.618) 11.596 2.770 ( -14.281 1.651 -8.138) 16.520 3.032 ( -5.012 -6.792 -7.538) 11.316 3.397 ( 11.424 -4.157 -0.991) 12.197 4.016 ( 7.618 1.565 4.075) 8.780 4.298 ( -1.527 4.437 1.604) 4.959 5.494 ( 4.436 -1.163 2.398) 5.175 6.565 ( -4.724 -1.654 -2.532) 5.609 6.708 ( 0.928 4.448 2.443) 5.159 6.943 ( 1.478 -0.524 -0.819) 1.769 7.880 ( -4.883 0.513 -5.763) 7.570 8.084 ( -3.500 -8.183 7.935) 11.923 8.259 ( -4.636 4.073 -1.065) 6.262 8.395 ( 9.489 0.468 -2.822) 9.910 9.606 ( 1.645 4.924 3.546) 6.287 9.736 ( 1.171 -4.346 -2.235) 5.025 16.261 ( -3.365 -0.952 -0.301) 3.510 16.413 ( 0.158 -0.126 1.317) 1.332 16.832 ( 4.939 2.763 -3.835) 6.836 16.992 ( -1.047 -2.041 4.348) 4.916 17.552 ( -3.475 1.830 2.349) 4.576 18.460 ( 7.317 -1.094 -3.783) 8.310 ======================= Grid point 47 (39/294) ======================= q-point: (-0.17 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.210 ( -10.622 19.762 17.819) 28.651 1.717 ( -8.484 -10.312 11.962) 17.927 2.077 ( -3.357 2.771 -3.291) 5.457 2.582 ( -2.268 6.172 -9.685) 11.706 2.862 ( 0.717 -9.007 -8.828) 12.633 3.574 ( 15.581 -4.055 -1.944) 16.218 4.148 ( 4.246 -0.077 3.913) 5.774 4.307 ( 0.305 0.259 -2.730) 2.759 5.579 ( 3.367 1.020 4.301) 5.556 6.455 ( -4.330 -1.961 -3.093) 5.671 6.780 ( -1.776 5.682 5.881) 8.368 6.968 ( 2.276 0.682 0.344) 2.401 7.760 ( -6.096 2.233 -8.195) 10.455 7.980 ( -6.830 -4.807 8.737) 12.087 8.191 ( -5.041 1.951 -2.343) 5.891 8.570 ( 11.455 -0.630 -0.419) 11.480 9.662 ( 2.477 -2.970 -4.003) 5.566 9.750 ( 4.066 0.684 2.607) 4.879 16.214 ( -2.847 2.261 -0.721) 3.706 16.386 ( -4.069 -0.503 2.754) 4.939 16.917 ( 4.846 1.534 -2.903) 5.854 17.014 ( 3.107 -2.255 4.438) 5.869 17.489 ( -2.925 -3.833 -2.829) 5.590 18.562 ( 5.175 3.482 -0.037) 6.237 ======================= Grid point 48 (40/294) ======================= q-point: (-0.08 0.25 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.373 ( -8.649 23.990 19.748) 32.254 1.465 ( -19.073 -13.179 18.146) 29.441 1.848 ( -19.462 5.465 -12.016) 23.517 2.628 ( 8.054 -7.819 -5.263) 12.397 2.879 ( 11.483 4.017 -6.667) 13.872 3.781 ( 16.110 -5.280 -3.297) 17.271 4.206 ( 2.137 -1.443 2.487) 3.583 4.279 ( 0.557 -3.358 -4.658) 5.769 5.658 ( 1.490 1.593 3.431) 4.066 6.363 ( -2.876 -0.860 -2.664) 4.013 6.801 ( -4.466 3.108 4.405) 7.000 7.046 ( 2.770 2.581 5.511) 6.686 7.636 ( -6.035 2.790 -7.722) 10.190 7.895 ( -6.928 1.148 7.886) 10.559 8.110 ( -4.763 0.391 -1.594) 5.037 8.733 ( 10.248 -2.459 -0.066) 10.539 9.643 ( 4.238 -3.805 -7.495) 9.413 9.845 ( 4.363 -0.739 2.776) 5.224 16.193 ( -3.025 4.490 -2.361) 5.906 16.323 ( -5.158 -0.694 5.289) 7.420 16.971 ( 2.401 -0.026 -1.074) 2.630 17.095 ( 5.992 -2.125 3.040) 7.047 17.358 ( -2.634 -7.393 -7.009) 10.522 18.691 ( 3.995 5.778 2.861) 7.585 ======================= Grid point 50 (41/294) ======================= q-point: ( 0.08 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.101 ( -22.177 -10.007 19.852) 31.402 1.462 ( -20.342 5.135 -8.820) 22.759 2.037 ( 3.134 5.295 2.686) 6.713 2.717 ( 6.021 9.896 13.486) 17.778 3.178 ( 10.070 2.342 -1.482) 10.445 3.688 ( 9.086 -8.184 -11.134) 16.538 4.032 ( -0.139 -4.376 -5.490) 7.022 4.187 ( 5.130 -4.341 0.631) 6.749 5.636 ( -3.463 -4.025 -1.426) 5.498 6.381 ( 0.899 4.410 0.629) 4.545 6.780 ( -5.775 -0.007 0.948) 5.853 7.137 ( -3.351 -4.620 3.817) 6.866 7.643 ( -2.403 6.135 -1.196) 6.696 7.988 ( -6.865 0.014 1.251) 6.979 8.138 ( -0.726 7.650 4.769) 9.044 8.750 ( 6.962 -6.478 0.925) 9.554 9.454 ( 7.644 -2.997 -10.542) 13.362 9.866 ( 0.766 -1.635 1.156) 2.144 16.185 ( -5.028 2.221 -1.589) 5.722 16.375 ( -2.674 1.910 4.626) 5.674 16.909 ( -0.661 -2.613 -2.715) 3.826 17.106 ( 2.931 3.544 -6.593) 8.038 17.203 ( 6.499 -4.249 6.352) 10.032 18.837 ( -1.203 -3.054 -0.672) 3.351 ======================= Grid point 51 (42/294) ======================= q-point: ( 0.17 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 868 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.835 ( -14.699 -1.595 17.588) 22.977 1.170 ( -16.187 5.409 -1.752) 17.156 2.139 ( 3.560 1.183 1.109) 3.912 3.007 ( 5.347 12.269 15.251) 20.291 3.240 ( -0.504 -5.150 -1.782) 5.473 3.672 ( 8.536 -11.338 -12.854) 19.148 3.997 ( 2.940 1.990 -4.857) 6.016 4.229 ( 3.302 -2.547 -0.632) 4.218 5.516 ( -3.242 -7.263 -2.093) 8.224 6.446 ( 0.860 4.668 0.349) 4.760 6.684 ( -6.341 -0.096 2.032) 6.659 7.052 ( -2.679 -5.002 1.693) 5.922 7.642 ( -3.313 3.337 -1.105) 4.831 7.913 ( -3.036 1.013 1.441) 3.510 8.204 ( -1.101 4.443 1.874) 4.946 8.784 ( 3.840 -6.099 1.891) 7.451 9.512 ( 7.294 0.622 -7.900) 10.771 9.865 ( 0.349 -1.354 0.757) 1.590 16.120 ( -3.891 1.012 -0.545) 4.057 16.408 ( 0.015 4.559 4.670) 6.526 16.855 ( -0.486 -2.911 -3.794) 4.807 17.184 ( 4.856 6.450 -6.009) 10.065 17.302 ( 5.549 -4.098 7.108) 9.905 18.710 ( -5.996 -8.847 -3.111) 11.132 ======================= Grid point 52 (43/294) ======================= q-point: ( 0.25 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.843 ( 0.968 10.524 7.369) 12.884 1.066 ( -3.806 3.810 9.876) 11.249 2.158 ( 0.228 -4.801 -1.517) 5.041 3.067 ( -8.168 -9.294 -4.654) 13.220 3.271 ( -0.146 14.481 14.367) 20.399 3.621 ( 7.906 -11.790 -9.307) 16.974 4.092 ( 5.070 4.011 -2.144) 6.811 4.240 ( 1.500 0.475 -3.336) 3.688 5.376 ( -1.914 -9.965 -3.195) 10.638 6.463 ( -2.259 1.130 -2.358) 3.455 6.640 ( -1.629 1.896 5.397) 5.948 6.987 ( -0.923 -4.073 0.830) 4.258 7.586 ( -4.847 1.246 -0.295) 5.013 7.923 ( 1.164 2.031 -0.207) 2.350 8.202 ( -1.092 -0.254 -2.507) 2.746 8.799 ( 0.961 -2.587 4.797) 5.535 9.603 ( 5.547 3.209 -4.345) 7.743 9.858 ( -0.083 -1.278 0.000) 1.281 16.073 ( -2.482 0.500 -0.193) 2.539 16.510 ( 1.517 7.076 5.515) 9.099 16.796 ( 0.642 -4.236 -5.071) 6.639 17.293 ( 4.744 6.082 -6.461) 10.062 17.394 ( 5.404 -3.189 6.708) 9.185 18.457 ( -9.688 -11.998 -3.690) 15.856 ======================= Grid point 53 (44/294) ======================= q-point: ( 0.33 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 868 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.077 ( 9.640 11.494 1.211) 15.050 1.221 ( 8.574 3.337 13.352) 16.215 2.035 ( -4.748 -9.084 -3.497) 10.830 2.788 ( -10.202 -9.175 -5.747) 14.876 3.414 ( -0.547 5.617 1.685) 5.890 3.635 ( 1.853 0.215 5.966) 6.251 4.137 ( -1.327 1.459 -0.742) 2.107 4.289 ( 4.075 3.058 -3.534) 6.201 5.238 ( 0.900 -11.055 -6.138) 12.677 6.408 ( -1.869 -0.736 -1.656) 2.603 6.696 ( 1.533 0.968 5.412) 5.708 6.953 ( -0.051 -2.414 0.234) 2.426 7.533 ( -2.647 1.617 0.180) 3.107 7.965 ( 2.306 1.343 -1.243) 2.944 8.153 ( -0.062 -2.820 -4.778) 5.549 8.822 ( -1.058 0.412 6.264) 6.366 9.690 ( 2.640 4.098 -1.244) 5.031 9.835 ( -1.151 -1.082 -0.862) 1.800 16.047 ( -0.969 0.500 -0.284) 1.126 16.622 ( -1.205 7.322 4.667) 8.766 16.750 ( 3.171 -4.811 -4.539) 7.335 17.354 ( 1.385 2.238 -3.130) 4.090 17.501 ( 6.185 -0.248 1.874) 6.467 18.165 ( -8.529 -12.058 -2.914) 15.054 ======================= Grid point 54 (45/294) ======================= q-point: ( 0.42 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.334 ( 11.057 3.512 0.959) 11.641 1.476 ( 9.801 3.756 3.657) 11.115 1.832 ( -7.148 -7.295 -2.348) 10.480 2.556 ( -4.516 -6.208 -1.138) 7.761 3.386 ( 1.297 -7.261 -7.789) 10.727 3.715 ( -8.939 12.400 15.590) 21.834 4.114 ( -1.592 2.492 -3.603) 4.661 4.337 ( -0.257 0.990 1.505) 1.820 5.144 ( 5.486 -9.380 -9.687) 14.557 6.390 ( 1.426 -1.115 0.340) 1.842 6.748 ( 1.796 -1.296 3.047) 3.767 6.938 ( -0.280 -0.793 0.100) 0.847 7.542 ( 1.263 2.739 0.222) 3.024 8.006 ( 2.800 0.158 -1.390) 3.130 8.101 ( 0.858 -3.844 -4.251) 5.795 8.833 ( -3.099 1.582 5.158) 6.222 9.744 ( -1.501 5.215 0.335) 5.437 9.795 ( -1.098 -1.766 -0.641) 2.176 16.051 ( 0.986 0.950 -0.610) 1.499 16.631 ( -0.818 -1.342 -2.042) 2.577 16.763 ( -0.597 1.605 1.748) 2.447 17.352 ( -1.555 0.451 -1.249) 2.045 17.592 ( 2.288 2.278 1.422) 3.528 17.963 ( 0.251 -10.691 -3.622) 11.291 ======================= Grid point 55 (46/294) ======================= q-point: ( 0.50 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 868 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.458 ( 3.866 -4.966 -1.361) 6.439 1.603 ( 5.813 0.950 -8.269) 10.152 1.683 ( -5.629 0.166 0.791) 5.687 2.578 ( 8.236 -0.718 8.866) 12.123 3.262 ( -0.804 -9.505 -6.795) 11.711 3.715 ( -12.191 8.337 9.543) 17.584 4.085 ( -3.667 3.290 -4.077) 6.395 4.331 ( -3.480 1.933 5.549) 6.829 5.134 ( 8.896 -5.954 -9.912) 14.589 6.434 ( 4.160 -0.995 1.842) 4.657 6.765 ( 0.987 -1.520 0.031) 1.813 6.923 ( -0.857 -0.591 0.067) 1.043 7.626 ( 5.079 3.244 0.286) 6.034 8.045 ( 3.351 -0.798 -1.492) 3.754 8.060 ( 1.279 -4.510 -2.111) 5.141 8.801 ( -5.767 1.759 2.988) 6.729 9.722 ( -5.617 5.374 -1.692) 7.956 9.784 ( 0.411 -2.195 2.480) 3.337 16.092 ( 3.241 1.455 -0.844) 3.651 16.576 ( -0.371 -5.236 -2.888) 5.991 16.749 ( -4.555 2.865 2.190) 5.810 17.302 ( -3.879 -0.445 -0.225) 3.911 17.644 ( -3.025 6.689 5.545) 9.200 17.930 ( 10.518 -10.096 -7.001) 16.173 ======================= Grid point 56 (47/294) ======================= q-point: ( 0.58 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.421 ( -1.347 -0.903 -0.629) 1.740 1.614 ( -0.520 2.814 -2.122) 3.563 1.664 ( 3.552 -1.456 -5.707) 6.878 2.827 ( 12.601 0.197 10.027) 16.105 3.127 ( -0.638 -8.456 -4.227) 9.475 3.601 ( -12.122 2.288 3.996) 12.967 3.986 ( -7.095 1.317 -5.086) 8.829 4.346 ( -2.927 4.645 5.424) 7.718 5.197 ( 9.086 -2.601 -5.776) 11.077 6.518 ( 5.100 -0.253 1.947) 5.465 6.755 ( -1.060 0.192 -1.070) 1.518 6.902 ( -0.273 -1.228 -0.606) 1.396 7.762 ( 7.624 2.530 0.352) 8.041 8.032 ( 0.839 -4.002 0.180) 4.093 8.083 ( 4.170 -2.179 -1.682) 4.996 8.712 ( -8.579 1.947 1.034) 8.858 9.675 ( -5.193 5.366 -0.661) 7.496 9.770 ( -0.468 -3.504 1.585) 3.874 16.172 ( 5.180 1.500 -0.672) 5.435 16.486 ( -3.042 -5.047 -1.149) 6.004 16.726 ( -2.007 2.930 0.610) 3.604 17.219 ( -5.433 -0.978 0.551) 5.547 17.677 ( -3.933 5.195 4.305) 7.810 18.014 ( 12.807 -5.549 -5.158) 14.880 ======================= Grid point 57 (48/294) ======================= q-point: (-0.33 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 868 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.424 ( -2.693 6.084 4.093) 7.812 1.664 ( 2.494 2.175 2.282) 4.020 1.684 ( 5.551 1.126 -6.642) 8.729 2.968 ( 5.728 -9.331 -5.121) 12.087 3.090 ( 0.027 -0.743 6.530) 6.572 3.430 ( -10.523 -1.106 1.075) 10.635 3.879 ( -2.725 2.190 -2.931) 4.562 4.362 ( -2.124 2.461 1.171) 3.455 5.305 ( 7.453 0.067 -0.260) 7.458 6.603 ( 3.832 -0.221 0.202) 3.844 6.728 ( -3.189 3.279 1.001) 4.683 6.893 ( 1.365 -1.118 -1.284) 2.182 7.902 ( 6.231 1.050 -1.512) 6.497 8.018 ( 1.702 -5.036 4.421) 6.914 8.124 ( 4.751 -1.201 -2.696) 5.593 8.580 ( -10.278 2.627 -0.160) 10.609 9.652 ( -3.469 4.651 0.900) 5.872 9.722 ( -0.536 -4.981 -0.786) 5.072 16.275 ( 5.958 0.716 0.353) 6.012 16.386 ( -3.917 -2.423 -0.222) 4.611 16.745 ( 0.663 3.233 -0.807) 3.398 17.120 ( -5.692 -1.443 1.439) 6.046 17.654 ( -2.507 -1.002 -1.027) 2.889 18.171 ( 10.161 1.445 0.273) 10.267 ======================= Grid point 58 (49/294) ======================= q-point: (-0.25 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.486 ( -4.611 11.945 8.596) 15.422 1.713 ( 4.926 -3.551 -0.597) 6.102 1.841 ( 8.196 7.675 1.272) 11.300 2.896 ( -1.822 -4.498 -8.851) 10.094 3.007 ( -8.420 -7.775 3.222) 11.905 3.292 ( -2.945 -1.144 -2.078) 3.782 3.942 ( 5.978 2.914 2.605) 7.143 4.329 ( -1.384 -1.718 -3.763) 4.362 5.432 ( 5.703 1.766 3.702) 7.025 6.588 ( -2.703 -2.209 -2.204) 4.128 6.782 ( 0.654 7.805 4.848) 9.211 6.907 ( 1.867 -0.328 -1.177) 2.231 7.914 ( -2.216 0.867 -4.490) 5.082 8.048 ( 2.903 -7.551 7.197) 10.828 8.216 ( 8.827 0.979 -2.127) 9.132 8.438 ( -10.040 3.469 -0.417) 10.631 9.626 ( -0.197 -5.728 -2.346) 6.193 9.689 ( -0.540 2.884 0.774) 3.034 16.313 ( -3.228 -0.224 1.544) 3.585 16.377 ( 4.611 0.511 0.356) 4.653 16.791 ( 1.795 3.959 -2.643) 5.087 17.034 ( -3.893 -2.275 2.956) 5.392 17.568 ( -1.660 -5.970 -5.261) 8.129 18.361 ( 7.120 5.826 3.930) 10.004 ======================= Grid point 59 (50/294) ======================= q-point: (-0.17 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 868 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.604 ( -4.136 15.552 11.724) 19.911 1.739 ( 1.295 -4.474 3.466) 5.805 2.058 ( 7.220 4.984 2.609) 9.153 2.705 ( -11.554 3.391 -10.829) 16.194 2.786 ( -6.953 -10.600 -0.462) 12.685 3.325 ( 9.301 -2.068 -1.232) 9.608 4.086 ( 5.760 0.974 3.271) 6.695 4.248 ( 0.105 -5.531 -7.453) 9.282 5.562 ( 4.299 2.734 5.075) 7.191 6.491 ( -4.387 -2.225 -2.490) 5.513 6.890 ( -0.876 4.684 3.924) 6.173 6.950 ( 2.981 4.258 2.763) 5.887 7.834 ( -5.354 2.317 -5.455) 7.987 8.041 ( -0.650 -5.221 6.445) 8.320 8.312 ( -6.855 1.985 -1.166) 7.231 8.382 ( 9.092 0.582 0.502) 9.124 9.543 ( 1.738 -8.109 -6.162) 10.332 9.738 ( 1.446 2.982 2.219) 3.988 16.285 ( -2.688 3.059 0.459) 4.098 16.432 ( 0.466 -0.439 2.826) 2.898 16.847 ( 3.108 3.823 -4.161) 6.449 16.996 ( -0.264 -3.197 4.581) 5.592 17.431 ( -1.646 -8.929 -7.930) 12.055 18.549 ( 4.834 7.443 5.275) 10.324 ======================= Grid point 60 (51/294) ======================= q-point: (-0.08 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.681 ( -7.573 -8.298 11.918) 16.379 1.764 ( -3.067 15.737 10.442) 19.134 2.072 ( -10.100 1.522 -3.984) 10.963 2.526 ( -6.253 -1.611 -2.596) 6.960 2.716 ( 7.916 3.441 -4.596) 9.779 3.490 ( 12.784 -2.156 -1.421) 13.043 4.133 ( 2.444 -5.786 -6.457) 9.008 4.187 ( 2.597 -3.912 -0.534) 4.725 5.669 ( 2.137 2.469 3.919) 5.101 6.392 ( -3.465 -1.285 -2.286) 4.345 6.894 ( -2.340 1.189 0.746) 2.729 7.085 ( 1.936 5.166 8.383) 10.035 7.733 ( -6.529 4.311 -5.655) 9.653 8.024 ( -2.057 -0.250 6.285) 6.618 8.208 ( -7.435 1.874 -0.209) 7.670 8.539 ( 10.198 -2.510 0.554) 10.517 9.472 ( 4.096 -7.471 -8.719) 12.191 9.804 ( 2.482 0.847 2.101) 3.360 16.278 ( -3.023 5.149 -1.543) 6.167 16.421 ( -3.413 -0.582 5.178) 6.229 16.913 ( 3.759 2.071 -3.412) 5.483 17.016 ( 3.221 -3.375 4.732) 6.645 17.265 ( -1.678 -9.142 -8.924) 12.885 18.713 ( 3.336 6.526 4.663) 8.687 ======================= Grid point 62 (52/294) ======================= q-point: ( 0.08 0.42 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.448 ( -17.856 -9.434 15.743) 25.606 1.741 ( -15.532 1.660 -7.977) 17.539 1.948 ( 5.100 -1.602 -1.064) 5.451 2.888 ( 1.897 14.799 13.683) 20.245 3.018 ( 12.362 4.446 -1.538) 13.227 3.440 ( 3.415 -8.740 -11.593) 14.914 3.901 ( 7.531 -1.476 -3.192) 8.312 4.111 ( -0.142 -4.740 1.855) 5.092 5.654 ( -4.268 -3.688 -2.459) 6.153 6.409 ( 1.516 4.362 1.294) 4.796 6.861 ( -3.786 -0.270 0.349) 3.811 7.170 ( -3.690 -4.990 2.784) 6.802 7.754 ( -4.704 6.329 -1.571) 8.040 8.077 ( -4.409 0.243 -0.876) 4.502 8.207 ( 0.374 -0.709 0.763) 1.107 8.626 ( 4.951 -1.304 5.292) 7.364 9.256 ( 7.195 -0.326 -7.661) 10.515 9.841 ( 1.063 -1.444 0.849) 1.983 16.288 ( -5.670 2.167 -1.208) 6.189 16.440 ( -1.898 -0.146 1.481) 2.412 16.893 ( -1.146 -1.559 -1.191) 2.272 17.067 ( 2.504 4.009 -2.960) 5.576 17.087 ( 7.034 -3.425 5.112) 9.346 18.819 ( -1.435 -3.548 -2.341) 4.487 ======================= Grid point 63 (53/294) ======================= q-point: ( 0.17 0.42 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.173 ( -17.119 -5.061 16.997) 24.649 1.459 ( -16.040 3.497 -5.383) 17.276 2.029 ( 6.356 -2.831 0.103) 6.958 3.123 ( 3.081 0.469 9.586) 10.079 3.211 ( 5.230 11.718 2.369) 13.049 3.363 ( 7.721 -9.091 -13.368) 17.915 3.934 ( 1.710 1.324 -6.235) 6.599 4.136 ( 4.892 -3.402 4.544) 7.494 5.510 ( -5.350 -6.228 -3.060) 8.762 6.486 ( 0.770 5.128 0.844) 5.254 6.786 ( -5.183 -0.721 1.458) 5.432 7.060 ( -3.722 -6.100 0.642) 7.174 7.731 ( -4.018 4.434 -1.079) 6.081 7.988 ( -4.942 -0.205 0.206) 4.951 8.202 ( 1.499 -3.074 -3.865) 5.161 8.720 ( 3.567 -0.722 6.616) 7.551 9.364 ( 7.954 4.285 -5.350) 10.500 9.846 ( 0.841 -1.880 0.873) 2.237 16.203 ( -5.426 0.732 -0.336) 5.486 16.448 ( 1.192 1.927 1.075) 2.508 16.841 ( -2.204 -1.765 -1.872) 3.388 17.152 ( 3.296 7.482 -4.263) 9.221 17.204 ( 6.699 -4.254 8.161) 11.383 18.691 ( -4.604 -8.449 -5.070) 10.876 ======================= Grid point 64 (54/294) ======================= q-point: ( 0.25 0.42 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.043 ( -8.204 3.752 13.785) 16.474 1.260 ( -10.363 4.224 1.493) 11.290 2.067 ( 2.694 -5.781 -0.652) 6.412 3.058 ( -3.492 -8.077 -5.984) 10.642 3.306 ( 4.944 -9.457 -9.712) 14.429 3.504 ( 5.248 14.271 14.184) 20.794 3.999 ( 7.435 5.095 -7.028) 11.429 4.200 ( 2.185 -1.334 3.192) 4.092 5.332 ( -5.600 -8.968 -2.787) 10.934 6.508 ( -2.749 2.086 -1.795) 3.890 6.722 ( -3.312 0.690 3.881) 5.149 6.966 ( -1.282 -4.805 -0.257) 4.979 7.678 ( -5.228 1.168 -0.074) 5.358 7.941 ( -1.478 1.495 -0.397) 2.139 8.153 ( 0.578 -4.195 -6.102) 7.428 8.803 ( 2.160 0.011 6.927) 7.256 9.517 ( 7.060 6.283 -2.988) 9.912 9.845 ( 0.555 -1.739 0.877) 2.025 16.129 ( -3.981 0.100 0.128) 3.985 16.529 ( 4.758 3.203 0.868) 5.801 16.770 ( -3.083 -1.116 -2.084) 3.885 17.251 ( 3.581 6.537 -4.763) 8.845 17.315 ( 5.323 -3.118 8.261) 10.310 18.461 ( -7.647 -11.475 -5.944) 15.016 ======================= Grid point 65 (55/294) ======================= q-point: ( 0.33 0.42 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.117 ( 0.616 9.843 5.316) 11.204 1.243 ( 0.556 2.736 9.480) 9.882 1.997 ( -2.137 -7.655 -1.460) 8.080 2.830 ( -9.315 -8.022 -7.425) 14.362 3.251 ( 6.200 -9.097 -9.242) 14.374 3.800 ( 3.525 12.895 16.996) 21.623 4.150 ( 6.834 6.816 -5.437) 11.078 4.216 ( 0.190 0.282 -0.490) 0.596 5.130 ( -4.673 -11.884 -3.337) 13.199 6.434 ( -3.885 -0.952 -2.481) 4.707 6.729 ( -0.800 0.963 4.173) 4.357 6.928 ( 0.616 -2.089 -0.156) 2.184 7.602 ( -4.364 0.222 0.564) 4.406 7.949 ( 0.612 1.664 -1.088) 2.080 8.085 ( 0.221 -3.635 -5.824) 6.869 8.868 ( 0.815 0.507 5.858) 5.936 9.660 ( 4.812 5.308 -1.161) 7.258 9.842 ( -0.127 -0.654 0.717) 0.978 16.077 ( -2.415 -0.080 0.182) 2.423 16.623 ( 4.224 -3.038 -4.374) 6.797 16.736 ( -1.224 6.312 3.284) 7.219 17.326 ( 2.623 3.065 -2.913) 4.977 17.413 ( 4.613 -1.275 4.505) 6.573 18.181 ( -8.675 -11.466 -4.859) 15.177 ======================= Grid point 66 (56/294) ======================= q-point: ( 0.42 0.42 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.245 ( 4.249 4.402 0.090) 6.119 1.402 ( 6.823 2.865 7.309) 10.401 1.874 ( -4.547 -4.122 0.319) 6.146 2.576 ( -7.116 -6.062 -4.831) 10.523 3.213 ( 4.174 -7.653 -7.554) 11.535 4.031 ( -1.296 9.737 16.188) 18.935 4.162 ( -5.339 2.765 -0.451) 6.029 4.316 ( 6.592 6.483 -4.657) 10.352 4.939 ( -0.058 -12.866 -6.163) 14.266 6.370 ( -0.916 -1.560 -0.802) 1.978 6.744 ( -0.043 -0.431 2.229) 2.270 6.933 ( 0.591 -0.110 0.244) 0.649 7.562 ( -1.241 1.027 0.231) 1.627 7.969 ( 1.148 0.352 -0.696) 1.388 8.032 ( 0.601 -2.697 -4.226) 5.049 8.903 ( -0.763 0.865 3.776) 3.948 9.746 ( 2.105 1.092 0.198) 2.380 9.840 ( -1.278 2.433 0.280) 2.763 16.053 ( -0.641 0.266 -0.084) 0.699 16.579 ( 0.279 -4.299 -4.235) 6.042 16.841 ( 0.140 7.157 3.956) 8.179 17.358 ( 0.523 0.737 -1.088) 1.414 17.498 ( 6.077 -1.402 0.398) 6.249 17.938 ( -6.575 -7.901 -2.546) 10.590 ======================= Grid point 67 (57/294) ======================= q-point: ( 0.50 0.42 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.332 ( 5.603 -1.422 -1.670) 6.017 1.506 ( 2.013 -0.579 -3.768) 4.311 1.798 ( -4.644 1.818 2.683) 5.663 2.508 ( 4.150 -0.496 4.145) 5.887 3.144 ( 0.431 -6.749 -5.993) 9.036 4.035 ( -13.012 4.279 5.921) 14.923 4.137 ( -1.468 1.256 1.201) 2.275 4.429 ( -0.651 5.364 3.536) 6.457 4.865 ( 9.282 -6.694 -9.318) 14.757 6.372 ( 2.679 -1.453 1.464) 3.380 6.751 ( 0.434 0.021 0.327) 0.544 6.932 ( -0.699 -0.274 -0.122) 0.761 7.587 ( 2.616 2.000 -0.536) 3.336 7.978 ( 1.082 -2.521 0.708) 2.834 8.011 ( 1.377 -0.780 -2.482) 2.944 8.899 ( -2.869 1.199 1.432) 3.423 9.757 ( -0.081 -1.860 0.811) 2.031 9.840 ( -2.658 3.388 -0.235) 4.313 16.063 ( 1.424 0.929 -0.452) 1.759 16.527 ( -0.205 -3.164 -1.773) 3.632 16.871 ( -4.777 3.239 2.325) 6.222 17.345 ( -1.915 -0.092 -0.454) 1.970 17.607 ( 10.405 -3.196 -2.354) 11.137 17.804 ( -3.859 -0.534 0.833) 3.984 ======================= Grid point 68 (58/294) ======================= q-point: (-0.42 -0.58 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.388 ( 2.864 -1.038 -1.250) 3.292 1.471 ( 4.299 -3.127 -9.649) 11.016 1.776 ( -4.605 5.785 3.669) 8.255 2.697 ( 10.358 1.916 7.805) 13.110 3.048 ( -0.910 -4.771 -3.010) 5.714 3.857 ( -14.407 0.187 4.089) 14.977 4.073 ( -5.736 -0.792 -2.077) 6.152 4.432 ( -2.125 -0.216 0.120) 2.139 4.993 ( 11.596 2.395 -3.860) 12.454 6.440 ( 5.037 -0.526 2.832) 5.802 6.767 ( 0.684 1.571 -0.335) 1.746 6.902 ( -1.677 -1.065 -1.044) 2.244 7.672 ( 5.725 2.212 -1.222) 6.258 7.974 ( 1.272 -3.678 2.442) 4.594 8.023 ( 1.789 -0.433 -1.158) 2.174 8.848 ( -5.446 1.727 -0.424) 5.728 9.729 ( -1.200 -3.230 1.209) 3.651 9.808 ( -3.731 2.147 -1.298) 4.496 16.111 ( 3.493 1.352 -0.638) 3.800 16.487 ( -1.659 -1.982 0.756) 2.693 16.809 ( -4.823 0.950 0.787) 4.978 17.291 ( -4.053 -0.420 -0.206) 4.080 17.653 ( 4.914 -9.060 -7.290) 12.625 17.879 ( 4.680 9.497 6.766) 12.565 ======================= Grid point 70 (59/294) ======================= q-point: (-0.33 -0.58 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.411 ( 4.678 1.197 -5.441) 7.274 1.510 ( 7.513 -3.242 -4.515) 9.346 1.811 ( -3.204 9.922 4.996) 11.561 2.821 ( 1.777 -3.433 -0.307) 3.878 3.077 ( 5.073 1.336 5.652) 7.711 3.627 ( -14.262 -3.788 3.879) 15.258 3.948 ( -5.747 0.420 -3.686) 6.840 4.375 ( -1.168 -3.209 -4.709) 5.817 5.194 ( 9.061 4.822 1.328) 10.350 6.543 ( 4.784 0.534 2.476) 5.413 6.800 ( 0.238 3.622 1.112) 3.796 6.858 ( -0.629 -1.165 -2.120) 2.499 7.789 ( 7.125 1.232 -1.390) 7.363 7.981 ( 1.229 -3.237 3.925) 5.234 8.045 ( 2.358 -0.711 -0.666) 2.551 8.753 ( -7.896 2.587 -1.326) 8.414 9.659 ( -1.904 -7.368 -0.029) 7.610 9.766 ( -3.253 3.534 -1.251) 4.964 16.191 ( 5.147 1.136 -0.362) 5.283 16.436 ( -3.707 -0.955 1.829) 4.243 16.774 ( -1.072 1.673 0.288) 2.008 17.207 ( -5.467 -0.665 0.031) 5.507 17.574 ( 1.682 -8.807 -7.875) 11.933 18.120 ( 7.036 10.335 7.708) 14.688 ======================= Grid point 71 (60/294) ======================= q-point: (-0.25 -0.58 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.509 ( 8.435 3.791 -8.518) 12.572 1.606 ( 7.446 -0.446 3.369) 8.185 1.895 ( -0.753 8.788 2.665) 9.214 2.812 ( 0.825 -0.203 1.592) 1.804 3.121 ( -5.507 -2.616 3.758) 7.162 3.383 ( -11.241 -4.851 0.327) 12.248 3.913 ( 1.910 2.815 0.141) 3.404 4.277 ( -1.318 -5.666 -8.041) 9.925 5.383 ( 6.725 4.557 4.004) 9.057 6.589 ( -0.317 -1.819 0.010) 1.846 6.859 ( 2.465 0.809 -1.874) 3.200 6.870 ( 1.174 6.822 3.782) 7.888 7.889 ( 4.642 -0.370 -1.448) 4.876 7.995 ( 0.419 -2.488 5.351) 5.916 8.093 ( 5.228 -0.244 -1.094) 5.347 8.632 ( -9.296 3.584 -1.074) 10.021 9.537 ( -1.529 -10.036 -2.873) 10.550 9.755 ( -1.964 3.852 0.029) 4.324 16.291 ( 5.954 0.408 0.627) 6.000 16.382 ( -3.500 0.660 1.574) 3.894 16.799 ( 0.840 3.066 -0.212) 3.186 17.107 ( -5.650 -1.175 0.535) 5.796 17.455 ( 0.252 -9.571 -8.544) 12.832 18.372 ( 6.002 10.223 8.088) 14.351 ======================= Grid point 72 (61/294) ======================= q-point: (-0.17 0.42 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.635 ( 6.922 2.199 -3.216) 7.944 1.755 ( 4.521 5.598 1.519) 7.354 1.999 ( 6.482 3.498 0.828) 7.412 2.837 ( -6.087 3.959 5.606) 9.173 2.921 ( -13.585 -4.924 2.220) 14.619 3.224 ( -0.427 -2.716 -2.518) 3.728 4.024 ( 5.856 2.006 2.334) 6.615 4.134 ( -1.576 -7.896 -10.491) 13.225 5.546 ( 5.139 4.065 4.912) 8.189 6.519 ( -3.535 -3.372 -1.844) 5.222 6.897 ( 1.945 0.668 -0.839) 2.221 7.011 ( 2.674 8.963 5.155) 10.680 7.903 ( -1.731 1.490 -2.328) 3.261 8.014 ( 1.027 -2.914 6.051) 6.794 8.197 ( 8.148 -0.854 -1.130) 8.271 8.516 ( -8.971 4.340 0.364) 9.972 9.400 ( 0.044 -10.694 -5.453) 12.004 9.771 ( -0.525 3.023 0.767) 3.162 16.359 ( -2.191 2.769 0.497) 3.565 16.393 ( 4.969 -0.358 2.840) 5.735 16.843 ( 0.761 4.359 -2.053) 4.878 17.017 ( -3.685 -2.527 1.803) 4.818 17.308 ( -0.801 -9.952 -8.519) 13.125 18.591 ( 4.270 8.761 7.138) 12.081 ======================= Grid point 73 (62/294) ======================= q-point: (-0.08 0.42 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.700 ( 1.578 -2.510 2.199) 3.691 1.873 ( 2.909 5.410 -0.956) 6.217 2.145 ( 3.730 1.381 0.114) 3.979 2.668 ( -7.581 -4.924 3.969) 9.873 2.761 ( -11.857 9.079 1.345) 14.995 3.314 ( 9.092 1.518 2.322) 9.506 3.964 ( 0.380 -10.701 -12.173) 16.212 4.128 ( 3.306 0.117 1.779) 3.756 5.676 ( 3.068 3.084 3.890) 5.836 6.417 ( -3.279 -2.521 -2.099) 4.638 6.918 ( 0.127 0.600 -0.349) 0.705 7.153 ( 1.711 5.587 5.652) 8.130 7.854 ( -5.251 4.159 -2.651) 7.204 8.045 ( 1.183 -0.749 4.596) 4.805 8.285 ( 3.292 -2.443 -1.083) 4.240 8.453 ( -2.886 3.774 2.965) 5.600 9.287 ( 2.443 -9.228 -7.496) 12.137 9.799 ( 0.660 1.467 0.989) 1.888 16.359 ( -1.980 4.046 -0.769) 4.569 16.466 ( 1.197 -0.334 4.647) 4.810 16.880 ( 0.941 4.691 -4.137) 6.325 16.973 ( 0.533 -4.524 3.776) 5.917 17.155 ( -1.202 -8.262 -7.359) 11.129 18.752 ( 2.570 5.865 4.745) 7.970 ======================= Grid point 76 (63/294) ======================= q-point: ( 0.08 0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.647 ( -6.477 -4.123 5.012) 9.169 1.838 ( -3.529 -4.859 3.171) 6.791 2.006 ( -11.368 1.150 -2.306) 11.656 2.826 ( 14.259 7.890 -5.345) 17.151 2.992 ( 7.426 1.793 6.212) 9.846 3.274 ( -3.887 -9.130 -10.929) 14.762 3.834 ( 4.335 7.612 8.325) 12.085 4.102 ( -2.347 -2.872 -0.305) 3.721 5.671 ( -3.918 -3.447 -3.353) 6.203 6.424 ( 2.516 3.702 1.833) 4.836 6.904 ( -1.921 -0.518 0.226) 2.002 7.185 ( -2.904 -5.180 -0.683) 5.978 7.872 ( -3.240 3.782 -0.851) 5.052 8.096 ( 2.802 -2.230 -3.285) 4.860 8.181 ( -4.954 -1.779 -0.003) 5.264 8.576 ( 5.046 -1.690 2.365) 5.824 9.175 ( 2.347 6.178 0.743) 6.651 9.816 ( 0.585 -1.463 0.076) 1.578 16.376 ( -2.783 0.568 0.092) 2.841 16.455 ( -2.270 -1.859 -2.763) 4.030 16.896 ( -1.050 -2.042 0.115) 2.299 16.983 ( 5.219 -0.525 3.564) 6.342 17.080 ( 1.467 6.306 1.636) 6.678 18.790 ( -1.935 -4.654 -3.793) 6.308 ======================= Grid point 77 (64/294) ======================= q-point: ( 0.17 0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 868 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.464 ( -13.671 -5.858 12.369) 19.344 1.673 ( -11.515 -0.449 -5.742) 12.875 1.949 ( 1.445 -0.497 3.525) 3.842 3.031 ( 3.052 -6.923 -9.340) 12.020 3.110 ( 9.607 -1.788 -5.848) 11.388 3.232 ( 8.682 9.553 4.655) 13.722 3.944 ( -3.083 2.876 -0.494) 4.245 4.084 ( 3.336 0.008 7.392) 8.110 5.527 ( -5.686 -5.155 -4.140) 8.720 6.517 ( 2.037 4.657 1.362) 5.263 6.855 ( -3.520 -0.985 1.055) 3.804 7.057 ( -3.774 -7.591 -1.779) 8.663 7.841 ( -4.670 4.480 -1.173) 6.577 8.072 ( -5.144 -2.679 0.179) 5.803 8.094 ( 2.197 -2.237 -4.857) 5.782 8.670 ( 6.210 -2.350 3.754) 7.627 9.311 ( 4.159 9.502 0.829) 10.405 9.813 ( 1.122 -2.433 0.334) 2.700 16.300 ( -6.060 0.204 -0.384) 6.076 16.423 ( 1.757 -0.960 -1.824) 2.708 16.852 ( -1.707 -2.024 -0.772) 2.758 17.091 ( 6.299 -0.370 1.689) 6.532 17.197 ( 1.589 7.752 5.659) 9.729 18.646 ( -4.110 -8.644 -6.633) 11.645 ======================= Grid point 78 (65/294) ======================= q-point: ( 0.25 0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.299 ( -10.813 -0.873 13.797) 17.551 1.467 ( -10.727 2.391 -3.055) 11.407 1.979 ( 2.188 -4.901 1.572) 5.593 2.918 ( 3.080 -8.411 -9.544) 13.089 3.176 ( 0.035 -2.555 -4.054) 4.793 3.526 ( 12.572 9.473 2.183) 15.892 3.923 ( 2.065 1.552 -1.363) 2.921 4.205 ( 1.974 3.337 8.183) 9.055 5.345 ( -7.038 -6.910 -3.439) 10.445 6.561 ( -1.895 2.238 -1.300) 3.207 6.799 ( -3.277 -0.106 2.870) 4.358 6.931 ( -1.418 -6.206 -1.998) 6.672 7.781 ( -5.944 1.398 0.098) 6.107 7.987 ( -3.111 0.230 -0.894) 3.245 8.069 ( 0.858 -2.067 -4.893) 5.381 8.770 ( 5.558 -2.057 4.256) 7.296 9.482 ( 4.900 9.670 0.292) 10.844 9.813 ( 1.519 -2.670 0.853) 3.188 16.204 ( -5.279 -0.422 0.104) 5.296 16.460 ( 4.228 0.086 -2.035) 4.693 16.801 ( -1.809 -0.839 -0.878) 2.179 17.196 ( 5.670 0.243 0.485) 5.696 17.326 ( 0.815 7.017 7.045) 9.977 18.425 ( -6.125 -11.199 -7.833) 14.976 ======================= Grid point 79 (66/294) ======================= q-point: ( 0.33 0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 868 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.272 ( -3.969 4.350 11.660) 13.062 1.349 ( -6.102 2.979 1.111) 6.880 1.939 ( 0.427 -7.310 -0.943) 7.383 2.832 ( -3.139 -5.256 -7.145) 9.409 3.074 ( -0.234 -4.585 -5.850) 7.437 3.825 ( 12.671 5.496 4.282) 14.460 4.025 ( 7.188 4.318 -3.262) 8.997 4.295 ( -1.021 5.188 7.200) 8.933 5.125 ( -8.583 -9.370 -2.270) 12.908 6.484 ( -5.107 -0.808 -3.194) 6.078 6.779 ( -2.079 -0.016 2.603) 3.332 6.889 ( 1.700 -1.841 -0.199) 2.514 7.686 ( -5.804 -0.964 1.305) 6.027 7.960 ( -0.810 2.015 -2.390) 3.230 8.032 ( -0.407 -1.310 -3.315) 3.588 8.856 ( 3.968 -1.342 3.681) 5.576 9.639 ( 4.056 7.237 -0.607) 8.318 9.824 ( 1.759 -1.852 1.563) 2.994 16.125 ( -3.776 -0.772 0.430) 3.878 16.514 ( 3.901 -1.111 -3.493) 5.353 16.793 ( 0.912 2.357 0.665) 2.614 17.282 ( 4.228 0.265 0.353) 4.251 17.427 ( -0.685 5.886 6.058) 8.474 18.163 ( -6.773 -11.532 -7.202) 15.189 ======================= Grid point 80 (67/294) ======================= q-point: ( 0.42 0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.286 ( -3.950 3.063 1.452) 5.205 1.392 ( 3.337 3.046 7.984) 9.174 1.878 ( 0.034 -4.173 -0.543) 4.208 2.619 ( -8.750 -4.801 -7.045) 12.216 3.066 ( 3.679 -1.815 -2.351) 4.728 4.064 ( 8.088 -0.805 7.880) 11.321 4.163 ( 8.189 4.403 -8.747) 12.765 4.373 ( -1.784 10.348 5.629) 11.915 4.870 ( -8.886 -11.399 -1.159) 14.500 6.386 ( -3.440 -0.623 -2.346) 4.210 6.758 ( -1.011 -0.830 1.149) 1.741 6.919 ( 1.549 0.391 0.653) 1.725 7.605 ( -3.541 -0.941 1.026) 3.805 7.961 ( 0.325 1.648 -2.434) 2.957 7.998 ( -0.897 -0.802 -1.003) 1.566 8.913 ( 2.020 -0.617 2.129) 2.999 9.729 ( 1.785 2.723 -0.902) 3.379 9.856 ( 1.668 0.181 1.477) 2.235 16.073 ( -1.995 -0.632 0.346) 2.121 16.517 ( 1.052 -1.578 -2.824) 3.402 16.880 ( 4.160 3.680 1.051) 5.652 17.339 ( 2.201 -0.038 0.536) 2.266 17.477 ( -2.311 3.770 3.466) 5.618 17.935 ( -4.424 -8.269 -4.645) 10.466 ======================= Grid point 81 (68/294) ======================= q-point: (-0.50 -0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 436 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.269 ( 0.000 0.000 0.000) 0.000 1.477 ( -0.000 0.000 0.000) 0.000 1.859 ( -0.000 0.000 0.000) 0.000 2.483 ( 0.000 0.000 0.000) 0.000 3.085 ( 0.000 -0.000 -0.000) 0.000 4.144 ( 0.000 0.000 0.000) 0.000 4.231 ( 0.000 0.000 0.000) 0.000 4.484 ( -0.000 0.000 0.000) 0.000 4.679 ( -0.000 -0.000 0.000) 0.000 6.347 ( 0.000 0.000 0.000) 0.000 6.749 ( 0.000 0.000 0.000) 0.000 6.937 ( 0.000 0.000 0.000) 0.000 7.573 ( 0.000 0.000 0.000) 0.000 7.968 ( 0.000 0.000 -0.000) 0.000 7.980 ( -0.000 -0.000 0.000) 0.000 8.933 ( 0.000 0.000 0.000) 0.000 9.751 ( 0.000 0.000 0.000) 0.000 9.878 ( 0.000 0.000 0.000) 0.000 16.055 ( -0.000 0.000 0.000) 0.000 16.507 ( -0.000 0.000 0.000) 0.000 16.947 ( -0.000 0.000 0.000) 0.000 17.358 ( -0.000 0.000 0.000) 0.000 17.478 ( 0.000 0.000 0.000) 0.000 17.843 ( -0.000 0.000 0.000) 0.000 ======================= Grid point 162 (69/294) ======================= q-point: ( 0.08 0.08 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 292 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.429 ( -0.000 0.000 24.439) 24.439 0.429 ( -0.000 0.000 24.439) 24.439 0.612 ( -0.000 0.000 34.795) 34.795 3.422 ( 0.000 -0.000 -8.642) 8.642 3.422 ( 0.000 -0.000 -8.642) 8.642 4.100 ( -0.000 0.000 1.069) 1.069 4.100 ( -0.000 0.000 1.069) 1.069 4.690 ( 0.000 -0.000 -11.973) 11.973 5.796 ( -0.000 0.000 3.480) 3.480 6.361 ( -0.000 0.000 1.792) 1.792 6.361 ( -0.000 0.000 1.792) 1.792 7.128 ( -0.000 0.000 5.512) 5.512 7.526 ( -0.000 0.000 3.146) 3.146 7.526 ( -0.000 0.000 3.146) 3.146 7.899 ( 0.000 -0.000 -0.861) 0.861 9.310 ( 0.000 -0.000 -2.003) 2.003 9.854 ( 0.000 -0.000 -4.111) 4.111 9.854 ( 0.000 -0.000 -4.111) 4.111 16.077 ( -0.000 0.000 2.290) 2.290 16.077 ( -0.000 0.000 2.290) 2.290 17.056 ( 0.000 -0.000 -1.691) 1.691 17.224 ( 0.000 -0.000 -1.920) 1.920 17.224 ( 0.000 -0.000 -1.920) 1.920 19.045 ( -0.000 0.000 1.512) 1.512 ======================= Grid point 163 (70/294) ======================= q-point: ( 0.17 0.08 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.534 ( 11.295 7.619 11.031) 17.530 0.763 ( -1.595 22.044 24.798) 33.218 1.027 ( 22.211 -3.605 28.466) 36.286 3.188 ( -8.848 -8.448 -11.398) 16.720 3.420 ( -2.240 -4.519 -3.475) 6.126 4.054 ( -0.481 2.569 -0.665) 2.697 4.188 ( 3.330 3.962 -0.147) 5.177 4.491 ( -9.052 -5.711 -11.744) 15.889 5.765 ( -3.586 -1.953 2.583) 4.832 6.332 ( -1.267 -1.281 0.961) 2.042 6.485 ( 6.557 4.747 2.054) 8.352 7.153 ( -0.607 0.012 5.865) 5.896 7.507 ( -0.209 -2.557 2.790) 3.790 7.629 ( 4.460 3.110 6.209) 8.253 7.914 ( 1.885 1.243 -0.990) 2.465 9.181 ( -6.826 -4.893 1.370) 8.509 9.791 ( -0.323 -4.813 -8.112) 9.438 9.906 ( 0.577 6.011 -6.306) 8.732 16.062 ( -0.352 -0.486 0.934) 1.110 16.154 ( 3.118 2.477 4.590) 6.077 17.024 ( -1.666 -0.331 -2.333) 2.886 17.175 ( -3.098 3.590 -4.946) 6.852 17.336 ( 5.161 1.035 -0.904) 5.341 18.936 ( -4.903 -6.448 4.674) 9.352 ======================= Grid point 164 (71/294) ======================= q-point: ( 0.25 0.08 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.920 ( 17.248 13.911 -0.740) 22.171 1.102 ( -1.735 26.094 23.268) 35.004 1.511 ( 22.673 -5.034 22.879) 32.602 2.883 ( -10.009 -9.299 -8.403) 16.039 3.269 ( -3.727 -11.745 -1.472) 12.410 4.060 ( -5.512 2.831 -4.160) 7.463 4.177 ( -7.327 0.058 -10.815) 13.063 4.282 ( 0.489 -2.149 -1.616) 2.733 5.704 ( -2.628 -1.066 0.210) 2.843 6.316 ( 0.113 -1.034 1.172) 1.567 6.646 ( 5.616 5.231 1.284) 7.781 7.179 ( -0.243 0.774 3.999) 4.081 7.510 ( 1.726 -3.005 3.922) 5.234 7.795 ( 6.486 4.063 7.888) 10.990 7.964 ( 3.032 1.584 -1.012) 3.567 9.028 ( -6.973 -5.252 -0.052) 8.730 9.654 ( -4.610 -3.586 -10.682) 12.175 9.913 ( -0.778 2.455 -3.116) 4.043 16.072 ( 1.754 0.213 -0.291) 1.791 16.268 ( 3.516 3.258 5.771) 7.502 16.981 ( -2.055 1.028 -2.738) 3.574 17.121 ( -3.243 2.869 -6.736) 8.008 17.372 ( -1.575 -1.031 4.370) 4.758 18.855 ( -0.070 -6.172 0.776) 6.221 ======================= Grid point 165 (72/294) ======================= q-point: ( 0.33 0.08 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.309 ( 15.952 14.393 -5.666) 22.220 1.452 ( -0.843 24.669 20.008) 31.774 1.881 ( 13.555 -5.212 12.344) 19.060 2.648 ( -2.839 -8.727 0.494) 9.190 3.086 ( -2.389 -13.961 -1.150) 14.210 3.797 ( -13.168 -4.319 -9.406) 16.748 4.091 ( -3.992 2.489 -7.869) 9.168 4.258 ( -2.981 -0.506 1.440) 3.349 5.670 ( -0.368 0.575 -2.751) 2.835 6.330 ( 1.398 -0.664 1.765) 2.347 6.773 ( 3.819 4.345 0.518) 5.808 7.204 ( 0.339 1.024 0.987) 1.462 7.559 ( 3.822 -1.563 5.033) 6.509 7.991 ( 5.109 6.072 4.294) 9.023 8.030 ( 5.359 -0.547 2.877) 6.107 8.854 ( -7.765 -5.424 -0.481) 9.484 9.463 ( -7.020 -2.558 -11.372) 13.606 9.897 ( -1.329 0.242 -0.531) 1.452 16.123 ( 4.217 1.007 -1.018) 4.453 16.385 ( 2.629 3.406 5.220) 6.765 16.947 ( -1.915 1.444 -2.098) 3.186 17.048 ( -2.754 1.422 -7.414) 8.035 17.327 ( -5.811 -2.671 7.655) 9.975 18.816 ( 2.092 -4.712 -2.745) 5.841 ======================= Grid point 166 (73/294) ======================= q-point: ( 0.42 0.08 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.629 ( 10.639 12.414 -6.953) 17.766 1.731 ( 0.442 14.920 10.822) 18.437 1.955 ( -1.402 -2.446 1.600) 3.241 2.669 ( 8.478 -7.890 5.964) 13.027 2.947 ( 0.112 -11.229 6.528) 12.989 3.534 ( -9.081 -0.853 -7.821) 12.015 3.945 ( -7.743 -2.637 -6.896) 10.698 4.208 ( -4.285 0.643 2.304) 4.908 5.666 ( 1.208 1.549 -5.188) 5.548 6.362 ( 1.571 -0.662 2.344) 2.898 6.860 ( 2.324 2.970 0.396) 3.792 7.216 ( 0.807 0.166 -2.467) 2.600 7.664 ( 5.727 1.055 4.833) 7.568 8.063 ( 1.874 1.762 -1.144) 2.815 8.197 ( 5.284 3.290 5.940) 8.604 8.682 ( -6.242 -5.712 1.177) 8.543 9.262 ( -7.164 -1.559 -9.343) 11.876 9.871 ( -1.603 -0.679 0.836) 1.931 16.215 ( 6.097 1.639 -1.042) 6.398 16.466 ( 0.495 3.330 2.243) 4.045 16.910 ( -1.340 -1.489 -2.455) 3.169 16.998 ( -0.743 2.464 -4.070) 4.816 17.230 ( -8.065 -3.597 8.757) 12.437 18.797 ( 2.514 -2.691 -5.230) 6.397 ======================= Grid point 167 (74/294) ======================= q-point: ( 0.50 0.08 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.705 ( -2.355 -0.235 -2.215) 3.242 1.908 ( 4.241 1.276 -2.277) 4.980 1.962 ( 3.582 6.892 -1.697) 7.950 2.690 ( -0.042 -3.092 0.565) 3.143 2.994 ( 2.946 -5.535 14.416) 15.721 3.392 ( -6.157 5.590 -8.389) 11.813 3.777 ( -2.550 -6.525 1.916) 7.262 4.160 ( -3.234 0.537 0.821) 3.379 5.671 ( 1.626 1.691 -6.652) 7.053 6.390 ( 0.854 -0.902 2.842) 3.102 6.912 ( 1.019 1.618 0.708) 2.039 7.198 ( 0.802 -1.521 -6.312) 6.542 7.809 ( 5.977 3.312 3.488) 7.672 8.089 ( 0.764 -0.151 -0.985) 1.256 8.264 ( -3.400 4.312 0.421) 5.507 8.582 ( -1.273 -6.141 2.189) 6.643 9.132 ( -2.321 0.159 -1.800) 2.941 9.844 ( -1.579 -0.584 1.111) 2.017 16.329 ( 5.865 1.627 -0.179) 6.089 16.485 ( -1.668 2.865 -2.309) 4.040 16.861 ( 0.951 -3.128 -3.552) 4.827 17.021 ( 1.067 2.364 2.078) 3.324 17.110 ( -8.278 -3.190 8.409) 12.223 18.783 ( 1.964 -0.738 -7.053) 7.358 ======================= Grid point 168 (75/294) ======================= q-point: (-0.42 0.08 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.628 ( -0.948 -5.754 -6.590) 8.800 1.895 ( 1.429 -4.783 0.273) 4.999 2.084 ( 6.186 0.811 -6.822) 9.245 2.687 ( -4.189 7.618 1.238) 8.781 2.931 ( -10.950 -5.454 6.045) 13.645 3.369 ( -0.586 9.984 -2.981) 10.436 3.824 ( 9.307 -5.600 10.989) 15.451 4.127 ( -0.913 -0.057 -0.833) 1.237 5.671 ( 1.365 1.381 -7.097) 7.358 6.404 ( -0.201 -1.026 3.209) 3.375 6.931 ( -0.319 0.180 0.919) 0.989 7.139 ( 0.438 -2.730 -10.068) 10.440 7.921 ( 0.191 1.698 3.015) 3.466 8.049 ( -3.147 1.627 -4.741) 5.918 8.277 ( 1.398 2.514 4.040) 4.959 8.481 ( -4.287 -4.579 -4.019) 7.450 9.195 ( 6.059 1.581 7.384) 9.682 9.823 ( -1.281 0.147 0.551) 1.402 16.406 ( 0.773 0.432 1.200) 1.492 16.450 ( -1.550 1.081 -5.130) 5.467 16.854 ( 3.915 -1.974 -3.870) 5.848 17.017 ( -5.535 -1.217 7.425) 9.341 17.090 ( 2.280 1.030 6.129) 6.619 18.764 ( 1.099 0.873 -8.482) 8.597 ======================= Grid point 169 (76/294) ======================= q-point: (-0.33 0.08 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.448 ( -1.192 -16.281 -14.248) 21.668 1.910 ( -0.054 1.271 -0.006) 1.272 2.077 ( -2.006 -2.891 -3.596) 5.031 2.569 ( -10.434 -3.121 -2.590) 11.194 2.864 ( -2.271 8.647 8.629) 12.425 3.495 ( 4.303 10.201 2.147) 11.277 4.027 ( 10.840 -2.187 10.273) 15.094 4.121 ( 1.662 -0.920 -2.011) 2.766 5.660 ( 0.928 0.959 -6.602) 6.735 6.402 ( -1.310 -0.851 3.490) 3.824 6.906 ( -1.977 -2.377 -1.124) 3.290 7.062 ( 0.626 -1.366 -10.665) 10.770 7.842 ( -7.433 -2.543 0.680) 7.885 8.031 ( -1.521 4.012 -3.867) 5.776 8.266 ( -7.058 -5.745 3.513) 9.755 8.464 ( 7.744 4.456 -2.261) 9.216 9.393 ( 8.711 2.297 9.553) 13.131 9.813 ( -0.582 0.966 -0.596) 1.275 16.361 ( -3.368 0.308 -5.242) 6.238 16.404 ( -3.099 -3.046 1.925) 4.753 16.900 ( 4.622 0.258 -3.890) 6.047 17.009 ( -0.483 2.014 6.154) 6.493 17.180 ( 3.466 -1.037 8.290) 9.045 18.738 ( 0.528 2.065 -9.554) 9.789 ======================= Grid point 170 (77/294) ======================= q-point: (-0.25 0.08 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.141 ( -2.378 -22.774 -15.884) 27.868 1.719 ( -22.039 6.052 -14.872) 27.267 1.975 ( -7.038 -9.749 7.857) 14.363 2.507 ( 6.821 -2.082 6.850) 9.889 3.002 ( 2.166 11.259 3.543) 12.000 3.724 ( 9.152 10.642 4.061) 14.612 4.135 ( 3.272 -2.099 -2.592) 4.672 4.216 ( 7.042 -0.277 6.157) 9.358 5.645 ( 0.643 0.745 -5.389) 5.478 6.388 ( -2.064 -0.493 3.860) 4.405 6.806 ( -3.249 -4.160 -6.257) 8.186 7.027 ( 1.190 0.756 -6.252) 6.409 7.701 ( -5.622 -3.786 -0.742) 6.818 7.973 ( -7.973 2.152 -1.496) 8.392 8.127 ( -3.962 -5.489 2.746) 7.305 8.653 ( 9.513 5.165 -0.640) 10.843 9.610 ( 7.781 3.212 8.666) 12.081 9.817 ( 0.877 1.197 -2.245) 2.691 16.268 ( -2.877 -1.497 -6.919) 7.641 16.318 ( -5.584 -3.076 4.471) 7.787 16.947 ( 2.779 0.892 -2.218) 3.666 17.098 ( 2.698 4.739 4.833) 7.287 17.271 ( 3.800 -3.085 8.328) 9.660 18.713 ( 0.781 2.598 -10.032) 10.393 ======================= Grid point 171 (78/294) ======================= q-point: (-0.17 0.08 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.787 ( -2.693 -24.786 -12.431) 27.859 1.257 ( -28.529 7.009 -18.418) 34.674 1.712 ( -17.082 -16.217 14.388) 27.601 2.757 ( 15.743 2.818 6.934) 17.432 3.170 ( 3.888 10.266 1.327) 11.058 3.993 ( 8.092 6.276 2.128) 10.459 4.171 ( 6.144 -0.032 -2.483) 6.627 4.308 ( 1.801 0.331 1.663) 2.474 5.638 ( 0.867 1.014 -3.683) 3.917 6.375 ( -1.811 -0.295 4.305) 4.680 6.669 ( -4.014 -3.547 -7.242) 9.008 7.032 ( 1.604 1.208 -3.460) 4.000 7.588 ( -2.572 -4.394 -1.711) 5.371 7.824 ( -10.559 -0.552 3.256) 11.064 8.050 ( -2.479 -3.550 0.889) 4.420 8.845 ( 8.606 4.609 -0.531) 9.776 9.782 ( 2.761 3.782 4.957) 6.819 9.851 ( 5.216 1.034 -2.743) 5.983 16.167 ( -2.248 -2.504 -6.110) 6.975 16.230 ( -5.531 -1.862 4.889) 7.613 16.985 ( 2.022 1.166 -1.438) 2.742 17.220 ( 1.919 5.999 5.455) 8.333 17.332 ( 2.607 -4.323 6.116) 7.930 18.700 ( 2.099 1.925 -9.343) 9.767 ======================= Grid point 172 (79/294) ======================= q-point: (-0.08 0.08 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.475 ( -2.920 -20.904 -1.259) 21.144 0.742 ( -30.345 8.372 -16.593) 35.584 1.311 ( -22.149 -19.498 17.972) 34.551 3.104 ( 17.192 3.491 7.374) 19.030 3.326 ( 4.720 7.150 -1.450) 8.689 4.051 ( 0.339 -2.611 -1.018) 2.823 4.219 ( -4.413 0.883 -3.524) 5.716 4.429 ( 10.954 5.875 -1.733) 12.550 5.659 ( 2.151 1.752 -1.203) 3.024 6.375 ( -0.831 -0.621 4.265) 4.389 6.531 ( -4.877 -2.457 -5.315) 7.620 7.057 ( 1.615 1.060 -1.022) 2.185 7.517 ( -0.009 -3.845 -1.987) 4.328 7.679 ( -8.886 -1.590 5.963) 10.819 7.980 ( -2.838 -2.380 -0.125) 3.706 9.008 ( 6.709 3.302 0.606) 7.502 9.831 ( 2.177 0.319 -2.512) 3.339 9.959 ( 3.938 3.871 -1.009) 5.613 16.087 ( -1.350 -1.794 -3.866) 4.471 16.161 ( -4.455 -1.255 4.397) 6.384 17.019 ( 1.625 1.363 -1.195) 2.434 17.307 ( -2.440 3.286 5.091) 6.532 17.358 ( 2.262 -1.128 2.383) 3.474 18.715 ( 4.344 -0.029 -5.699) 7.166 ======================= Grid point 175 (80/294) ======================= q-point: ( 0.17 0.17 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.525 ( 1.048 -5.118 20.540) 21.194 0.793 ( 10.276 0.260 25.915) 27.879 1.296 ( -5.667 24.424 26.064) 36.166 3.195 ( -3.845 -3.851 -13.935) 14.960 3.377 ( -1.153 -1.210 -7.591) 7.772 4.069 ( -0.974 -0.339 -1.920) 2.179 4.114 ( 4.684 -1.510 2.124) 5.360 4.437 ( -0.510 -7.530 -13.076) 15.098 5.769 ( 0.004 -5.816 1.865) 6.108 6.386 ( -1.659 1.732 0.152) 2.403 6.447 ( 2.035 3.258 4.265) 5.740 7.170 ( 0.301 -4.013 6.908) 7.995 7.516 ( -1.675 -2.217 2.886) 4.006 7.694 ( 0.311 8.336 7.612) 11.293 7.907 ( -0.034 2.330 -1.109) 2.581 9.185 ( -0.855 -8.054 -0.802) 8.139 9.729 ( -1.778 -2.843 -8.356) 9.003 9.880 ( 2.805 3.848 -6.134) 7.765 16.063 ( -0.239 -1.943 1.924) 2.745 16.184 ( 0.452 4.399 4.892) 6.594 17.013 ( 0.493 -1.577 -2.442) 2.949 17.202 ( 6.550 3.900 -6.657) 10.121 17.313 ( -3.923 6.770 -1.601) 7.987 18.926 ( -2.728 -12.602 5.081) 13.859 ======================= Grid point 176 (81/294) ======================= q-point: ( 0.25 0.17 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.775 ( 14.795 8.146 6.100) 17.957 1.191 ( 18.769 -1.277 23.580) 30.165 1.593 ( -3.191 22.666 23.695) 32.945 2.927 ( -11.399 -4.001 -12.683) 17.515 3.233 ( -5.554 -11.074 -2.458) 12.630 4.077 ( 2.012 2.260 -6.269) 6.961 4.210 ( -1.997 -6.691 -6.449) 9.505 4.223 ( -0.548 0.870 -5.041) 5.145 5.701 ( -1.240 -6.029 -0.514) 6.177 6.348 ( -2.767 0.895 1.360) 3.210 6.599 ( 6.608 4.231 2.770) 8.321 7.174 ( 0.995 -5.005 5.373) 7.410 7.493 ( -0.040 -3.226 4.669) 5.675 7.841 ( 1.819 8.957 8.001) 12.147 7.940 ( 1.589 3.078 -1.295) 3.698 9.049 ( -4.160 -8.432 -1.442) 9.512 9.635 ( -2.710 -1.422 -7.949) 8.518 9.904 ( 1.216 2.000 -6.045) 6.483 16.054 ( 0.225 -1.327 1.203) 1.805 16.286 ( 2.615 4.651 5.373) 7.572 16.987 ( -0.302 -1.048 -2.403) 2.639 17.219 ( -4.908 7.361 -8.626) 12.356 17.374 ( 3.279 3.447 0.708) 4.810 18.773 ( -1.699 -14.480 4.065) 15.136 ======================= Grid point 177 (82/294) ======================= q-point: ( 0.33 0.17 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.147 ( 16.436 12.151 -2.247) 20.563 1.592 ( 15.663 -1.106 16.316) 22.644 1.868 ( -0.817 14.587 18.452) 23.536 2.665 ( -8.580 -1.841 -6.525) 10.935 3.020 ( -4.863 -12.604 1.315) 13.573 3.896 ( -11.059 -6.362 -9.703) 16.029 4.099 ( -0.945 1.030 -8.333) 8.450 4.286 ( 0.985 1.479 0.786) 1.943 5.628 ( 0.461 -4.558 -4.170) 6.195 6.340 ( -0.641 1.081 2.303) 2.624 6.745 ( 4.966 3.834 1.169) 6.382 7.169 ( 1.516 -4.941 1.641) 5.423 7.519 ( 2.980 -3.114 6.900) 8.136 7.988 ( 3.029 2.617 -0.349) 4.018 8.016 ( 2.915 7.954 6.394) 10.614 8.890 ( -5.052 -7.663 -1.162) 9.252 9.507 ( -6.495 0.670 -8.907) 11.044 9.898 ( 0.294 0.106 -3.002) 3.018 16.069 ( 2.274 -0.394 0.217) 2.318 16.404 ( 2.799 4.088 5.031) 7.061 16.955 ( -0.752 -1.458 -2.394) 2.902 17.138 ( -6.809 7.770 -8.551) 13.412 17.419 ( -2.178 -0.195 5.609) 6.020 18.670 ( 3.420 -12.185 -1.001) 12.696 ======================= Grid point 178 (83/294) ======================= q-point: ( 0.42 0.17 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.489 ( 14.419 11.900 -6.583) 19.820 1.789 ( 3.044 -3.060 1.869) 4.703 2.000 ( -0.563 -2.039 6.818) 7.139 2.616 ( 1.171 6.025 7.017) 9.323 2.901 ( -1.104 -6.948 9.290) 11.654 3.624 ( -9.411 -3.642 -6.997) 12.280 3.994 ( -5.638 -1.084 -8.912) 10.601 4.284 ( -2.970 -0.205 2.533) 3.909 5.586 ( 2.872 -2.867 -7.643) 8.653 6.368 ( 0.401 1.508 3.030) 3.408 6.845 ( 3.127 2.816 0.251) 4.215 7.146 ( 1.758 -5.244 -2.469) 6.057 7.610 ( 5.613 -1.252 7.151) 9.176 8.040 ( 1.975 2.007 -1.563) 3.221 8.188 ( 5.096 5.378 5.796) 9.407 8.729 ( -6.154 -6.507 0.252) 8.960 9.348 ( -8.411 2.959 -7.965) 11.956 9.883 ( -0.412 -1.033 -0.230) 1.135 16.127 ( 4.930 0.413 -0.356) 4.960 16.500 ( 1.314 3.556 2.928) 4.789 16.890 ( -2.151 -3.522 -4.330) 5.982 17.077 ( -4.462 7.811 -4.052) 9.866 17.372 ( -6.594 -2.890 9.007) 11.531 18.635 ( 6.274 -8.434 -5.837) 12.023 ======================= Grid point 179 (84/294) ======================= q-point: ( 0.50 0.17 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.712 ( -1.781 -1.651 -3.647) 4.381 1.765 ( 10.543 4.848 -8.889) 14.618 1.902 ( -1.632 -12.923 -3.454) 13.475 2.806 ( -0.359 14.399 8.858) 16.909 2.956 ( 4.661 -5.032 17.046) 18.374 3.465 ( -3.948 0.397 -4.560) 6.045 3.815 ( -7.784 -2.478 -5.423) 9.805 4.226 ( -4.372 -1.761 2.690) 5.427 5.574 ( 4.215 -1.758 -9.413) 10.463 6.408 ( 0.065 1.801 3.465) 3.905 6.907 ( 1.894 1.560 0.228) 2.464 7.095 ( 1.583 -6.155 -6.429) 9.040 7.755 ( 7.160 1.523 5.289) 9.031 8.071 ( 1.062 0.861 -1.100) 1.755 8.322 ( 2.808 3.467 0.557) 4.496 8.576 ( -5.561 -6.504 2.495) 8.914 9.223 ( -6.769 5.286 -2.849) 9.049 9.864 ( -0.889 -1.272 1.280) 2.012 16.230 ( 6.932 0.803 -0.171) 6.980 16.533 ( -1.986 3.094 -1.480) 3.963 16.795 ( -0.468 -4.761 -4.307) 6.437 17.087 ( -2.185 5.859 1.865) 6.526 17.272 ( -8.276 -2.596 9.335) 12.743 18.635 ( 6.579 -5.320 -8.948) 12.315 ======================= Grid point 180 (85/294) ======================= q-point: ( 0.58 0.17 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.556 ( -4.986 -10.929 -7.336) 14.075 1.776 ( 3.350 -8.063 -2.267) 9.021 1.929 ( 8.838 2.648 -7.301) 11.766 2.901 ( -7.361 13.675 0.324) 15.534 3.056 ( -2.328 -4.284 13.456) 14.312 3.440 ( 0.381 4.275 -2.883) 5.171 3.723 ( 2.271 -1.833 5.569) 6.287 4.155 ( -3.462 -2.007 1.994) 4.471 5.576 ( 4.258 -1.218 -9.265) 10.269 6.440 ( -0.928 1.972 3.745) 4.333 6.939 ( 0.338 0.002 1.091) 1.142 7.010 ( 1.700 -6.394 -10.426) 12.348 7.912 ( 5.521 3.040 2.385) 6.738 8.075 ( -0.579 0.635 -1.768) 1.966 8.332 ( -2.733 3.212 -3.196) 5.292 8.465 ( -2.563 -7.660 2.791) 8.546 9.222 ( -0.522 6.174 4.915) 7.909 9.846 ( -1.047 -0.939 1.484) 2.044 16.352 ( 6.407 0.401 1.026) 6.501 16.476 ( -4.111 0.587 -5.332) 6.758 16.756 ( 2.691 -2.890 -3.018) 4.970 17.097 ( -3.550 -2.274 7.416) 8.530 17.208 ( -5.054 5.482 6.834) 10.114 18.639 ( 5.690 -3.282 -10.908) 12.733 ======================= Grid point 181 (86/294) ======================= q-point: (-0.33 0.17 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.288 ( -6.277 -14.798 -9.205) 18.524 1.827 ( 7.550 -1.112 0.127) 7.632 2.020 ( 5.128 -1.341 -3.220) 6.202 2.760 ( -15.607 3.475 -9.710) 18.707 3.036 ( -5.042 2.135 12.121) 13.301 3.514 ( 4.820 4.458 -0.939) 6.632 3.895 ( 10.345 1.313 9.712) 14.250 4.108 ( -1.811 -0.896 1.933) 2.797 5.581 ( 3.569 -0.829 -7.697) 8.525 6.458 ( -1.995 2.116 4.046) 4.982 6.876 ( -1.079 -6.309 -7.511) 9.868 6.972 ( 1.911 -0.486 -3.785) 4.268 7.928 ( -5.386 -1.504 -2.347) 6.065 8.077 ( -0.603 5.865 -3.382) 6.797 8.347 ( -5.124 -6.108 0.458) 7.986 8.362 ( 5.221 1.422 2.364) 5.905 9.359 ( 5.252 4.956 8.351) 11.040 9.829 ( -0.919 -0.589 0.651) 1.271 16.366 ( -3.621 -1.494 -6.537) 7.621 16.433 ( 1.052 -1.284 3.652) 4.011 16.790 ( 5.475 0.069 -3.788) 6.658 17.054 ( -2.028 -3.515 8.072) 9.034 17.261 ( -2.404 7.408 7.453) 10.780 18.631 ( 4.600 -1.916 -12.347) 13.314 ======================= Grid point 182 (87/294) ======================= q-point: (-0.25 0.17 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.985 ( -8.543 -13.612 -5.762) 17.073 1.938 ( 1.446 1.121 -0.216) 1.842 1.994 ( -5.402 -0.739 -5.042) 7.426 2.502 ( -7.485 -2.480 0.714) 7.917 3.057 ( -0.374 2.441 2.793) 3.729 3.671 ( 10.137 3.926 -0.373) 10.877 4.097 ( -1.290 1.401 2.529) 3.166 4.126 ( 8.977 1.534 6.425) 11.146 5.589 ( 2.658 -0.169 -5.352) 5.978 6.461 ( -3.005 1.805 4.299) 5.547 6.753 ( -1.114 -5.003 -8.951) 10.314 6.979 ( 1.426 -0.048 -2.416) 2.806 7.770 ( -7.861 -1.364 -5.474) 9.676 8.084 ( -2.650 4.330 -2.109) 5.497 8.193 ( -7.777 -6.450 4.418) 11.027 8.526 ( 10.028 2.685 0.502) 10.393 9.557 ( 7.695 3.688 7.735) 11.517 9.812 ( -0.492 -0.599 -0.814) 1.124 16.254 ( -3.243 -2.249 -6.079) 7.248 16.412 ( -4.171 -1.942 4.743) 6.608 16.876 ( 5.711 1.594 -3.439) 6.854 17.080 ( 3.261 -2.707 7.716) 8.804 17.335 ( -2.235 6.371 8.064) 10.517 18.611 ( 3.833 -0.795 -13.399) 13.959 ======================= Grid point 183 (88/294) ======================= q-point: (-0.17 0.17 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.720 ( -10.830 -5.810 4.667) 13.146 1.668 ( -24.525 7.310 -15.134) 29.731 1.882 ( -9.807 -11.764 11.374) 19.077 2.578 ( 12.146 1.113 6.052) 13.616 3.104 ( 5.994 -1.045 -5.126) 7.956 3.907 ( 14.660 3.129 -0.997) 15.023 4.104 ( -1.909 2.190 3.115) 4.259 4.277 ( 4.278 1.256 1.961) 4.871 5.605 ( 1.875 0.957 -3.032) 3.691 6.438 ( -3.192 -0.492 2.899) 4.340 6.656 ( -2.100 -0.608 -5.485) 5.904 6.994 ( 1.904 0.491 -1.980) 2.790 7.611 ( -5.937 -0.857 -5.953) 8.451 8.007 ( -9.843 -2.584 4.623) 11.177 8.073 ( -2.875 -1.353 0.842) 3.287 8.720 ( 10.264 2.828 -0.602) 10.664 9.749 ( 7.246 1.475 2.946) 7.960 9.798 ( 0.793 0.414 -0.302) 0.944 16.154 ( -2.774 -1.491 -4.957) 5.873 16.339 ( -5.730 -1.669 4.955) 7.757 16.948 ( 3.237 1.631 -1.940) 4.111 17.185 ( 6.735 -3.012 7.302) 10.380 17.393 ( -2.733 4.765 7.122) 8.994 18.591 ( 3.669 0.533 -13.341) 13.847 ======================= Grid point 184 (89/294) ======================= q-point: (-0.08 0.17 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.628 ( -10.835 9.957 19.838) 24.700 1.219 ( -28.279 8.876 -14.109) 32.826 1.586 ( -19.285 -16.419 17.507) 30.789 2.882 ( 17.129 2.729 5.329) 18.145 3.153 ( 9.352 -6.528 -10.826) 15.725 4.118 ( -2.713 5.598 4.015) 7.404 4.160 ( 13.626 0.151 -3.596) 14.094 4.313 ( 0.823 -0.048 -2.114) 2.269 5.636 ( 1.846 1.982 -1.125) 2.933 6.387 ( -1.542 -3.289 0.186) 3.637 6.604 ( -4.811 3.845 0.041) 6.158 7.032 ( 2.468 1.683 -0.269) 2.999 7.501 ( -2.846 -0.406 -4.738) 5.542 7.843 ( -9.676 -4.602 7.492) 13.074 8.019 ( -3.489 0.115 -0.503) 3.527 8.899 ( 9.235 1.883 -0.590) 9.443 9.766 ( 1.914 -1.749 -5.234) 5.841 9.920 ( 5.360 2.576 2.212) 6.345 16.083 ( -1.986 0.004 -3.290) 3.843 16.261 ( -5.525 -1.138 5.001) 7.539 16.995 ( 2.061 1.221 -1.275) 2.714 17.296 ( 5.156 -3.952 6.268) 9.027 17.410 ( -2.903 1.319 3.484) 4.723 18.603 ( 4.528 3.142 -9.393) 10.890 ======================= Grid point 187 (90/294) ======================= q-point: ( 0.17 0.25 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.696 ( -14.045 -4.778 17.221) 22.730 0.900 ( -5.577 -1.964 21.737) 22.527 1.747 ( -5.176 21.678 20.258) 30.118 3.024 ( 10.113 -0.780 -8.979) 13.546 3.355 ( -0.406 -1.507 -6.869) 7.044 4.016 ( 3.485 -1.796 -0.774) 3.996 4.070 ( -0.428 -6.830 -9.571) 11.766 4.289 ( 1.517 -2.446 -6.324) 6.948 5.701 ( 1.428 -6.405 0.579) 6.588 6.375 ( 3.054 2.588 1.606) 4.313 6.555 ( -6.478 1.748 2.524) 7.168 7.164 ( -0.593 -5.014 5.351) 7.357 7.552 ( -1.796 -0.105 3.040) 3.532 7.813 ( -1.379 5.068 6.367) 8.254 7.964 ( -2.074 6.478 1.406) 6.945 9.074 ( 3.768 -7.801 -1.576) 8.806 9.637 ( 3.278 -2.609 -11.438) 12.181 9.863 ( -0.813 1.546 -2.995) 3.467 16.066 ( -0.724 -0.593 1.386) 1.672 16.270 ( -1.983 3.891 5.842) 7.294 16.950 ( 1.899 -2.639 -3.636) 4.878 17.110 ( 3.985 3.354 -6.051) 7.984 17.402 ( -0.917 2.330 1.645) 2.996 18.876 ( -1.060 -8.420 1.665) 8.648 ======================= Grid point 188 (91/294) ======================= q-point: ( 0.25 0.25 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.700 ( 5.549 1.891 14.443) 15.587 1.078 ( 10.020 -0.497 23.476) 25.530 1.968 ( -3.727 17.223 15.708) 23.607 3.004 ( -6.327 0.700 -8.503) 10.622 3.203 ( -5.431 -8.089 -5.810) 11.344 3.985 ( 3.283 -4.482 -9.725) 11.200 4.107 ( 6.113 0.007 -1.530) 6.302 4.211 ( -2.374 -1.064 -6.387) 6.896 5.636 ( -0.250 -8.727 -0.821) 8.769 6.410 ( -2.316 0.795 0.033) 2.449 6.571 ( 3.160 3.628 5.315) 7.169 7.137 ( 0.263 -7.026 5.930) 9.198 7.515 ( -2.735 -1.491 3.034) 4.349 7.888 ( 2.478 3.065 1.099) 4.091 8.021 ( -2.294 8.830 4.741) 10.282 8.994 ( -0.958 -9.299 -2.273) 9.621 9.609 ( 0.931 0.444 -7.009) 7.085 9.862 ( 1.001 1.609 -5.402) 5.725 16.054 ( -0.705 -1.375 1.936) 2.477 16.340 ( 0.549 5.503 5.584) 7.859 16.936 ( 1.995 -3.074 -3.698) 5.207 17.210 ( 5.614 5.826 -7.533) 11.055 17.414 ( -1.520 5.272 -0.906) 5.561 18.714 ( -5.232 -15.524 4.039) 16.872 ======================= Grid point 189 (92/294) ======================= q-point: ( 0.33 0.25 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.990 ( 14.525 9.096 3.383) 17.469 1.413 ( 15.047 -2.472 20.573) 25.608 2.083 ( -3.919 4.514 5.631) 8.212 2.820 ( -11.372 2.868 -4.604) 12.599 3.030 ( -5.427 -3.707 3.626) 7.507 3.890 ( -2.622 -8.132 -10.527) 13.558 4.076 ( -1.758 0.600 -5.863) 6.150 4.261 ( 4.595 3.533 -1.796) 6.068 5.535 ( 0.070 -8.662 -3.960) 9.525 6.383 ( -1.621 0.794 1.764) 2.524 6.706 ( 5.005 3.164 3.438) 6.847 7.106 ( 0.653 -7.682 4.241) 8.799 7.497 ( 0.334 -1.856 4.547) 4.923 7.956 ( 2.951 2.435 -1.567) 4.134 8.102 ( -0.092 6.575 3.960) 7.676 8.878 ( -2.760 -6.704 -0.104) 7.250 9.570 ( -3.682 3.032 -5.598) 7.354 9.859 ( 1.449 0.205 -4.771) 4.990 16.046 ( 0.244 -0.984 1.394) 1.724 16.440 ( 1.414 5.278 4.952) 7.374 16.912 ( 1.240 -3.338 -3.967) 5.331 17.248 ( -2.585 6.478 -7.658) 10.359 17.461 ( 1.013 4.544 -0.061) 4.656 18.515 ( -1.618 -16.948 3.239) 17.330 ======================= Grid point 190 (93/294) ======================= q-point: ( 0.42 0.25 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.326 ( 14.388 10.336 -3.256) 18.013 1.680 ( 8.583 -4.667 9.133) 13.374 1.987 ( -4.597 -9.075 -2.879) 10.572 2.691 ( -1.467 -2.702 4.107) 5.131 3.043 ( -5.436 12.503 12.201) 18.296 3.672 ( -7.126 -6.838 -7.603) 12.463 4.010 ( -3.118 0.805 -8.069) 8.688 4.323 ( 0.193 0.834 1.247) 1.513 5.446 ( 2.657 -6.899 -8.054) 10.933 6.398 ( 0.253 1.480 3.144) 3.484 6.815 ( 3.647 2.026 0.872) 4.262 7.060 ( 0.539 -7.595 1.127) 7.697 7.550 ( 4.250 -1.293 5.633) 7.174 8.013 ( 2.587 2.175 -2.078) 3.967 8.182 ( 2.978 2.101 1.338) 3.882 8.776 ( -4.824 -3.490 2.368) 6.408 9.484 ( -7.480 5.636 -5.219) 10.721 9.860 ( 1.328 -1.000 -1.771) 2.429 16.067 ( 2.472 -0.182 0.593) 2.549 16.532 ( 1.102 4.229 3.373) 5.520 16.854 ( -1.041 -4.299 -5.495) 7.055 17.208 ( -4.753 7.611 -4.437) 10.010 17.485 ( -3.276 0.427 5.206) 6.166 18.402 ( 5.194 -13.589 -2.607) 14.779 ======================= Grid point 191 (94/294) ======================= q-point: ( 0.50 0.25 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.592 ( 10.847 7.316 -7.637) 15.149 1.695 ( -1.142 -4.613 -2.127) 5.206 1.779 ( -3.339 -14.669 -4.101) 15.593 2.810 ( 10.315 -2.336 14.298) 17.784 3.150 ( -6.976 14.946 9.815) 19.193 3.479 ( -4.371 -4.943 -5.526) 8.607 3.899 ( -6.509 1.910 -5.765) 8.902 4.297 ( -3.975 -2.132 4.048) 6.061 5.405 ( 5.493 -4.441 -10.735) 12.850 6.446 ( 0.696 2.271 3.822) 4.500 6.874 ( 2.748 0.244 -1.901) 3.350 6.993 ( -0.155 -6.877 -1.352) 7.011 7.671 ( 7.212 0.332 4.841) 8.692 8.053 ( 1.573 1.384 -1.850) 2.795 8.251 ( 5.095 -1.928 -1.110) 5.559 8.671 ( -7.395 -1.587 3.110) 8.178 9.395 ( -7.864 7.837 -2.382) 11.355 9.860 ( 0.509 -1.598 0.709) 1.821 16.134 ( 5.219 0.481 0.136) 5.243 16.586 ( -0.934 3.730 0.159) 3.849 16.739 ( -2.168 -5.646 -5.921) 8.464 17.202 ( -3.321 5.917 1.705) 6.996 17.433 ( -6.875 -0.570 8.308) 10.799 18.384 ( 8.925 -9.220 -8.507) 15.396 ======================= Grid point 192 (95/294) ======================= q-point: ( 0.58 0.25 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.508 ( -6.510 -10.759 -5.078) 13.561 1.648 ( 2.530 -4.966 -2.645) 6.169 1.772 ( 8.181 2.112 -6.497) 10.658 3.044 ( 7.201 -0.796 11.641) 13.712 3.176 ( -8.290 10.429 1.569) 13.414 3.381 ( 1.444 -5.284 -3.771) 6.650 3.805 ( -5.892 4.185 2.649) 7.698 4.226 ( -4.798 -1.679 4.976) 7.114 5.411 ( 6.603 -2.485 -10.373) 12.544 6.499 ( -0.143 3.006 3.913) 4.937 6.867 ( 1.538 -5.461 -7.744) 9.600 6.937 ( -0.067 -1.770 0.810) 1.948 7.833 ( 8.176 1.935 2.301) 8.712 8.070 ( 0.606 0.385 -1.028) 1.254 8.289 ( 3.973 -3.025 -4.247) 6.555 8.541 ( -8.547 -1.946 3.618) 9.483 9.365 ( -4.971 8.444 2.352) 10.077 9.853 ( -0.251 -1.901 1.631) 2.517 16.244 ( 7.221 0.585 0.374) 7.254 16.528 ( -5.692 -0.337 -5.566) 7.968 16.679 ( 2.118 -2.126 -1.581) 3.392 17.193 ( -4.690 -1.318 7.141) 8.644 17.392 ( -5.600 6.027 7.026) 10.819 18.403 ( 9.196 -6.426 -11.590) 16.130 ======================= Grid point 193 (96/294) ======================= q-point: (-0.33 0.25 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.278 ( -8.602 -7.127 -1.132) 11.228 1.691 ( 7.080 -0.494 -1.753) 7.310 1.870 ( 7.934 -1.749 -3.941) 9.030 2.983 ( -13.424 4.342 -10.720) 17.719 3.193 ( -3.644 -0.375 11.927) 12.477 3.384 ( 7.128 -4.981 -3.846) 9.508 3.853 ( 3.774 2.881 8.026) 9.325 4.190 ( -3.783 2.789 5.302) 7.085 5.447 ( 6.120 -1.050 -7.708) 9.898 6.541 ( -1.402 3.801 4.016) 5.704 6.766 ( -0.271 -6.195 -8.719) 10.699 6.941 ( 0.987 -0.627 -0.161) 1.181 7.942 ( 1.123 -0.235 -2.564) 2.809 8.098 ( 2.751 3.831 -0.724) 4.772 8.274 ( 1.362 -1.248 -6.954) 7.195 8.421 ( -5.591 -4.790 7.708) 10.660 9.419 ( -0.317 7.034 5.682) 9.048 9.833 ( -0.623 -2.381 0.981) 2.650 16.360 ( 3.312 -0.340 -1.979) 3.873 16.402 ( -1.757 -1.986 -1.260) 2.936 16.703 ( 2.939 0.556 -2.676) 4.014 17.124 ( -4.854 -4.129 8.276) 10.445 17.434 ( -3.677 8.834 6.675) 11.667 18.422 ( 8.006 -4.310 -12.714) 15.631 ======================= Grid point 194 (97/294) ======================= q-point: (-0.25 0.25 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.095 ( -11.092 0.342 5.789) 12.517 1.823 ( 8.924 1.717 -3.365) 9.691 1.963 ( 6.586 -2.253 0.483) 6.978 2.690 ( -16.591 1.676 -9.787) 19.336 3.133 ( -6.695 -4.709 6.734) 10.600 3.466 ( 11.207 -3.742 -4.323) 12.581 4.027 ( 8.578 0.681 6.513) 10.792 4.207 ( -3.022 5.987 4.078) 7.849 5.499 ( 4.875 0.395 -4.224) 6.462 6.562 ( -3.761 2.447 3.669) 5.796 6.668 ( 0.614 -2.297 -7.295) 7.672 6.949 ( 1.035 -0.591 -0.807) 1.439 7.848 ( -6.553 -0.949 -6.451) 9.245 8.154 ( -2.118 5.634 -2.711) 6.601 8.243 ( -1.600 -4.018 -0.650) 4.373 8.408 ( 5.482 -2.571 6.445) 8.844 9.541 ( 3.759 4.805 6.288) 8.761 9.799 ( -0.432 -3.093 -0.689) 3.198 16.266 ( -4.062 -1.209 -4.870) 6.456 16.453 ( 0.839 -1.815 4.752) 5.156 16.765 ( 5.989 1.799 -3.896) 7.368 17.080 ( -1.348 -3.567 7.875) 8.750 17.491 ( -3.246 6.720 5.776) 9.437 18.438 ( 6.306 -1.444 -12.383) 13.971 ======================= Grid point 195 (98/294) ======================= q-point: (-0.17 0.25 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.013 ( -11.977 10.492 14.864) 21.782 1.909 ( 1.375 -4.378 1.753) 4.912 1.966 ( -9.681 4.986 -7.886) 13.445 2.489 ( -0.053 -0.287 1.075) 1.114 2.998 ( -2.954 -8.442 -1.754) 9.115 3.632 ( 15.336 -2.995 -3.120) 15.934 4.171 ( 3.182 0.235 4.864) 5.817 4.246 ( 0.798 4.542 -0.163) 4.614 5.562 ( 3.382 1.962 -1.572) 4.214 6.486 ( -4.171 -2.774 -1.794) 5.321 6.686 ( -0.235 5.830 1.167) 5.950 6.959 ( 1.565 -0.017 -1.000) 1.857 7.683 ( -7.520 0.492 -7.538) 10.659 8.129 ( -4.486 -0.349 -0.413) 4.519 8.137 ( -5.852 -2.328 4.281) 7.615 8.567 ( 10.423 0.565 1.166) 10.504 9.678 ( 4.401 0.857 2.756) 5.263 9.768 ( 1.792 -1.857 -0.656) 2.663 16.175 ( -3.508 0.375 -3.842) 5.216 16.432 ( -3.967 -1.816 5.082) 6.697 16.871 ( 6.506 1.606 -2.940) 7.318 17.109 ( 3.302 -3.650 7.927) 9.330 17.508 ( -2.975 1.775 2.402) 4.216 18.466 ( 4.611 3.084 -10.207) 11.617 ======================= Grid point 196 (99/294) ======================= q-point: (-0.08 0.25 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.078 ( -10.391 19.126 21.303) 30.456 1.646 ( -23.664 7.559 -13.037) 28.055 1.806 ( -11.516 -11.612 13.899) 21.462 2.666 ( 14.625 1.372 2.985) 14.989 2.888 ( 4.326 -9.124 -8.919) 13.473 3.852 ( 16.965 -3.659 -3.601) 17.725 4.209 ( -0.528 2.386 1.103) 2.681 4.290 ( 1.442 -0.478 -1.583) 2.194 5.623 ( 1.978 2.996 -0.747) 3.667 6.387 ( -3.007 -2.912 -1.751) 4.537 6.735 ( -3.497 6.320 3.463) 8.010 7.008 ( 3.305 2.723 1.042) 4.407 7.543 ( -5.511 1.485 -6.353) 8.540 7.992 ( -8.641 -4.814 7.801) 12.597 8.084 ( -3.962 1.390 -1.161) 4.357 8.746 ( 10.329 0.566 -0.453) 10.354 9.679 ( 1.798 -3.896 -5.090) 6.657 9.859 ( 5.525 0.962 2.277) 6.052 16.115 ( -2.883 2.055 -2.943) 4.604 16.370 ( -5.264 -1.082 5.326) 7.566 16.953 ( 3.644 0.958 -1.855) 4.199 17.200 ( 6.175 -4.518 8.202) 11.217 17.444 ( -2.999 -4.701 -3.267) 6.463 18.541 ( 4.079 8.322 -5.881) 10.976 ======================= Grid point 199 (100/294) ======================= q-point: ( 0.17 0.33 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.031 ( -19.331 -0.499 7.671) 20.803 1.147 ( -14.389 -6.263 18.867) 24.540 2.045 ( 0.035 10.983 8.319) 13.778 2.865 ( 8.755 8.453 3.361) 12.625 3.269 ( 5.717 0.404 -4.268) 7.146 3.790 ( 8.959 -10.442 -12.815) 18.803 3.991 ( -0.610 -3.408 -5.815) 6.768 4.266 ( 0.029 -1.157 -0.504) 1.262 5.627 ( 0.082 -5.351 -1.748) 5.630 6.378 ( 1.413 3.198 2.260) 4.164 6.686 ( -6.444 0.931 1.332) 6.646 7.160 ( -1.707 -4.582 2.467) 5.477 7.605 ( -1.352 1.304 4.466) 4.845 7.907 ( -4.526 0.587 1.328) 4.753 8.095 ( -1.867 8.654 4.849) 10.094 8.915 ( 5.543 -6.975 -1.146) 8.983 9.466 ( 6.564 -1.672 -11.071) 12.978 9.876 ( -1.054 -0.001 -1.421) 1.769 16.099 ( -2.348 1.182 0.674) 2.714 16.371 ( -2.246 2.408 5.068) 6.044 16.888 ( -0.441 -2.831 -3.629) 4.624 17.050 ( 3.299 3.236 -5.587) 7.250 17.407 ( 2.936 -2.026 6.035) 7.011 18.822 ( -0.451 -4.799 -2.992) 5.673 ======================= Grid point 200 (101/294) ======================= q-point: ( 0.25 0.33 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.831 ( -9.412 -1.203 16.920) 19.399 1.117 ( 0.099 -0.468 18.599) 18.606 2.163 ( 0.188 4.821 3.186) 5.782 3.080 ( 1.273 11.875 6.183) 13.448 3.192 ( -5.782 -6.572 -7.735) 11.682 3.754 ( 7.790 -9.586 -13.512) 18.307 4.005 ( 6.239 1.971 -3.238) 7.301 4.226 ( -2.801 -0.086 -2.711) 3.899 5.548 ( -0.416 -9.181 -1.226) 9.272 6.434 ( 0.202 1.546 1.041) 1.875 6.629 ( -2.686 2.250 4.145) 5.427 7.105 ( -0.721 -6.809 4.143) 8.003 7.582 ( -4.091 -0.298 3.136) 5.164 7.887 ( 0.191 1.600 -0.138) 1.617 8.153 ( -2.066 5.365 2.036) 6.100 8.899 ( 1.660 -6.539 -0.097) 6.747 9.519 ( 5.990 1.969 -7.210) 9.578 9.852 ( -1.014 1.035 -3.110) 3.431 16.076 ( -1.801 -0.392 1.899) 2.647 16.422 ( 0.153 5.295 5.187) 7.413 16.842 ( 1.452 -3.664 -4.930) 6.312 17.136 ( 5.301 6.212 -5.512) 9.853 17.454 ( 0.783 0.466 2.687) 2.837 18.679 ( -5.089 -12.663 -0.758) 13.668 ======================= Grid point 201 (102/294) ======================= q-point: ( 0.33 0.33 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.924 ( 6.250 6.165 10.755) 13.884 1.312 ( 9.445 -1.391 19.648) 21.844 2.146 ( -3.227 -3.943 -2.923) 5.874 2.927 ( -9.962 -8.435 -7.142) 14.880 3.221 ( -4.389 14.496 9.057) 17.648 3.721 ( 5.608 -7.560 -9.444) 13.334 4.094 ( -0.323 1.614 -3.121) 3.529 4.193 ( 3.851 3.712 -5.333) 7.553 5.428 ( -0.998 -11.170 -2.385) 11.465 6.421 ( -1.756 -0.440 1.419) 2.301 6.693 ( 2.706 2.734 4.857) 6.196 7.054 ( -0.174 -7.499 3.865) 8.438 7.532 ( -3.054 -0.575 3.305) 4.537 7.924 ( 2.331 2.009 -1.416) 3.388 8.155 ( -0.819 0.885 -1.735) 2.113 8.869 ( -0.925 -2.708 3.038) 4.173 9.594 ( 2.507 4.335 -3.394) 6.050 9.823 ( -0.606 0.850 -4.858) 4.969 16.056 ( -1.218 -0.925 2.089) 2.589 16.515 ( 0.115 6.599 4.860) 8.196 16.808 ( 2.932 -4.554 -5.925) 8.027 17.248 ( 4.033 5.880 -5.005) 8.711 17.483 ( 0.588 3.176 -1.111) 3.416 18.443 ( -6.179 -16.894 2.373) 18.144 ======================= Grid point 202 (103/294) ======================= q-point: ( 0.42 0.33 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.196 ( 11.758 8.467 2.982) 14.793 1.554 ( 9.157 -3.863 12.821) 16.222 1.971 ( -6.672 -8.866 -5.235) 12.269 2.691 ( -4.380 -7.799 -0.718) 8.973 3.328 ( -3.616 12.018 4.852) 13.455 3.658 ( -3.538 -2.425 -1.724) 4.623 4.038 ( -3.277 2.493 -5.274) 6.691 4.298 ( 4.876 3.135 -2.651) 6.374 5.293 ( 0.560 -10.845 -5.434) 12.143 6.418 ( 0.335 -0.308 3.244) 3.276 6.782 ( 2.856 0.600 2.528) 3.861 7.002 ( -0.289 -6.492 2.072) 6.821 7.528 ( 0.736 -0.178 3.816) 3.890 7.975 ( 2.780 1.758 -1.928) 3.813 8.140 ( 1.569 -2.007 -2.915) 3.871 8.845 ( -3.208 -0.220 3.962) 5.102 9.620 ( -4.047 6.663 -1.894) 8.023 9.808 ( 1.835 -0.278 -3.613) 4.061 16.049 ( 0.178 -0.545 1.527) 1.632 16.590 ( -0.626 4.876 3.224) 5.879 16.775 ( 1.700 -3.825 -6.393) 7.641 17.299 ( -1.048 4.887 -2.112) 5.426 17.531 ( 1.602 3.966 -1.516) 4.538 18.223 ( -1.773 -16.924 1.767) 17.108 ======================= Grid point 203 (104/294) ======================= q-point: ( 0.50 0.33 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.457 ( 10.656 6.226 -1.960) 12.496 1.618 ( 0.952 -7.781 -0.424) 7.850 1.746 ( -7.267 -7.288 -3.111) 10.752 2.695 ( 8.189 -4.536 10.995) 14.441 3.340 ( -0.981 -1.047 -7.112) 7.255 3.569 ( -11.128 8.075 4.065) 14.338 3.994 ( -3.812 4.667 -1.263) 6.157 4.349 ( -0.656 0.140 2.595) 2.680 5.202 ( 4.760 -7.671 -9.335) 12.986 6.461 ( 2.029 0.305 4.353) 4.812 6.813 ( 1.546 -2.568 -1.221) 3.237 6.953 ( -0.626 -3.575 0.702) 3.697 7.598 ( 4.873 0.577 3.470) 6.010 8.021 ( 2.443 1.261 -2.052) 3.431 8.140 ( 3.568 -3.952 -1.660) 5.577 8.794 ( -5.824 0.516 2.331) 6.295 9.581 ( -6.964 7.869 -1.666) 10.639 9.827 ( 2.015 -1.079 -0.181) 2.293 16.076 ( 2.583 0.219 0.790) 2.710 16.625 ( 0.426 0.657 0.608) 0.992 16.701 ( -3.195 -1.247 -6.270) 7.147 17.309 ( -2.478 3.249 3.062) 5.106 17.565 ( -2.578 3.554 3.345) 5.519 18.106 ( 6.048 -13.044 -5.105) 15.257 ======================= Grid point 204 (105/294) ======================= q-point: ( 0.58 0.33 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.496 ( -3.320 -7.565 -2.447) 8.617 1.599 ( -3.385 -1.501 -0.819) 3.792 1.625 ( 7.674 1.098 -4.789) 9.112 2.926 ( 12.891 -2.749 13.761) 19.055 3.234 ( -0.349 -6.447 -10.039) 11.936 3.471 ( -11.529 9.185 -2.801) 15.004 3.971 ( -6.309 3.299 5.919) 9.259 4.327 ( -4.129 0.240 5.805) 7.128 5.202 ( 8.255 -3.187 -10.083) 13.415 6.528 ( 2.150 0.982 3.988) 4.636 6.777 ( -0.108 -3.533 -3.891) 5.256 6.924 ( -0.231 -1.698 0.064) 1.715 7.727 ( 7.633 1.334 1.597) 7.912 8.051 ( 1.412 0.427 -1.263) 1.942 8.161 ( 4.591 -4.798 -0.588) 6.667 8.690 ( -8.354 0.543 0.426) 8.382 9.543 ( -5.961 7.876 0.266) 9.881 9.838 ( 0.595 -2.247 1.324) 2.675 16.148 ( 5.268 0.772 0.323) 5.334 16.563 ( -3.795 -4.342 -5.418) 7.912 16.655 ( -0.816 3.235 -0.585) 3.387 17.294 ( -4.355 -2.349 7.626) 9.091 17.575 ( -4.624 6.946 5.473) 9.979 18.102 ( 10.683 -8.377 -10.523) 17.176 ======================= Grid point 205 (106/294) ======================= q-point: (-0.33 0.33 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.387 ( -5.734 0.005 3.178) 6.556 1.586 ( 3.323 0.819 -1.763) 3.850 1.709 ( 6.687 -1.855 -3.163) 7.627 3.097 ( -3.003 -5.044 -11.434) 12.853 3.142 ( 7.406 -3.749 7.160) 10.962 3.365 ( -6.610 5.683 -2.093) 8.965 3.915 ( -4.705 -2.132 8.666) 10.089 4.313 ( -3.453 3.473 4.291) 6.511 5.281 ( 8.517 0.313 -6.672) 10.824 6.589 ( 1.836 1.643 1.404) 2.835 6.712 ( -2.540 -1.480 -2.435) 3.817 6.912 ( 0.955 -1.578 -0.828) 2.022 7.865 ( 6.479 1.068 -2.147) 6.909 8.074 ( 2.103 0.647 0.451) 2.246 8.183 ( 3.602 -4.304 -0.820) 5.672 8.549 ( -9.084 -0.131 0.957) 9.135 9.545 ( -3.334 6.914 2.567) 8.094 9.816 ( -0.436 -4.031 0.750) 4.124 16.259 ( 6.896 0.723 0.157) 6.936 16.430 ( -4.731 -2.498 -3.294) 6.283 16.676 ( 0.610 2.414 -1.452) 2.882 17.217 ( -5.698 -5.090 8.388) 11.346 17.604 ( -3.725 6.635 3.808) 8.509 18.162 ( 10.558 -3.258 -10.074) 14.953 ======================= Grid point 206 (107/294) ======================= q-point: (-0.25 0.33 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.348 ( -7.487 7.528 8.764) 13.767 1.679 ( 7.304 2.969 -5.638) 9.693 1.811 ( 8.963 -1.864 2.574) 9.510 2.882 ( -11.614 -0.066 -12.830) 17.306 3.169 ( 1.511 -8.180 0.251) 8.322 3.324 ( -2.795 -1.375 4.252) 5.271 3.949 ( 5.216 -0.772 7.120) 8.860 4.309 ( -2.499 2.395 0.088) 3.463 5.396 ( 6.911 2.539 -2.449) 7.760 6.607 ( -1.004 -1.543 -4.837) 5.175 6.677 ( -1.616 5.228 4.315) 6.969 6.915 ( 1.574 -1.178 -1.101) 2.254 7.879 ( -2.143 -0.380 -5.332) 5.759 8.169 ( 5.951 1.830 -2.969) 6.898 8.186 ( 1.853 -0.900 1.072) 2.322 8.422 ( -6.206 -2.847 5.035) 8.484 9.594 ( -0.204 5.266 4.059) 6.652 9.759 ( -0.550 -5.842 -1.210) 5.991 16.301 ( -3.376 0.190 -3.843) 5.119 16.405 ( 5.332 -1.204 3.842) 6.682 16.704 ( 1.574 2.842 -2.970) 4.401 17.134 ( -4.030 -4.674 7.605) 9.794 17.601 ( -2.692 1.048 -0.252) 2.900 18.266 ( 7.944 3.159 -6.311) 10.626 ======================= Grid point 207 (108/294) ======================= q-point: (-0.17 0.33 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.390 ( -7.605 13.909 13.426) 20.774 1.790 ( 7.777 -0.080 -4.531) 9.001 1.976 ( 7.271 2.827 0.786) 7.841 2.603 ( -13.352 1.535 -9.439) 16.424 3.019 ( -8.550 -12.232 4.952) 15.724 3.372 ( 9.805 -2.835 -0.625) 10.226 4.097 ( 7.331 0.153 4.469) 8.587 4.271 ( -1.325 -0.767 -4.512) 4.765 5.516 ( 4.869 3.756 -0.125) 6.151 6.517 ( -4.300 -1.922 -2.614) 5.387 6.770 ( 0.819 8.735 4.167) 9.713 6.926 ( 1.652 -0.385 -1.005) 1.972 7.767 ( -6.699 0.915 -6.380) 9.296 8.152 ( -0.738 -2.919 -0.604) 3.071 8.253 ( -4.680 4.515 0.191) 6.505 8.415 ( 7.715 -3.891 5.299) 10.136 9.647 ( 0.074 -3.435 -0.250) 3.445 9.710 ( 2.642 -0.400 0.742) 2.774 16.228 ( -3.884 1.956 -2.744) 5.142 16.478 ( 0.766 -1.698 5.462) 5.771 16.762 ( 5.265 2.641 -3.827) 7.024 17.098 ( -0.497 -3.975 7.149) 8.195 17.529 ( -2.137 -4.957 -4.663) 7.133 18.402 ( 5.085 8.485 -2.904) 10.310 ======================= Grid point 208 (109/294) ======================= q-point: (-0.08 0.33 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.512 ( -6.422 17.830 15.426) 24.436 1.850 ( 1.433 -3.982 1.985) 4.675 1.964 ( -12.744 4.971 -8.767) 16.248 2.507 ( 4.783 1.554 0.604) 5.066 2.790 ( -6.094 -10.783 2.283) 12.594 3.542 ( 14.188 -3.450 -1.178) 14.649 4.188 ( 1.801 -2.969 -2.499) 4.278 4.231 ( 3.238 -1.550 -2.728) 4.509 5.617 ( 2.736 4.231 -0.297) 5.047 6.414 ( -4.200 -1.994 -1.486) 4.881 6.857 ( -2.376 4.720 2.517) 5.853 6.993 ( 4.338 5.808 2.396) 7.635 7.632 ( -7.116 2.629 -5.429) 9.329 8.095 ( -3.339 -2.838 2.471) 5.031 8.182 ( -7.057 1.504 2.795) 7.738 8.573 ( 10.622 -1.222 0.880) 10.728 9.570 ( 1.222 -7.394 -5.906) 9.542 9.800 ( 4.246 1.187 2.648) 5.143 16.180 ( -3.587 3.745 -2.404) 5.716 16.467 ( -3.658 -0.975 5.461) 6.645 16.865 ( 6.366 1.204 -2.579) 6.973 17.126 ( 3.318 -4.246 7.702) 9.400 17.388 ( -2.434 -8.768 -7.927) 12.068 18.552 ( 3.548 11.065 -1.436) 11.708 ======================= Grid point 211 (110/294) ======================= q-point: ( 0.17 0.42 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.358 ( -16.634 2.930 -1.381) 16.947 1.452 ( -18.209 -10.072 17.910) 27.455 2.044 ( 6.217 0.757 -0.788) 6.313 2.927 ( 6.796 16.645 5.764) 18.881 3.162 ( 6.583 2.498 3.434) 7.834 3.474 ( 6.887 -10.917 -13.219) 18.476 3.921 ( 0.727 -3.144 -6.358) 7.130 4.229 ( 2.746 -3.348 3.681) 5.683 5.583 ( -2.213 -3.708 -4.811) 6.465 6.410 ( 0.633 3.707 2.634) 4.592 6.794 ( -5.170 0.439 0.784) 5.248 7.159 ( -2.354 -3.826 -0.976) 4.597 7.677 ( -2.344 2.044 4.822) 5.738 7.991 ( -5.187 -0.141 -0.379) 5.203 8.202 ( -1.181 2.606 1.298) 3.142 8.777 ( 5.367 -2.760 2.470) 6.521 9.283 ( 7.200 -0.049 -8.533) 11.165 9.875 ( 0.138 -0.928 -0.065) 0.941 16.173 ( -4.260 2.415 0.263) 4.904 16.431 ( -1.098 0.175 1.380) 1.772 16.872 ( -2.109 -2.579 -1.584) 3.689 17.007 ( 2.591 4.832 -4.000) 6.786 17.345 ( 5.936 -4.619 8.918) 11.666 18.766 ( -0.904 -3.221 -6.974) 7.735 ======================= Grid point 212 (111/294) ======================= q-point: ( 0.25 0.42 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.124 ( -15.549 -1.233 12.396) 19.924 1.265 ( -7.765 -2.149 13.983) 16.138 2.127 ( 4.251 -1.340 -1.939) 4.861 3.151 ( -0.509 -2.067 -7.684) 7.973 3.258 ( 1.975 14.072 12.042) 18.626 3.431 ( 9.615 -9.647 -14.196) 19.673 3.906 ( 4.234 1.175 -4.138) 6.036 4.246 ( -0.458 -1.341 1.661) 2.183 5.474 ( -1.923 -7.634 -2.983) 8.419 6.462 ( -0.255 2.620 1.617) 3.089 6.725 ( -4.374 1.076 2.383) 5.096 7.078 ( -1.487 -6.358 1.319) 6.662 7.668 ( -3.618 0.456 3.877) 5.322 7.918 ( -3.004 0.692 -0.532) 3.129 8.187 ( -0.423 -1.771 -3.947) 4.346 8.842 ( 2.488 -0.988 4.429) 5.175 9.390 ( 8.054 4.306 -5.813) 10.826 9.862 ( -0.734 -0.074 -1.169) 1.382 16.129 ( -3.366 0.443 1.523) 3.721 16.465 ( 2.390 3.320 1.263) 4.281 16.796 ( -2.472 -2.792 -2.750) 4.633 17.096 ( 3.780 6.828 -3.065) 8.385 17.431 ( 3.580 -3.243 6.676) 8.240 18.626 ( -3.901 -9.824 -6.165) 12.237 ======================= Grid point 213 (112/294) ======================= q-point: ( 0.33 0.42 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.038 ( -5.064 3.702 13.650) 15.022 1.304 ( 2.833 -1.139 15.975) 16.264 2.110 ( -0.849 -5.314 -3.749) 6.558 2.950 ( -8.355 -8.801 -7.839) 14.446 3.343 ( 3.393 -4.849 -8.479) 10.341 3.591 ( 6.448 14.077 7.292) 17.115 4.018 ( 7.728 4.047 -4.176) 9.672 4.207 ( -3.669 0.707 -1.495) 4.025 5.337 ( -2.399 -11.167 -1.669) 11.543 6.453 ( -2.189 -0.990 1.180) 2.677 6.724 ( -0.253 2.241 3.970) 4.566 7.011 ( -0.405 -6.559 1.930) 6.849 7.615 ( -4.899 -0.512 3.651) 6.131 7.908 ( 0.657 1.712 -1.449) 2.337 8.124 ( -0.052 -3.600 -5.657) 6.706 8.890 ( 0.352 0.314 4.939) 4.962 9.539 ( 6.875 5.970 -2.843) 9.539 9.835 ( -1.725 0.913 -2.541) 3.204 16.091 ( -2.424 -0.670 2.189) 3.334 16.575 ( 4.556 5.642 0.569) 7.275 16.712 ( -1.970 -3.172 -3.493) 5.113 17.211 ( 4.146 6.523 -2.181) 8.031 17.479 ( 1.673 -1.251 2.852) 3.535 18.399 ( -6.112 -14.247 -3.014) 15.792 ======================= Grid point 214 (113/294) ======================= q-point: ( 0.42 0.42 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.157 ( 4.693 5.871 8.067) 11.026 1.468 ( 6.785 -2.561 13.044) 14.925 1.973 ( -5.354 -6.662 -3.456) 9.219 2.692 ( -6.915 -8.431 -4.185) 11.680 3.299 ( 4.005 -6.376 -9.872) 12.416 3.844 ( -1.935 16.916 12.023) 20.843 4.094 ( -3.015 2.598 -3.674) 5.416 4.197 ( 6.889 3.715 -6.357) 10.083 5.171 ( -2.252 -13.299 -1.769) 13.604 6.421 ( -0.368 -2.477 2.983) 3.895 6.768 ( 0.961 0.032 2.698) 2.864 6.965 ( -0.044 -4.221 1.171) 4.380 7.565 ( -2.740 -0.299 3.385) 4.366 7.939 ( 2.112 1.600 -1.824) 3.217 8.069 ( 1.080 -3.352 -4.177) 5.464 8.910 ( -1.522 0.591 3.518) 3.878 9.679 ( 4.287 5.588 -0.171) 7.045 9.793 ( -2.771 1.899 -3.691) 4.990 16.064 ( -1.386 -0.873 2.132) 2.689 16.635 ( 0.254 -4.446 -4.818) 6.561 16.702 ( 1.895 7.656 0.418) 7.898 17.315 ( 2.689 4.283 0.163) 5.060 17.510 ( 2.274 1.112 -0.943) 2.702 18.147 ( -5.856 -15.474 0.019) 16.545 ======================= Grid point 215 (114/294) ======================= q-point: ( 0.50 0.42 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.337 ( 7.969 1.621 2.106) 8.401 1.550 ( 0.917 -4.675 2.595) 5.425 1.810 ( -6.834 -2.825 -0.562) 7.416 2.596 ( 4.030 -5.122 5.819) 8.737 3.226 ( 1.562 -6.726 -9.858) 12.035 3.887 ( -12.698 10.744 -0.933) 16.660 4.099 ( -1.562 6.104 6.221) 8.855 4.332 ( 6.263 4.786 -2.417) 8.245 5.016 ( 1.145 -12.214 -4.333) 13.011 6.437 ( 2.468 -2.708 4.713) 5.970 6.773 ( 0.180 -2.202 -0.093) 2.211 6.942 ( -0.364 -1.426 0.324) 1.507 7.570 ( 1.284 0.370 2.574) 2.901 7.979 ( 2.469 0.971 -1.718) 3.160 8.050 ( 2.197 -3.253 -1.211) 4.108 8.888 ( -3.677 0.680 1.076) 3.891 9.737 ( -5.048 5.223 -2.206) 7.591 9.779 ( 3.092 1.287 -0.040) 3.349 16.060 ( 0.360 -0.293 1.552) 1.619 16.578 ( 0.614 -4.027 -3.644) 5.465 16.763 ( -2.453 6.579 -2.029) 7.309 17.374 ( -0.289 1.050 4.731) 4.854 17.585 ( 5.313 3.996 -1.929) 6.923 17.933 ( -3.047 -13.620 -0.847) 13.982 ======================= Grid point 216 (115/294) ======================= q-point: ( 0.58 0.42 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.433 ( 3.109 -4.460 -0.333) 5.447 1.500 ( 1.991 -3.524 -2.902) 4.980 1.706 ( -6.115 3.101 1.505) 7.019 2.762 ( 12.075 -2.698 10.835) 16.447 3.117 ( -0.221 -6.010 -8.883) 10.727 3.730 ( -13.071 8.437 -7.873) 17.436 4.128 ( -5.205 1.062 8.314) 9.866 4.419 ( -1.543 2.779 4.043) 5.143 4.975 ( 8.644 -4.555 -7.274) 12.182 6.494 ( 3.717 -2.376 4.596) 6.371 6.751 ( -0.191 -0.546 -1.341) 1.460 6.918 ( -1.048 -1.336 -0.642) 1.816 7.640 ( 5.074 0.968 0.946) 5.251 8.016 ( 2.328 0.388 -1.399) 2.744 8.061 ( 2.847 -3.804 1.859) 5.102 8.815 ( -6.148 1.049 -1.308) 6.372 9.692 ( -4.619 5.216 -1.900) 7.222 9.815 ( 0.536 -1.208 1.132) 1.740 16.093 ( 2.777 0.537 0.852) 2.954 16.530 ( -0.546 -3.121 -2.531) 4.055 16.737 ( -4.501 4.835 -2.542) 7.078 17.374 ( -3.162 -3.519 8.264) 9.523 17.723 ( -0.029 9.047 3.137) 9.576 17.798 ( 7.205 -11.046 -8.134) 15.494 ======================= Grid point 217 (116/294) ======================= q-point: ( 0.67 0.42 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.403 ( 1.463 -2.638 -1.834) 3.530 1.543 ( 5.830 -1.984 -0.661) 6.194 1.682 ( -3.834 5.960 3.259) 7.800 2.919 ( 4.508 -7.639 -2.189) 9.136 3.088 ( 5.870 0.306 2.857) 6.535 3.551 ( -11.382 7.430 -8.923) 16.260 4.045 ( -8.171 -5.251 10.212) 14.093 4.395 ( -2.946 -0.588 -0.020) 3.004 5.107 ( 10.690 3.221 -3.806) 11.796 6.554 ( 2.975 -0.663 1.605) 3.445 6.753 ( -0.590 2.258 1.297) 2.671 6.878 ( -0.482 -2.192 -1.921) 2.954 7.752 ( 6.921 1.337 -1.253) 7.160 8.047 ( 1.966 0.120 -0.609) 2.062 8.088 ( 3.164 -4.513 3.737) 6.658 8.698 ( -8.188 1.664 -2.419) 8.698 9.668 ( -3.504 5.288 -0.231) 6.348 9.786 ( -0.983 -4.857 0.354) 4.968 16.169 ( 5.177 1.025 0.381) 5.291 16.463 ( -3.454 -1.597 -1.505) 4.092 16.710 ( -2.029 3.790 -1.630) 4.598 17.304 ( -5.330 -6.149 8.371) 11.675 17.669 ( -0.824 -4.621 -5.594) 7.302 17.963 ( 9.534 7.724 -0.125) 12.271 ======================= Grid point 218 (117/294) ======================= q-point: (-0.25 0.42 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.429 ( 5.049 0.427 -4.381) 6.699 1.629 ( 4.085 1.312 2.325) 4.880 1.742 ( 1.106 7.208 4.854) 8.760 2.861 ( 0.711 -5.012 -4.666) 6.885 3.143 ( -3.040 -0.304 -2.762) 4.119 3.431 ( -6.239 1.446 0.983) 6.480 3.947 ( -2.526 -4.225 9.069) 10.319 4.325 ( -1.718 -3.221 -5.244) 6.390 5.299 ( 8.556 5.429 -0.292) 10.137 6.593 ( 0.648 1.200 -0.942) 1.657 6.775 ( -1.902 4.159 3.434) 5.719 6.861 ( 2.385 -1.459 -1.980) 3.426 7.847 ( 3.515 1.517 -3.141) 4.952 8.084 ( 3.439 -0.163 -1.835) 3.902 8.125 ( 3.706 -4.236 5.963) 8.200 8.563 ( -8.730 2.003 -1.427) 9.070 9.676 ( -1.794 4.342 1.620) 4.969 9.701 ( -1.504 -7.678 -1.531) 7.972 16.276 ( 5.749 1.175 -0.248) 5.873 16.388 ( -3.242 -0.383 0.376) 3.286 16.718 ( -0.572 3.884 -1.539) 4.217 17.201 ( -5.051 -5.975 6.558) 10.209 17.572 ( -0.179 -6.998 -7.035) 9.924 18.197 ( 7.230 11.035 1.896) 13.328 ======================= Grid point 219 (118/294) ======================= q-point: (-0.17 0.42 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.530 ( 8.028 4.305 -4.326) 10.084 1.704 ( 0.852 3.477 0.873) 3.684 1.904 ( 6.812 6.030 4.256) 10.044 2.769 ( -9.165 2.422 -3.730) 10.187 3.042 ( -3.120 -5.201 0.335) 6.075 3.318 ( -5.532 -5.462 5.431) 9.483 4.013 ( 5.903 0.300 4.767) 7.594 4.217 ( -1.076 -6.116 -8.724) 10.709 5.473 ( 6.117 5.492 0.892) 8.269 6.559 ( -3.757 -1.303 -1.264) 4.173 6.852 ( 2.579 8.328 1.841) 8.910 6.889 ( 1.567 0.402 0.165) 1.626 7.841 ( -3.761 2.301 -3.124) 5.404 8.107 ( 1.966 -2.744 -0.484) 3.410 8.232 ( 8.447 -0.856 3.175) 9.065 8.443 ( -7.868 1.559 1.229) 8.115 9.575 ( -1.355 -10.108 -3.198) 10.688 9.717 ( 0.474 3.552 2.178) 4.193 16.298 ( -3.126 2.828 -1.866) 4.610 16.430 ( 5.820 -1.116 4.120) 7.218 16.738 ( -0.177 4.276 -2.799) 5.114 17.118 ( -2.501 -5.220 5.360) 7.889 17.446 ( -0.976 -9.072 -7.237) 11.646 18.418 ( 4.998 12.064 1.954) 13.204 ======================= Grid point 220 (119/294) ======================= q-point: (-0.08 0.42 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.713 ( 9.551 5.891 -1.427) 11.312 1.741 ( 0.876 2.568 -1.057) 2.912 2.057 ( 1.595 5.585 -3.941) 7.019 2.617 ( -10.399 7.017 2.965) 12.891 2.875 ( -11.357 -11.037 9.426) 18.429 3.336 ( 8.343 -1.808 2.515) 8.899 4.077 ( 0.382 -8.153 -10.107) 12.991 4.140 ( 5.504 -0.450 1.089) 5.629 5.608 ( 3.767 5.234 0.049) 6.449 6.460 ( -4.555 -2.505 -1.146) 5.324 6.907 ( 0.061 0.447 0.198) 0.493 7.014 ( 4.201 10.215 1.797) 11.190 7.760 ( -7.230 4.021 -1.993) 8.510 8.099 ( 0.171 -2.312 0.500) 2.371 8.347 ( -7.641 1.832 3.215) 8.490 8.392 ( 10.239 -1.388 1.683) 10.468 9.438 ( 0.029 -10.549 -5.576) 11.932 9.778 ( 2.045 1.862 2.363) 3.638 16.268 ( -3.537 4.527 -1.534) 5.946 16.512 ( 1.427 -1.492 5.183) 5.579 16.777 ( 3.355 3.589 -3.603) 6.093 17.090 ( 1.084 -4.851 5.405) 7.343 17.288 ( -2.167 -9.842 -6.989) 12.264 18.603 ( 3.188 11.274 0.426) 11.724 ======================= Grid point 223 (120/294) ======================= q-point: ( 0.17 0.50 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.594 ( -10.627 -0.560 -2.318) 10.891 1.721 ( -14.981 -6.186 8.213) 18.170 1.954 ( 3.861 0.442 1.723) 4.251 2.877 ( 12.273 10.611 -6.630) 17.527 3.186 ( 1.629 1.485 8.975) 9.242 3.224 ( 4.020 -9.283 -8.582) 13.265 3.878 ( 0.387 2.909 -0.064) 2.935 4.170 ( 3.163 -3.935 5.331) 7.342 5.568 ( -3.623 -2.474 -7.380) 8.585 6.448 ( 1.129 3.634 3.034) 4.867 6.871 ( -3.511 -0.087 0.743) 3.590 7.145 ( -1.830 -3.294 -4.881) 6.167 7.775 ( -4.143 2.402 3.079) 5.693 8.066 ( -3.292 0.753 -0.637) 3.436 8.180 ( -0.424 -6.002 -3.138) 6.786 8.707 ( 5.944 0.334 3.092) 6.709 9.174 ( 3.608 4.436 -0.856) 5.782 9.855 ( 0.994 -1.686 0.638) 2.058 16.279 ( -5.491 2.352 0.178) 5.976 16.429 ( -0.113 -1.508 -2.555) 2.969 16.865 ( -0.580 -0.973 -2.662) 2.893 17.030 ( -0.085 5.333 1.309) 5.492 17.243 ( 7.428 -4.560 10.348) 13.530 18.711 ( -1.880 -3.130 -9.779) 10.438 ======================= Grid point 224 (121/294) ======================= q-point: ( 0.25 0.50 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.402 ( -12.215 1.231 2.903) 12.615 1.481 ( -13.075 -6.320 13.220) 19.639 2.036 ( 4.162 -0.677 0.211) 4.222 3.041 ( 2.990 -8.403 -10.373) 13.680 3.141 ( 9.876 2.028 -10.451) 14.521 3.363 ( 4.684 6.336 5.254) 9.470 3.887 ( -0.624 3.316 2.309) 4.088 4.235 ( 2.482 -1.456 6.236) 6.868 5.434 ( -3.608 -5.236 -5.793) 8.601 6.506 ( -0.420 3.181 1.531) 3.555 6.812 ( -4.062 0.248 1.347) 4.286 7.044 ( -1.768 -6.382 -2.113) 6.951 7.751 ( -3.216 1.383 2.595) 4.357 7.991 ( -5.523 -0.019 0.427) 5.540 8.109 ( 1.256 -5.196 -6.095) 8.107 8.814 ( 4.775 -0.310 3.251) 5.785 9.309 ( 5.542 8.231 -0.370) 9.929 9.854 ( 0.515 -1.369 0.095) 1.466 16.208 ( -4.811 0.391 0.879) 4.906 16.433 ( 2.738 0.923 -2.550) 3.853 16.810 ( -2.486 -1.585 -2.136) 3.640 17.116 ( 1.710 7.495 1.317) 7.799 17.366 ( 5.256 -3.914 9.455) 11.504 18.553 ( -3.577 -8.079 -10.402) 13.648 ======================= Grid point 225 (122/294) ======================= q-point: ( 0.33 0.50 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.271 ( -9.933 2.476 9.947) 14.274 1.377 ( -3.590 -2.231 12.504) 13.199 2.047 ( 0.670 -4.545 -2.219) 5.102 2.922 ( -1.928 -8.400 -7.832) 11.646 3.132 ( 2.439 -6.369 -9.746) 11.896 3.614 ( 12.594 12.851 -3.534) 18.337 3.978 ( 2.537 5.043 7.068) 9.046 4.270 ( -1.939 1.367 3.838) 4.512 5.281 ( -4.017 -8.723 -3.416) 10.192 6.492 ( -3.141 -0.712 0.068) 3.221 6.781 ( -1.970 1.455 2.525) 3.517 6.962 ( -0.053 -5.995 -0.102) 5.996 7.712 ( -4.631 -0.498 3.662) 5.925 7.922 ( -2.182 0.732 -1.814) 2.931 8.051 ( 0.464 -3.175 -4.784) 5.761 8.892 ( 3.024 -0.469 2.785) 4.138 9.484 ( 6.034 8.433 -0.643) 10.389 9.848 ( -0.181 -0.234 -0.402) 0.499 16.146 ( -3.576 -0.674 1.745) 4.036 16.493 ( 5.099 1.006 -4.351) 6.778 16.749 ( -2.471 0.787 -1.051) 2.798 17.229 ( 1.943 7.178 2.633) 7.888 17.445 ( 2.698 -2.952 6.366) 7.518 18.333 ( -4.906 -11.642 -8.586) 15.275 ======================= Grid point 226 (123/294) ======================= q-point: ( 0.42 0.50 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.246 ( -3.736 3.459 8.159) 9.617 1.440 ( 3.101 -1.496 12.376) 12.846 1.965 ( -2.157 -5.511 -2.598) 6.463 2.709 ( -7.988 -8.001 -5.478) 12.563 3.098 ( 5.587 -4.942 -7.680) 10.706 3.925 ( 14.398 11.823 -7.287) 20.005 4.102 ( 1.467 3.827 6.381) 7.584 4.248 ( -6.579 5.932 2.680) 9.255 5.098 ( -4.606 -12.407 -0.934) 13.267 6.425 ( -2.105 -3.331 1.441) 4.195 6.781 ( -0.948 -0.264 1.604) 1.882 6.932 ( 0.949 -2.408 0.541) 2.644 7.642 ( -4.870 -1.499 4.036) 6.501 7.914 ( 1.186 1.488 -3.047) 3.593 8.013 ( 0.136 -1.623 -1.975) 2.560 8.934 ( 0.997 -0.418 1.585) 1.919 9.639 ( 5.028 5.753 -1.630) 7.813 9.842 ( -1.175 1.820 -0.359) 2.196 16.099 ( -2.454 -1.236 2.237) 3.543 16.529 ( 3.060 -2.000 -5.748) 6.812 16.764 ( 0.949 6.212 -0.597) 6.313 17.337 ( 1.157 5.320 4.717) 7.204 17.477 ( 1.423 -2.154 2.661) 3.708 18.093 ( -5.027 -12.463 -5.492) 14.517 ======================= Grid point 227 (124/294) ======================= q-point: ( 0.50 0.50 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.281 ( 1.356 -0.089 3.643) 3.888 1.527 ( 0.918 -2.828 6.985) 7.591 1.872 ( -3.092 -2.065 -1.267) 3.928 2.541 ( -0.778 -5.195 1.218) 5.393 3.095 ( 2.447 -2.864 -5.560) 6.716 4.090 ( -5.540 3.988 -7.134) 9.874 4.187 ( 8.262 3.120 -6.427) 10.923 4.292 ( -0.453 13.986 9.817) 17.094 4.899 ( -3.655 -14.450 1.147) 14.949 6.398 ( 1.195 -3.810 3.912) 5.590 6.761 ( -0.694 -1.347 -0.202) 1.529 6.937 ( 0.291 -0.318 0.148) 0.455 7.591 ( -2.114 -0.971 2.985) 3.784 7.941 ( 2.191 1.164 -2.142) 3.278 8.002 ( 0.587 -1.110 0.694) 1.434 8.933 ( -1.161 -0.183 -0.322) 1.219 9.724 ( 2.626 1.865 -3.157) 4.510 9.844 ( -1.818 3.714 0.509) 4.167 16.071 ( -1.077 -1.044 2.116) 2.593 16.514 ( 1.167 -1.638 -3.241) 3.814 16.840 ( 0.212 7.236 -3.442) 8.016 17.410 ( -0.203 1.865 5.495) 5.807 17.504 ( 3.671 -2.728 2.184) 5.068 17.891 ( -3.889 -8.129 -3.502) 9.668 ======================= Grid point 228 (125/294) ======================= q-point: ( 0.58 0.50 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.333 ( 4.516 -2.028 2.451) 5.524 1.466 ( -4.020 -6.794 -0.144) 7.896 1.818 ( -2.950 2.312 -0.648) 3.804 2.624 ( 9.327 -0.731 8.053) 12.345 3.054 ( -1.488 -1.061 -3.869) 4.279 3.941 ( -10.631 5.520 -10.726) 16.079 4.233 ( -1.249 0.088 2.566) 2.855 4.471 ( 0.792 3.868 1.006) 4.075 4.785 ( 4.709 -5.498 1.933) 7.492 6.434 ( 3.618 -3.144 5.353) 7.185 6.743 ( 0.096 -0.015 -1.285) 1.289 6.925 ( -1.188 -0.631 -0.568) 1.460 7.596 ( 1.734 0.053 1.410) 2.236 7.975 ( 2.061 0.412 -0.981) 2.319 8.018 ( 1.305 -1.351 3.212) 3.721 8.889 ( -3.345 0.373 -2.601) 4.253 9.739 ( 0.218 1.222 -2.921) 3.174 9.840 ( -2.430 1.299 0.182) 2.761 16.073 ( 0.856 -0.244 1.579) 1.813 16.508 ( 0.219 0.072 -0.418) 0.477 16.839 ( -4.064 4.661 -4.717) 7.778 17.428 ( -1.808 -3.360 7.837) 8.716 17.548 ( 5.956 -7.493 -3.031) 10.040 17.818 ( -0.195 5.149 0.287) 5.160 ======================= Grid point 229 (126/294) ======================= q-point: (-0.33 -0.50 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.333 ( -1.141 -6.917 -3.406) 7.794 1.422 ( 6.650 -3.232 3.788) 8.308 1.811 ( -2.259 5.937 -0.149) 6.354 2.820 ( 5.563 -0.142 6.064) 8.230 3.027 ( 1.947 2.336 0.329) 3.059 3.742 ( -11.300 5.399 -12.466) 17.670 4.183 ( -6.798 -4.308 8.644) 11.811 4.386 ( -2.464 -7.917 -4.552) 9.459 4.971 ( 10.596 7.463 1.895) 13.098 6.507 ( 3.976 -1.019 4.463) 6.064 6.757 ( 1.918 1.023 -1.101) 2.437 6.882 ( -2.434 -0.832 -0.635) 2.649 7.662 ( 4.981 1.067 0.162) 5.097 8.002 ( 1.993 -0.850 -0.433) 2.210 8.053 ( 1.392 -1.426 5.330) 5.691 8.804 ( -5.314 1.338 -4.496) 7.089 9.732 ( -0.691 0.351 -1.046) 1.302 9.785 ( -3.604 -1.472 -1.212) 4.077 16.114 ( 3.101 0.523 0.990) 3.297 16.503 ( -2.272 1.089 0.829) 2.653 16.778 ( -3.506 2.675 -3.150) 5.420 17.368 ( -4.445 -7.282 7.188) 11.156 17.516 ( 3.522 -7.065 -7.766) 11.074 17.975 ( 5.559 12.090 4.501) 14.047 ======================= Grid point 230 (127/294) ======================= q-point: (-0.25 -0.50 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.277 ( 5.091 -4.857 -6.793) 9.780 1.542 ( 8.178 -2.457 5.992) 10.432 1.848 ( -1.379 7.561 -1.090) 7.763 2.854 ( -2.125 2.679 4.807) 5.900 3.142 ( 3.103 1.926 0.416) 3.676 3.555 ( -8.125 3.064 -8.571) 12.201 4.046 ( -8.364 -7.375 11.136) 15.759 4.254 ( -0.891 -6.472 -8.740) 10.912 5.220 ( 9.149 7.816 1.939) 12.188 6.585 ( 2.475 1.002 2.313) 3.533 6.790 ( 2.551 -1.513 -3.414) 4.522 6.853 ( -1.184 3.332 2.547) 4.358 7.771 ( 6.234 1.947 0.103) 6.532 8.021 ( 2.314 -1.783 -0.378) 2.945 8.093 ( 1.010 -1.587 6.235) 6.513 8.695 ( -6.594 2.500 -5.176) 8.748 9.654 ( -3.351 -8.474 -0.472) 9.125 9.746 ( -1.616 3.810 -1.032) 4.265 16.193 ( 5.175 0.795 0.644) 5.275 16.458 ( -4.405 0.931 0.345) 4.515 16.761 ( -0.776 3.304 -0.822) 3.492 17.250 ( -4.660 -6.520 1.889) 8.234 17.448 ( 0.725 -7.733 -4.151) 8.806 18.227 ( 6.518 13.388 4.437) 15.537 ======================= Grid point 231 (128/294) ======================= q-point: (-0.17 -0.50 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.337 ( 10.899 0.168 -9.641) 14.552 1.700 ( 5.857 0.865 6.155) 8.540 1.884 ( 1.947 4.008 -3.107) 5.432 2.924 ( -1.172 8.092 10.488) 13.299 3.081 ( -7.297 0.188 -6.765) 9.952 3.414 ( -7.695 -6.150 1.980) 10.048 3.982 ( 0.709 -1.612 6.477) 6.712 4.116 ( -1.974 -7.126 -9.698) 12.195 5.430 ( 6.970 6.723 1.626) 9.819 6.589 ( -2.349 -2.656 -0.050) 3.546 6.818 ( 4.111 1.903 -2.569) 5.208 6.925 ( 1.706 6.159 1.999) 6.697 7.878 ( 2.568 2.532 1.368) 3.857 8.046 ( 2.811 -1.098 -0.291) 3.032 8.133 ( 2.837 -2.595 5.367) 6.602 8.585 ( -6.688 3.408 -4.345) 8.673 9.499 ( -3.667 -10.566 -1.378) 11.269 9.760 ( -0.592 3.140 0.490) 3.233 16.297 ( 5.564 0.875 0.330) 5.642 16.408 ( -2.392 1.238 0.964) 2.861 16.784 ( -0.908 4.424 -0.821) 4.590 17.129 ( -3.146 -5.636 -1.006) 6.532 17.347 ( -1.528 -8.862 -1.289) 9.085 18.470 ( 5.133 12.760 2.944) 14.065 ======================= Grid point 232 (129/294) ======================= q-point: (-0.08 0.50 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.512 ( 13.683 4.147 -9.410) 17.117 1.757 ( -0.508 2.875 -1.752) 3.405 2.002 ( 7.744 2.293 -0.295) 8.081 2.890 ( -11.380 2.994 -0.108) 11.768 3.036 ( -7.709 0.480 11.658) 13.985 3.259 ( 0.573 -4.277 4.775) 6.436 3.942 ( -2.676 -9.002 -10.459) 14.057 4.066 ( 4.765 1.074 2.007) 5.280 5.592 ( 4.747 5.842 0.312) 7.534 6.494 ( -3.963 -4.049 -0.945) 5.744 6.889 ( 2.743 1.103 -0.038) 2.957 7.040 ( 3.660 8.505 -2.032) 9.480 7.899 ( -3.907 3.049 2.122) 5.391 8.075 ( 0.644 -0.074 1.241) 1.400 8.222 ( 8.193 -3.870 3.513) 9.718 8.498 ( -5.633 4.175 -2.814) 7.555 9.332 ( -2.934 -10.588 -1.938) 11.157 9.789 ( 0.417 1.897 1.252) 2.311 16.346 ( -1.315 3.200 -0.573) 3.507 16.456 ( 5.283 -0.378 2.681) 5.936 16.796 ( -1.761 5.060 -2.712) 6.005 17.043 ( 0.190 -5.689 -0.963) 5.773 17.223 ( -3.138 -8.539 0.933) 9.145 18.657 ( 3.073 10.427 0.242) 10.873 ======================= Grid point 236 (130/294) ======================= q-point: ( 0.17 0.58 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.649 ( -0.468 -0.772 -2.610) 2.762 1.889 ( -6.061 -6.025 -0.019) 8.547 1.983 ( -5.411 4.277 -1.111) 6.986 2.725 ( 10.392 4.810 -4.940) 12.471 3.022 ( 3.250 -11.170 -2.963) 12.004 3.228 ( -0.311 0.457 6.312) 6.336 3.971 ( -2.318 8.228 5.000) 9.904 4.125 ( 2.208 -1.978 4.948) 5.768 5.564 ( -4.003 -1.826 -8.793) 9.832 6.471 ( 2.215 2.899 3.452) 5.022 6.916 ( -1.858 -0.600 0.883) 2.143 7.091 ( -0.197 -3.363 -8.956) 9.569 7.881 ( -4.686 1.965 0.251) 5.087 8.018 ( 3.486 -4.168 -4.726) 7.201 8.207 ( -6.477 -0.680 2.514) 6.981 8.578 ( 8.788 -2.685 -0.987) 9.242 9.250 ( -1.826 8.630 7.083) 11.313 9.821 ( 1.019 -2.404 0.482) 2.655 16.376 ( -3.068 -1.294 -4.179) 5.344 16.394 ( -1.139 -0.060 0.354) 1.194 16.857 ( -0.745 1.528 -3.727) 4.096 17.053 ( 3.067 -3.289 5.261) 6.921 17.202 ( 2.926 5.320 10.006) 11.704 18.656 ( -2.871 -3.677 -11.313) 12.237 ======================= Grid point 237 (131/294) ======================= q-point: ( 0.25 0.58 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.573 ( -6.720 0.162 0.090) 6.722 1.674 ( -10.596 -6.999 5.003) 13.649 1.985 ( 1.645 -1.373 -0.747) 2.269 2.856 ( 1.072 -6.954 -7.059) 9.967 2.984 ( 10.107 7.026 -6.468) 13.905 3.335 ( 4.147 0.755 3.323) 5.368 3.966 ( -2.315 0.726 4.126) 4.786 4.234 ( 2.981 2.796 8.784) 9.688 5.421 ( -4.446 -3.150 -8.067) 9.735 6.544 ( 0.639 2.977 1.751) 3.512 6.875 ( -2.971 -0.333 0.793) 3.093 6.984 ( -1.051 -6.772 -5.661) 8.889 7.828 ( -3.594 2.578 -1.922) 4.823 8.010 ( 2.053 -3.334 -3.032) 4.952 8.101 ( -7.141 -0.442 2.605) 7.615 8.693 ( 8.721 -2.562 -0.595) 9.109 9.368 ( 0.589 10.105 5.242) 11.399 9.820 ( 1.500 -2.772 0.455) 3.185 16.289 ( -4.419 -0.336 -1.427) 4.656 16.386 ( 1.070 -0.250 -1.602) 1.942 16.817 ( -1.853 -0.454 -3.129) 3.665 17.134 ( 4.739 -0.035 4.904) 6.820 17.353 ( 2.102 4.817 10.066) 11.355 18.476 ( -4.192 -7.101 -12.596) 15.055 ======================= Grid point 238 (132/294) ======================= q-point: ( 0.33 0.58 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.460 ( -7.144 0.634 1.948) 7.432 1.527 ( -7.536 -2.660 11.249) 13.799 1.958 ( 1.865 -7.326 -4.590) 8.844 2.801 ( 2.045 -2.508 -2.974) 4.395 3.071 ( -1.917 -1.222 -6.612) 6.992 3.458 ( 11.172 7.055 -7.132) 15.015 4.021 ( 2.985 0.142 9.644) 10.096 4.339 ( 0.505 3.602 6.749) 7.666 5.265 ( -5.224 -4.904 -5.947) 9.312 6.539 ( -3.423 -0.169 -0.957) 3.558 6.838 ( -2.304 0.753 1.324) 2.762 6.896 ( 0.819 -5.767 -1.664) 6.058 7.787 ( -3.057 1.305 -0.653) 3.388 7.962 ( -3.311 -2.406 -0.296) 4.104 8.031 ( -2.348 0.995 0.106) 2.552 8.800 ( 7.325 -2.050 -0.633) 7.633 9.506 ( 2.225 9.141 2.215) 9.665 9.826 ( 1.755 -2.093 0.671) 2.813 16.211 ( -4.255 -0.676 0.599) 4.350 16.409 ( 3.140 0.456 -3.287) 4.569 16.770 ( -1.193 0.228 -2.787) 3.040 17.249 ( 5.096 -0.122 6.461) 8.230 17.468 ( -0.476 5.321 8.014) 9.632 18.250 ( -4.951 -9.499 -12.067) 16.135 ======================= Grid point 239 (133/294) ======================= q-point: ( 0.42 0.58 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.388 ( -5.247 0.689 2.979) 6.073 1.500 ( -2.891 0.439 12.988) 13.313 1.883 ( 2.184 -7.808 -5.302) 9.688 2.738 ( -6.843 -5.341 -3.621) 9.405 2.987 ( 1.412 1.084 -3.274) 3.726 3.709 ( 15.036 7.948 -9.618) 19.539 4.128 ( 2.724 -0.344 7.522) 8.008 4.401 ( -1.261 4.542 4.593) 6.581 5.088 ( -6.811 -6.762 -2.189) 9.844 6.450 ( -4.094 -2.474 -0.499) 4.810 6.805 ( -1.922 -1.579 0.490) 2.535 6.895 ( 2.104 -0.530 0.477) 2.222 7.729 ( -4.752 -2.112 3.255) 6.135 7.907 ( -1.329 1.654 -2.185) 3.046 8.016 ( -1.136 0.811 0.535) 1.495 8.879 ( 4.862 -1.594 -0.956) 5.205 9.624 ( 2.592 6.352 -1.282) 6.979 9.847 ( 1.669 -0.588 1.113) 2.091 16.146 ( -3.403 -1.450 1.866) 4.143 16.447 ( 2.963 0.914 -3.819) 4.919 16.768 ( 1.804 2.565 -3.120) 4.423 17.363 ( 4.696 -2.567 8.746) 10.254 17.528 ( -3.899 7.118 5.132) 9.602 18.012 ( -4.230 -10.280 -10.107) 15.024 ======================= Grid point 240 (134/294) ======================= q-point: ( 0.50 0.58 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.326 ( -4.044 0.120 2.124) 4.570 1.557 ( -0.863 -0.996 10.753) 10.833 1.833 ( 2.118 -4.208 -4.592) 6.579 2.539 ( -5.091 -5.218 -1.662) 7.477 3.053 ( 1.865 4.506 0.843) 4.949 3.954 ( 13.993 5.002 -10.839) 18.393 4.162 ( -1.447 -0.038 0.672) 1.596 4.446 ( -0.160 3.544 1.552) 3.872 4.906 ( -8.122 -6.040 4.899) 11.245 6.384 ( -1.261 -2.574 2.302) 3.676 6.763 ( -1.299 -1.347 -0.652) 1.982 6.926 ( 1.134 0.318 0.211) 1.196 7.647 ( -4.235 -2.929 3.897) 6.458 7.917 ( 0.873 2.715 -1.624) 3.282 8.013 ( -0.817 0.673 1.931) 2.203 8.913 ( 2.050 -1.292 -1.990) 3.136 9.692 ( 1.889 3.580 -3.455) 5.321 9.875 ( 0.888 0.170 0.797) 1.205 16.097 ( -2.136 -1.745 2.343) 3.619 16.479 ( 1.531 1.964 -1.569) 2.944 16.829 ( 3.971 3.744 -5.428) 7.697 17.440 ( 3.126 -5.790 7.731) 10.152 17.534 ( -6.821 6.092 5.021) 10.434 17.835 ( -0.670 -5.784 -6.882) 9.015 ======================= Grid point 241 (135/294) ======================= q-point: (-0.42 -0.42 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.297 ( -0.338 -1.455 1.964) 2.467 1.498 ( -6.941 -7.113 3.782) 10.634 1.824 ( 1.896 0.300 -3.207) 3.737 2.537 ( 6.177 0.854 5.050) 8.024 3.110 ( -2.430 6.053 2.687) 7.054 4.029 ( -2.649 -0.160 -13.118) 13.384 4.167 ( 5.595 1.299 -3.867) 6.924 4.454 ( 0.641 -4.303 -3.104) 5.344 4.821 ( -4.665 3.031 12.735) 13.897 6.391 ( 2.038 -2.135 5.005) 5.811 6.732 ( -0.377 -0.464 -2.113) 2.196 6.933 ( -0.431 -0.140 -0.138) 0.474 7.597 ( -1.185 -1.856 2.763) 3.533 7.952 ( 1.121 1.679 -0.443) 2.067 8.028 ( -0.109 0.716 3.990) 4.055 8.898 ( -0.443 -0.960 -3.917) 4.057 9.722 ( 1.024 2.196 -3.341) 4.127 9.874 ( -0.991 -0.883 -0.489) 1.414 16.074 ( -0.453 -1.259 2.208) 2.582 16.522 ( 0.592 3.516 1.566) 3.894 16.864 ( 0.875 1.377 -7.330) 7.509 17.438 ( 0.194 -4.967 0.534) 5.000 17.485 ( -4.449 -1.909 5.781) 7.540 17.838 ( 3.400 4.707 0.801) 5.861 ======================= Grid point 242 (136/294) ======================= q-point: (-0.33 -0.42 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.294 ( -1.476 -6.970 -2.718) 7.625 1.312 ( -0.883 -9.188 4.975) 10.486 1.865 ( 1.174 5.772 -1.407) 6.056 2.751 ( 10.219 4.507 6.867) 13.111 3.126 ( -5.532 7.958 4.166) 10.549 3.838 ( -7.234 -1.894 -16.443) 18.063 4.215 ( 2.640 -1.590 -4.293) 5.285 4.343 ( -5.251 -8.959 2.569) 10.698 4.955 ( 4.196 9.436 8.633) 13.460 6.459 ( 4.079 -1.230 5.984) 7.346 6.719 ( 1.086 -0.353 -3.490) 3.672 6.914 ( -1.582 0.047 0.359) 1.622 7.611 ( 2.563 -0.316 1.784) 3.139 7.972 ( 0.733 -0.274 0.051) 0.784 8.071 ( 0.447 1.305 5.928) 6.087 8.840 ( -2.250 -0.300 -6.191) 6.594 9.727 ( -0.379 -0.445 -1.235) 1.366 9.823 ( -2.705 -0.748 -2.194) 3.563 16.086 ( 1.475 -0.492 1.772) 2.357 16.571 ( -1.555 4.215 2.872) 5.333 16.804 ( -1.592 -2.036 -5.755) 6.308 17.365 ( -2.205 -4.894 -3.124) 6.211 17.445 ( -1.607 -2.769 3.901) 5.046 18.011 ( 6.426 9.958 5.003) 12.864 ======================= Grid point 243 (137/294) ======================= q-point: (-0.25 -0.42 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.130 ( -0.403 -10.131 -3.558) 10.745 1.376 ( 10.311 -6.772 4.337) 13.076 1.931 ( -1.267 8.018 -0.916) 8.169 2.958 ( 3.130 5.692 5.614) 8.586 3.165 ( -2.066 9.481 4.644) 10.758 3.600 ( -5.634 -4.678 -16.443) 18.000 4.154 ( -3.681 -7.296 -3.360) 8.836 4.199 ( -6.095 -3.078 6.133) 9.178 5.181 ( 7.173 8.997 4.659) 12.414 6.554 ( 3.948 -0.603 4.701) 6.168 6.714 ( 2.203 -1.342 -4.631) 5.301 6.906 ( -0.712 2.228 1.467) 2.761 7.692 ( 5.639 0.583 2.197) 6.080 7.976 ( 1.044 -1.733 0.075) 2.024 8.127 ( -0.130 1.894 6.522) 6.793 8.754 ( -3.379 0.684 -7.842) 8.567 9.651 ( -4.629 -6.438 0.916) 7.982 9.788 ( -1.000 3.079 -2.674) 4.199 16.133 ( 3.442 -0.007 1.306) 3.681 16.547 ( -5.133 0.992 -0.397) 5.243 16.773 ( 1.502 0.123 -0.201) 1.521 17.250 ( -3.843 -2.734 -6.549) 8.071 17.404 ( -2.101 -5.681 5.277) 8.034 18.265 ( 7.386 12.506 4.717) 15.271 ======================= Grid point 244 (138/294) ======================= q-point: (-0.17 -0.42 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.091 ( 9.376 -4.699 -8.934) 13.777 1.564 ( 13.662 -3.472 7.692) 16.058 1.939 ( -4.716 5.821 -2.122) 7.786 3.035 ( -1.175 4.700 -1.001) 4.947 3.227 ( -5.970 8.509 5.655) 11.833 3.408 ( -1.313 -7.991 -9.111) 12.190 4.025 ( -3.601 -3.193 3.261) 5.813 4.095 ( -6.434 -2.846 0.218) 7.039 5.395 ( 6.803 7.434 2.633) 10.415 6.580 ( -0.547 -4.514 0.917) 4.639 6.746 ( 4.908 1.946 -3.026) 6.085 6.954 ( 1.635 4.538 0.575) 4.858 7.815 ( 6.549 -1.314 4.344) 7.968 7.988 ( 2.900 -0.830 -0.647) 3.085 8.168 ( -1.757 2.259 5.601) 6.290 8.657 ( -3.890 1.530 -8.321) 9.312 9.498 ( -6.511 -7.352 1.966) 10.015 9.796 ( -0.468 2.825 -1.186) 3.099 16.211 ( 5.296 0.059 1.033) 5.396 16.467 ( -3.336 -0.354 -1.205) 3.564 16.818 ( 1.242 2.290 1.516) 3.014 17.119 ( -4.339 -1.519 -7.833) 9.082 17.330 ( -3.408 -7.545 6.435) 10.486 18.515 ( 5.853 12.212 2.544) 13.779 ======================= Grid point 245 (139/294) ======================= q-point: (-0.08 -0.42 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.239 ( 16.197 3.052 -12.153) 20.478 1.792 ( 6.289 1.086 6.316) 8.979 1.903 ( 0.617 2.914 -0.718) 3.064 2.963 ( -2.806 -3.235 -9.331) 10.267 3.195 ( -6.707 -9.900 -1.027) 12.002 3.326 ( -3.320 9.625 11.653) 15.475 3.937 ( -8.821 -3.055 -1.338) 9.431 4.033 ( 2.289 1.590 1.989) 3.424 5.568 ( 5.275 6.054 0.721) 8.062 6.499 ( -2.705 -5.378 -0.483) 6.040 6.839 ( 4.768 1.887 -1.142) 5.253 7.036 ( 2.947 6.061 -3.599) 7.640 7.893 ( 3.948 -5.395 4.044) 7.813 8.078 ( 6.814 1.804 1.668) 7.243 8.169 ( -3.769 1.995 3.067) 5.253 8.563 ( -3.559 1.624 -7.936) 8.848 9.341 ( -6.900 -5.588 3.938) 9.713 9.809 ( -0.200 1.802 -0.138) 1.819 16.312 ( 5.942 -0.128 1.049) 6.035 16.432 ( -0.160 0.500 -0.881) 1.025 16.858 ( -0.624 3.575 0.109) 3.631 17.001 ( -3.097 -1.436 -5.683) 6.629 17.232 ( -4.126 -7.665 6.687) 10.977 18.698 ( 3.179 9.398 -0.798) 9.954 ======================= Grid point 248 (140/294) ======================= q-point: ( 0.17 -0.33 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.596 ( 5.473 4.124 -8.784) 11.141 1.837 ( 1.132 -11.161 -5.595) 12.536 2.058 ( -2.545 1.669 -8.890) 9.397 2.636 ( 3.044 5.566 2.556) 6.839 2.884 ( 5.996 -8.278 12.659) 16.271 3.319 ( -8.407 -0.342 1.812) 8.607 4.088 ( -3.378 0.079 -2.127) 3.993 4.158 ( 0.540 8.056 9.589) 12.535 5.561 ( -3.864 -1.419 -9.104) 9.991 6.470 ( 3.121 1.716 3.872) 5.261 6.924 ( 0.943 -1.412 -0.606) 1.803 6.997 ( -0.207 -2.935 -10.352) 10.762 7.894 ( 4.853 -2.400 -2.405) 5.924 7.951 ( -2.739 0.364 -2.289) 3.588 8.352 ( -7.790 1.686 3.999) 8.917 8.394 ( 8.198 -3.497 -1.214) 8.996 9.430 ( -4.025 8.188 8.534) 12.493 9.786 ( 0.068 -2.876 -0.500) 2.920 16.320 ( 0.898 -2.476 -5.537) 6.131 16.440 ( -0.290 -1.069 2.330) 2.580 16.876 ( -1.704 2.727 -4.111) 5.219 16.998 ( 0.950 -4.785 6.315) 7.980 17.305 ( 1.182 8.946 9.055) 12.784 18.608 ( -3.727 -3.695 -11.417) 12.565 ======================= Grid point 249 (141/294) ======================= q-point: ( 0.25 -0.33 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.622 ( 1.006 -0.685 -3.829) 4.017 1.702 ( -1.801 -9.460 -4.627) 10.684 1.942 ( -3.542 -3.268 -6.281) 7.917 2.820 ( 5.121 8.850 3.266) 10.734 2.906 ( -0.726 -1.135 2.150) 2.538 3.302 ( 2.545 -0.147 4.304) 5.003 4.005 ( -2.987 -3.370 1.148) 4.648 4.290 ( 1.501 5.287 7.033) 8.926 5.424 ( -4.531 -1.328 -9.000) 10.163 6.558 ( 2.271 2.316 2.658) 4.193 6.886 ( 0.350 -6.524 -7.756) 10.141 6.914 ( -1.977 -0.398 0.248) 2.032 7.885 ( -2.130 4.132 -7.589) 8.900 7.954 ( 1.731 -0.979 2.333) 3.065 8.241 ( -8.000 0.030 2.688) 8.440 8.508 ( 9.187 -3.638 0.598) 9.899 9.506 ( -1.917 8.512 6.315) 10.771 9.762 ( 1.468 -4.106 -0.218) 4.366 16.289 ( 0.716 -0.381 -5.060) 5.125 16.409 ( -3.108 -1.341 2.405) 4.153 16.833 ( -2.535 0.115 -2.902) 3.855 17.050 ( 5.562 -3.436 5.592) 8.603 17.460 ( 1.085 8.677 8.124) 11.936 18.423 ( -5.436 -5.153 -11.685) 13.880 ======================= Grid point 250 (142/294) ======================= q-point: ( 0.33 -0.33 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.546 ( -2.588 -7.813 -2.320) 8.552 1.623 ( -1.574 2.099 1.831) 3.200 1.825 ( -1.146 -8.000 -3.717) 8.896 2.841 ( -4.455 5.676 2.835) 7.752 3.031 ( 4.208 2.783 -3.509) 6.145 3.356 ( 3.475 3.003 -2.728) 5.342 3.995 ( 3.402 -4.403 8.566) 10.215 4.378 ( 1.671 1.319 3.267) 3.899 5.290 ( -5.315 -0.444 -6.578) 8.469 6.586 ( -2.423 0.876 -0.451) 2.615 6.808 ( 1.932 -5.397 -2.372) 6.204 6.883 ( -1.992 0.401 0.404) 2.072 7.844 ( -3.248 4.432 -5.568) 7.823 7.976 ( -0.023 -0.546 2.119) 2.188 8.134 ( -6.903 -0.057 3.269) 7.638 8.629 ( 9.356 -2.775 -1.076) 9.818 9.590 ( -0.520 7.313 2.988) 7.917 9.760 ( 3.019 -4.138 0.551) 5.151 16.265 ( -2.074 0.801 -2.390) 3.264 16.372 ( -0.239 -0.629 0.514) 0.847 16.775 ( -1.963 -0.516 -2.697) 3.375 17.160 ( 7.112 -3.458 6.512) 10.244 17.589 ( 0.513 7.041 5.872) 9.182 18.205 ( -7.325 -4.973 -10.366) 13.632 ======================= Grid point 251 (143/294) ======================= q-point: ( 0.42 0.67 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.453 ( -2.112 -2.915 0.882) 3.706 1.644 ( -2.226 3.124 5.667) 6.844 1.722 ( 1.043 -7.866 -2.476) 8.312 2.810 ( -7.943 -0.726 -2.291) 8.298 3.004 ( -0.756 3.814 -1.845) 4.304 3.513 ( 11.030 6.471 -5.445) 13.899 4.094 ( 5.156 -3.530 9.642) 11.490 4.405 ( 2.157 -3.147 -1.354) 4.049 5.169 ( -7.020 1.469 -1.489) 7.325 6.507 ( -5.295 -0.569 -1.236) 5.467 6.797 ( 0.760 -3.449 0.650) 3.591 6.877 ( 0.391 1.631 -0.100) 1.680 7.790 ( -3.836 0.051 -1.142) 4.003 7.967 ( -2.790 1.624 2.207) 3.911 8.068 ( -3.563 1.279 1.904) 4.238 8.741 ( 8.194 -2.078 -2.569) 8.835 9.654 ( 0.189 5.294 -0.699) 5.344 9.788 ( 3.912 -3.367 1.307) 5.324 16.204 ( -4.143 -1.082 1.084) 4.417 16.404 ( 2.709 2.975 -1.618) 4.337 16.740 ( 0.319 -0.059 -3.169) 3.185 17.279 ( 6.604 -4.445 7.677) 11.059 17.678 ( 0.595 4.764 2.828) 5.572 17.979 ( -9.408 -2.795 -7.274) 12.216 ======================= Grid point 252 (144/294) ======================= q-point: (-0.50 -0.33 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.408 ( -3.649 0.857 0.437) 3.773 1.660 ( -3.603 0.283 10.478) 11.084 1.703 ( 4.436 -2.886 -4.072) 6.678 2.587 ( -8.711 -5.387 -3.547) 10.839 3.105 ( 2.295 9.296 2.716) 9.953 3.713 ( 12.273 2.396 -8.158) 14.930 4.168 ( 1.340 -2.237 4.612) 5.298 4.383 ( 3.184 -6.092 -4.813) 8.392 5.081 ( -8.417 4.416 5.680) 11.073 6.422 ( -3.940 -0.483 0.981) 4.089 6.767 ( -1.259 -1.553 -0.724) 2.126 6.910 ( 1.512 0.849 0.052) 1.735 7.705 ( -4.437 -4.073 2.799) 6.642 7.963 ( -2.400 4.847 1.070) 5.513 8.053 ( -1.363 1.037 2.172) 2.766 8.818 ( 5.613 -1.958 -3.828) 7.071 9.691 ( 0.458 4.193 -3.133) 5.254 9.828 ( 3.594 -3.328 0.986) 4.997 16.136 ( -3.310 -2.078 2.262) 4.515 16.481 ( 2.124 5.417 -0.018) 5.819 16.750 ( 3.420 0.240 -4.912) 5.990 17.368 ( 4.515 -5.386 6.760) 9.752 17.724 ( 3.006 -4.685 -6.572) 8.613 17.789 ( -11.740 8.046 4.704) 14.989 ======================= Grid point 253 (145/294) ======================= q-point: (-0.42 -0.33 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.331 ( -5.470 -0.673 -3.382) 6.466 1.605 ( -8.449 -4.783 7.888) 12.509 1.754 ( 4.838 1.108 -0.837) 5.034 2.495 ( 2.409 0.716 1.978) 3.198 3.242 ( -0.214 10.356 5.048) 11.523 3.822 ( 9.439 -6.270 -14.071) 18.066 4.155 ( -1.453 -0.271 -0.258) 1.500 4.358 ( 2.958 -4.120 -4.371) 6.695 5.052 ( -7.475 6.935 11.344) 15.253 6.392 ( -0.723 -0.643 3.870) 3.989 6.725 ( -1.259 -0.627 -2.942) 3.261 6.933 ( 0.522 0.147 0.185) 0.573 7.620 ( -2.805 -4.366 3.442) 6.227 7.979 ( -1.624 3.531 0.743) 3.957 8.070 ( -0.302 1.940 4.170) 4.609 8.839 ( 2.612 -2.144 -5.496) 6.452 9.715 ( 0.496 3.627 -3.853) 5.315 9.845 ( 1.878 -3.492 0.187) 3.969 16.089 ( -1.663 -2.050 2.599) 3.705 16.569 ( 0.965 6.027 3.002) 6.802 16.775 ( 3.533 -1.318 -7.184) 8.114 17.395 ( 1.479 -4.511 2.358) 5.300 17.596 ( -6.204 -0.273 -4.122) 7.453 17.849 ( 1.301 6.099 7.886) 10.054 ======================= Grid point 254 (146/294) ======================= q-point: (-0.33 -0.33 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.197 ( -1.522 -6.467 -6.367) 9.202 1.387 ( -12.827 -11.971 7.606) 19.123 1.880 ( 4.533 7.891 1.277) 9.189 2.668 ( 9.961 6.423 4.318) 12.614 3.340 ( -4.157 10.861 6.793) 13.468 3.715 ( 0.947 -11.563 -19.295) 22.515 4.149 ( 0.741 0.057 -1.715) 1.869 4.341 ( 0.275 -2.188 -1.373) 2.598 5.103 ( -3.479 8.544 11.752) 14.940 6.429 ( 2.441 -0.945 6.038) 6.581 6.681 ( -0.386 -0.868 -4.847) 4.939 6.935 ( -0.498 0.214 0.551) 0.773 7.585 ( 0.638 -2.898 2.888) 4.141 7.979 ( -1.255 0.669 0.671) 1.572 8.124 ( 0.120 3.055 5.854) 6.604 8.804 ( 0.338 -1.789 -7.485) 7.703 9.727 ( -0.279 1.337 -2.091) 2.498 9.827 ( -0.397 -1.691 -1.201) 2.112 16.075 ( 0.180 -1.516 2.526) 2.951 16.659 ( 0.143 5.919 4.763) 7.599 16.731 ( 0.061 -5.231 -7.592) 9.220 17.369 ( -1.817 -0.727 -2.327) 3.040 17.493 ( -4.585 -0.318 -0.309) 4.606 18.021 ( 6.216 7.388 8.429) 12.817 ======================= Grid point 255 (147/294) ======================= q-point: (-0.25 -0.33 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.089 ( -9.267 -13.857 2.064) 16.798 1.156 ( 7.678 -9.882 1.105) 12.563 2.025 ( 0.815 9.438 1.776) 9.638 2.924 ( 9.310 7.720 2.348) 12.320 3.399 ( -4.455 7.761 5.648) 10.582 3.469 ( -4.316 -7.590 -18.423) 20.387 4.130 ( -1.159 -0.922 -3.035) 3.377 4.300 ( -3.634 -2.617 4.292) 6.202 5.228 ( 1.473 8.745 8.047) 11.974 6.510 ( 3.763 -1.388 6.189) 7.375 6.642 ( 1.097 -1.769 -5.664) 6.035 6.937 ( -0.287 1.495 0.809) 1.724 7.623 ( 4.332 -1.460 2.929) 5.429 7.960 ( -0.941 -1.479 0.233) 1.768 8.190 ( 0.204 2.825 5.604) 6.279 8.740 ( -1.110 -0.161 -8.347) 8.422 9.685 ( -3.785 -3.276 1.725) 5.295 9.809 ( -0.441 2.626 -3.054) 4.052 16.095 ( 1.921 -1.013 2.236) 3.117 16.601 ( -3.663 -4.847 -6.032) 8.561 16.749 ( 1.728 3.033 4.515) 5.707 17.287 ( -5.461 2.242 -7.098) 9.231 17.431 ( -2.701 -4.226 4.885) 7.001 18.274 ( 8.455 10.452 6.293) 14.844 ======================= Grid point 256 (148/294) ======================= q-point: (-0.17 -0.33 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.877 ( 1.390 -11.890 -3.572) 12.493 1.311 ( 16.284 -6.545 7.129) 18.943 2.080 ( -4.298 6.618 0.892) 7.941 3.066 ( -2.195 2.205 -7.338) 7.970 3.216 ( 3.440 -9.752 -13.820) 17.261 3.485 ( -5.709 14.529 8.221) 17.643 4.069 ( -3.268 -1.161 0.239) 3.476 4.223 ( -6.932 -1.655 5.631) 9.083 5.392 ( 4.280 7.549 4.417) 9.737 6.541 ( 0.174 -5.026 1.183) 5.166 6.661 ( 5.276 0.931 -2.254) 5.812 6.969 ( 1.116 3.173 0.071) 3.364 7.719 ( 6.130 -2.330 4.604) 8.012 7.934 ( 1.029 -2.101 -1.408) 2.731 8.236 ( -0.130 0.896 2.756) 2.900 8.676 ( -2.798 2.743 -6.840) 7.883 9.581 ( -6.728 -3.032 4.200) 8.492 9.816 ( -0.207 2.871 -2.402) 3.749 16.143 ( 3.615 -0.784 1.822) 4.124 16.474 ( -2.052 -4.573 -4.546) 6.767 16.826 ( 1.338 2.482 3.948) 4.851 17.169 ( -6.132 2.925 -8.266) 10.700 17.366 ( -3.647 -6.471 7.452) 10.522 18.535 ( 7.058 11.141 2.632) 13.449 ======================= Grid point 257 (149/294) ======================= q-point: (-0.08 -0.33 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.915 ( 15.592 -1.237 -11.116) 19.189 1.602 ( 17.771 -3.670 10.507) 20.968 2.036 ( -6.920 4.121 0.723) 8.087 2.846 ( -2.823 -11.733 -17.216) 21.024 3.183 ( -2.408 -0.912 -4.128) 4.865 3.572 ( -5.837 12.036 9.556) 16.439 4.039 ( -0.301 -0.442 3.180) 3.225 4.111 ( -9.757 1.937 3.579) 10.571 5.548 ( 4.627 5.900 1.595) 7.666 6.478 ( -1.348 -5.772 0.023) 5.928 6.758 ( 5.905 1.570 -2.027) 6.438 7.025 ( 1.970 4.361 -2.813) 5.551 7.787 ( 3.872 -6.892 4.333) 9.014 7.980 ( 6.748 0.316 -0.511) 6.774 8.223 ( -0.771 -2.841 -1.457) 3.285 8.619 ( -5.213 5.419 -4.362) 8.693 9.475 ( -7.976 -0.121 7.016) 10.623 9.825 ( -0.213 1.948 -1.493) 2.464 16.219 ( 5.392 -0.724 1.360) 5.608 16.405 ( 0.712 -3.138 -3.162) 4.512 16.883 ( 0.704 1.970 3.029) 3.681 17.059 ( -5.665 3.997 -6.519) 9.517 17.279 ( -4.516 -7.053 8.151) 11.687 18.720 ( 3.554 8.522 -1.802) 9.407 ======================= Grid point 260 (150/294) ======================= q-point: ( 0.17 -0.25 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.423 ( 12.978 5.785 -15.565) 21.075 1.535 ( 9.136 -18.620 -15.092) 25.650 2.087 ( -1.489 2.693 -1.109) 3.271 2.698 ( 7.021 6.914 14.012) 17.130 2.849 ( -5.002 -6.405 10.405) 13.203 3.524 ( -14.390 1.898 1.488) 14.591 4.120 ( -2.572 0.780 -2.661) 3.782 4.279 ( -0.769 5.401 5.172) 7.518 5.559 ( -3.562 -0.865 -8.401) 9.166 6.451 ( 3.390 0.683 4.423) 5.614 6.820 ( 3.703 -2.990 -8.908) 10.099 6.972 ( -1.706 -0.446 -2.607) 3.147 7.789 ( 5.928 1.469 -2.097) 6.457 7.937 ( 1.548 -3.664 -1.068) 4.118 8.243 ( 6.819 -2.362 2.767) 7.729 8.538 ( -9.766 3.081 1.020) 10.291 9.615 ( -4.579 5.540 7.494) 10.383 9.765 ( -1.715 -2.420 -2.281) 3.742 16.246 ( 1.713 -1.989 -5.153) 5.783 16.402 ( 4.425 -2.319 3.331) 6.004 16.910 ( -2.288 2.226 -4.004) 5.121 17.027 ( -4.378 -3.163 5.963) 8.045 17.406 ( 2.057 7.332 6.643) 10.105 18.585 ( -4.332 -1.688 -9.455) 10.536 ======================= Grid point 261 (151/294) ======================= q-point: ( 0.25 -0.25 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.365 ( 9.105 -17.064 -14.045) 23.903 1.634 ( 6.606 6.522 -7.836) 12.148 1.990 ( -7.965 -0.838 -4.426) 9.151 2.845 ( 1.651 1.789 7.409) 7.798 2.967 ( 5.244 3.715 15.756) 17.016 3.347 ( -8.116 1.310 0.140) 8.222 4.038 ( -4.609 -2.318 -1.307) 5.322 4.334 ( 0.706 1.058 2.136) 2.486 5.442 ( -4.234 0.813 -8.309) 9.361 6.548 ( 3.644 1.844 4.044) 5.747 6.772 ( 1.294 -4.716 -7.696) 9.119 6.939 ( -1.449 0.085 -0.096) 1.455 7.878 ( 3.014 5.364 -4.979) 7.915 7.943 ( 1.693 -0.548 0.232) 1.795 8.315 ( 2.497 -1.916 -2.944) 4.310 8.433 ( -4.978 -0.852 7.665) 9.180 9.645 ( -2.619 4.441 5.318) 7.407 9.703 ( -0.255 -3.734 -1.805) 4.155 16.238 ( 1.821 0.098 -4.076) 4.466 16.438 ( 0.095 -2.122 2.843) 3.549 16.867 ( -2.806 0.951 -2.942) 4.175 16.992 ( 0.699 -3.172 5.225) 6.152 17.529 ( 2.653 4.154 2.568) 5.558 18.441 ( -6.555 0.158 -6.513) 9.242 ======================= Grid point 262 (152/294) ======================= q-point: ( 0.33 -0.25 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.319 ( 9.509 -11.178 -8.744) 17.083 1.713 ( -1.291 5.298 0.434) 5.470 1.821 ( -5.728 -3.147 -2.800) 7.110 2.942 ( 3.513 2.192 0.819) 4.220 3.072 ( -7.185 8.445 5.121) 12.213 3.326 ( 3.106 -0.207 2.306) 3.874 3.959 ( -0.364 -4.820 4.933) 6.907 4.338 ( 1.771 -4.133 -2.842) 5.319 5.352 ( -4.515 3.737 -5.086) 7.760 6.633 ( -0.122 3.284 2.357) 4.044 6.708 ( 2.043 -5.288 -2.941) 6.386 6.917 ( -1.628 0.633 -0.153) 1.753 7.912 ( -2.297 7.475 -7.496) 10.833 7.977 ( 1.511 0.096 2.579) 2.990 8.248 ( -4.695 -1.070 -0.184) 4.819 8.474 ( 5.178 -2.925 4.459) 7.433 9.644 ( 1.782 -4.769 0.074) 5.092 9.700 ( -0.686 3.339 1.622) 3.775 16.261 ( 1.766 2.786 -3.206) 4.599 16.405 ( -2.987 -1.826 2.361) 4.222 16.801 ( -3.488 -0.693 -1.522) 3.869 17.053 ( 5.907 -2.897 5.106) 8.328 17.595 ( 3.507 -0.928 -2.495) 4.403 18.305 ( -9.342 4.095 -2.188) 10.432 ======================= Grid point 263 (153/294) ======================= q-point: ( 0.42 -0.25 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.352 ( 7.266 -4.232 -2.879) 8.888 1.668 ( -4.266 -1.108 2.245) 4.946 1.785 ( -1.997 3.700 3.341) 5.370 2.948 ( -11.621 -0.870 -5.234) 12.775 3.019 ( 2.822 5.756 -2.297) 6.809 3.425 ( 4.792 3.481 1.839) 6.202 4.014 ( 6.199 -5.207 10.346) 13.136 4.286 ( 2.508 -7.257 -7.187) 10.517 5.304 ( -5.296 6.152 -0.299) 8.123 6.589 ( -4.866 0.065 -0.926) 4.954 6.744 ( 3.119 -0.882 2.255) 3.949 6.899 ( -1.304 1.305 -0.806) 2.014 7.860 ( -5.223 2.281 -3.966) 6.943 8.016 ( 0.383 2.087 2.168) 3.033 8.175 ( -5.218 1.015 2.776) 5.997 8.567 ( 7.962 -2.491 -1.428) 8.464 9.649 ( 4.477 -5.234 0.562) 6.910 9.725 ( -0.326 2.605 -0.472) 2.667 16.268 ( -3.369 0.639 -0.217) 3.436 16.392 ( 1.836 3.012 0.337) 3.544 16.734 ( -2.293 -1.104 -1.710) 3.067 17.166 ( 7.174 -3.594 5.954) 9.992 17.600 ( 4.141 -5.348 -6.320) 9.257 18.191 ( -11.633 8.306 1.964) 14.429 ======================= Grid point 264 (154/294) ======================= q-point: (-0.50 -0.25 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.434 ( 3.442 2.858 1.224) 4.638 1.632 ( -1.041 -0.253 0.554) 1.206 1.802 ( -3.890 3.423 6.779) 8.533 2.676 ( -11.592 -5.653 -5.315) 13.949 3.143 ( 5.061 9.419 -1.942) 10.868 3.527 ( 6.304 -2.473 -3.218) 7.497 4.127 ( 4.805 -4.034 8.649) 10.685 4.225 ( 3.770 -5.289 -7.750) 10.112 5.288 ( -6.099 7.341 4.355) 10.491 6.503 ( -4.998 -0.169 0.505) 5.027 6.772 ( -0.785 0.541 0.390) 1.030 6.899 ( 0.605 1.144 -0.678) 1.462 7.756 ( -5.224 -3.293 0.475) 6.194 8.059 ( -0.231 4.063 2.763) 4.919 8.121 ( -5.277 2.122 2.584) 6.247 8.658 ( 7.936 -2.256 -5.133) 9.717 9.692 ( 4.616 -2.883 1.044) 5.541 9.733 ( 0.710 0.369 -2.399) 2.528 16.194 ( -4.562 -1.840 1.896) 5.272 16.499 ( 3.852 7.708 0.016) 8.617 16.688 ( -0.130 -1.702 -2.735) 3.223 17.270 ( 5.880 -4.101 4.436) 8.431 17.572 ( 4.340 -6.544 -5.955) 9.855 18.104 ( -12.138 10.317 4.727) 16.617 ======================= Grid point 265 (155/294) ======================= q-point: (-0.42 -0.25 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.424 ( -8.770 1.724 -6.528) 11.068 1.678 ( 4.691 5.653 1.934) 7.597 1.780 ( -6.909 -3.058 10.307) 12.780 2.493 ( -1.946 -1.218 -0.698) 2.400 3.331 ( 5.768 11.238 1.237) 12.692 3.520 ( 6.341 -12.217 -10.979) 17.607 4.164 ( 0.253 -1.373 2.670) 3.013 4.248 ( 4.618 -0.714 -3.083) 5.598 5.293 ( -6.237 7.544 8.066) 12.684 6.441 ( -3.043 -0.517 2.709) 4.107 6.739 ( -2.957 1.180 -3.168) 4.491 6.923 ( 1.116 0.482 0.287) 1.249 7.646 ( -3.981 -5.529 2.932) 7.417 8.072 ( -4.555 2.027 1.853) 5.319 8.118 ( 0.185 3.982 4.030) 5.669 8.712 ( 5.592 -2.399 -7.101) 9.351 9.727 ( -0.232 3.219 -4.067) 5.192 9.753 ( 4.958 -4.398 1.789) 6.864 16.123 ( -3.170 -2.284 2.645) 4.718 16.632 ( 0.698 5.746 3.545) 6.788 16.668 ( 3.617 -0.130 -6.294) 7.260 17.323 ( 3.675 -2.873 -1.069) 4.785 17.563 ( 3.338 -4.092 -2.334) 5.774 18.053 ( -9.306 9.162 7.787) 15.205 ======================= Grid point 266 (156/294) ======================= q-point: (-0.33 -0.25 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.182 ( -9.847 -3.834 -12.751) 16.561 1.565 ( -15.498 -12.286 11.030) 22.645 1.887 ( 6.446 9.969 3.534) 12.387 2.595 ( 8.715 6.515 1.735) 11.019 3.390 ( 3.714 -15.291 -13.080) 20.462 3.540 ( 3.716 11.762 2.548) 12.596 4.157 ( -1.718 -0.454 1.157) 2.120 4.292 ( 2.788 1.264 -3.476) 4.632 5.321 ( -5.288 7.321 9.915) 13.411 6.433 ( 0.227 -1.164 5.208) 5.341 6.671 ( -2.960 0.324 -5.465) 6.223 6.942 ( 0.355 0.550 0.592) 0.883 7.569 ( -1.233 -5.017 3.362) 6.164 8.030 ( -3.299 0.421 1.416) 3.615 8.179 ( 0.254 2.427 4.256) 4.906 8.718 ( 2.811 -1.108 -7.721) 8.292 9.729 ( 0.386 0.458 -1.814) 1.910 9.796 ( 2.063 0.101 -0.151) 2.071 16.082 ( -1.238 -2.116 2.979) 3.858 16.611 ( 1.165 -5.784 -4.633) 7.502 16.759 ( 0.175 7.386 2.194) 7.707 17.345 ( 2.514 0.217 -3.680) 4.463 17.545 ( -1.726 -0.278 -3.659) 4.055 18.093 ( -1.059 6.747 11.698) 13.546 ======================= Grid point 267 (157/294) ======================= q-point: (-0.25 -0.25 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.971 ( 0.536 -7.872 -7.911) 11.173 1.206 ( -17.444 -17.486 9.779) 26.565 2.081 ( 3.995 7.747 1.331) 8.817 2.841 ( 10.931 8.369 -1.538) 13.853 3.219 ( 1.496 -12.788 -13.316) 18.523 3.686 ( -4.071 14.225 5.806) 15.894 4.126 ( -0.783 -0.364 -1.543) 1.769 4.316 ( 0.643 -0.419 -0.079) 0.771 5.374 ( -3.092 7.084 8.920) 11.803 6.482 ( 2.871 -1.639 6.669) 7.444 6.591 ( -1.802 -1.560 -6.184) 6.627 6.956 ( 0.043 1.389 0.552) 1.495 7.559 ( 2.635 -3.406 3.080) 5.295 7.982 ( -3.045 -1.419 0.597) 3.412 8.211 ( 1.023 -1.577 1.267) 2.267 8.714 ( 0.682 3.315 -5.384) 6.360 9.720 ( -1.378 -1.257 2.033) 2.759 9.821 ( 0.189 3.106 -2.388) 3.922 16.076 ( 0.583 -1.791 3.084) 3.613 16.523 ( -0.334 -7.289 -6.343) 9.668 16.826 ( -1.206 5.369 4.133) 6.882 17.347 ( -1.916 2.508 -4.973) 5.890 17.467 ( -3.817 -1.106 -2.059) 4.476 18.277 ( 6.529 7.768 10.247) 14.421 ======================= Grid point 268 (158/294) ======================= q-point: (-0.17 -0.25 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.825 ( -12.255 -18.501 5.926) 22.969 1.008 ( 15.118 -9.028 3.782) 18.010 2.147 ( 0.828 -1.210 -3.243) 3.559 2.994 ( 1.119 -5.257 -15.053) 15.984 3.098 ( 1.809 7.709 -2.328) 8.253 3.767 ( -5.932 15.028 6.133) 17.281 4.105 ( -1.701 -0.790 0.886) 2.074 4.305 ( -1.684 -1.540 3.054) 3.813 5.456 ( -0.098 6.551 5.942) 8.845 6.507 ( -1.379 -3.850 -1.364) 4.311 6.571 ( 5.169 -1.036 1.625) 5.516 6.981 ( 0.645 2.532 0.118) 2.615 7.623 ( 5.825 -2.634 3.820) 7.448 7.907 ( -2.419 -3.502 -2.406) 4.889 8.199 ( 1.894 -5.081 -2.511) 5.976 8.743 ( -1.698 7.993 -1.548) 8.317 9.686 ( -4.117 -0.212 5.051) 6.520 9.834 ( -0.477 3.278 -2.763) 4.313 16.100 ( 2.038 -1.579 2.963) 3.927 16.407 ( -0.723 -6.662 -6.012) 9.002 16.876 ( -0.675 3.628 4.207) 5.596 17.260 ( -6.481 3.902 -8.201) 11.157 17.401 ( -2.507 -4.805 4.901) 7.306 18.529 ( 7.818 9.331 4.646) 13.030 ======================= Grid point 269 (159/294) ======================= q-point: (-0.08 -0.25 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.623 ( 6.410 -9.807 -3.879) 12.342 1.290 ( 21.708 -7.466 11.273) 25.575 2.068 ( 0.898 -10.279 -7.487) 12.749 2.771 ( -10.182 -2.420 -10.838) 15.066 3.207 ( 0.709 7.831 -5.402) 9.540 3.849 ( -6.658 14.397 6.635) 17.194 4.063 ( -1.990 -2.575 3.699) 4.926 4.271 ( -4.580 1.177 3.215) 5.718 5.556 ( 2.146 5.243 2.735) 6.291 6.441 ( -0.732 -4.895 -0.542) 4.979 6.661 ( 5.730 -0.093 -0.417) 5.746 7.023 ( 1.231 3.394 -1.498) 3.909 7.699 ( 2.840 -5.981 4.674) 8.105 7.855 ( 5.029 -2.364 -5.180) 7.597 8.151 ( 1.087 -6.652 -3.233) 7.475 8.767 ( -5.052 8.979 -0.513) 10.315 9.652 ( -6.087 3.027 7.783) 10.334 9.837 ( -0.387 2.158 -2.452) 3.289 16.146 ( 3.503 -1.406 2.169) 4.353 16.324 ( 1.339 -5.036 -4.369) 6.800 16.921 ( -0.207 2.533 3.739) 4.521 17.156 ( -5.320 4.436 -5.850) 9.067 17.333 ( -3.953 -5.911 7.265) 10.166 18.722 ( 4.226 7.715 -1.901) 9.000 ======================= Grid point 272 (160/294) ======================= q-point: ( 0.17 -0.17 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.037 ( 10.312 -24.171 -17.327) 31.477 1.176 ( 19.768 11.540 -14.281) 26.980 2.038 ( 12.286 -2.927 9.095) 15.564 2.763 ( -4.092 2.260 10.750) 11.723 3.011 ( -8.920 1.638 7.267) 11.621 3.816 ( -16.303 4.113 0.204) 16.815 4.146 ( -1.518 0.517 -3.593) 3.935 4.327 ( 0.314 0.601 0.709) 0.981 5.568 ( -3.347 0.215 -6.368) 7.197 6.429 ( 2.880 0.034 4.819) 5.614 6.682 ( 4.075 -1.653 -8.083) 9.202 6.992 ( -1.911 0.682 -1.289) 2.404 7.701 ( 6.782 4.789 -3.390) 8.968 7.839 ( 3.978 -7.335 3.786) 9.163 8.146 ( 5.942 -0.896 2.753) 6.610 8.733 ( -9.992 3.118 0.033) 10.468 9.747 ( -3.371 -0.219 2.578) 4.250 9.787 ( -4.501 1.435 -1.815) 5.061 16.170 ( 2.394 -0.850 -4.529) 5.193 16.314 ( 5.673 -2.475 4.100) 7.424 16.943 ( -2.464 1.236 -3.444) 4.412 17.130 ( -6.514 -2.318 5.997) 9.153 17.435 ( 2.939 2.023 1.358) 3.818 18.616 ( -4.166 2.849 -5.158) 7.217 ======================= Grid point 273 (161/294) ======================= q-point: ( 0.25 -0.17 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.946 ( 12.631 -15.579 -10.973) 22.862 1.490 ( 13.865 12.231 -12.750) 22.459 2.094 ( -5.567 -1.187 -0.423) 5.708 2.820 ( 5.630 -9.451 16.356) 19.711 3.035 ( -0.239 8.122 9.855) 12.772 3.580 ( -15.797 3.818 -2.181) 16.397 4.085 ( -3.574 -1.182 -2.543) 4.543 4.306 ( -0.160 -4.533 -2.781) 5.320 5.485 ( -3.825 3.200 -5.925) 7.744 6.516 ( 4.391 -0.108 3.496) 5.614 6.684 ( 1.822 -0.112 -4.408) 4.771 6.968 ( -1.684 1.076 0.121) 2.002 7.830 ( 6.327 5.574 -7.774) 11.469 7.881 ( 3.846 -2.014 4.905) 6.550 8.237 ( 4.181 -1.663 2.210) 5.013 8.592 ( -9.454 0.445 2.626) 9.822 9.654 ( -3.038 -5.006 -3.837) 7.001 9.764 ( -2.663 2.957 3.316) 5.180 16.188 ( 2.434 1.126 -2.935) 3.975 16.398 ( 4.116 -2.187 3.489) 5.822 16.897 ( -1.970 1.549 -4.026) 4.742 17.040 ( -5.478 -2.840 6.082) 8.664 17.475 ( 3.635 -2.861 -4.224) 6.264 18.559 ( -6.180 6.066 -0.478) 8.673 ======================= Grid point 274 (162/294) ======================= q-point: ( 0.33 -0.17 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.026 ( 11.954 -3.344 -2.113) 12.591 1.707 ( 7.378 10.142 -7.907) 14.826 1.924 ( -9.916 -2.826 -0.526) 10.324 2.913 ( 3.244 -2.589 9.085) 9.989 3.222 ( 7.909 0.906 11.822) 14.252 3.359 ( -13.207 3.866 -5.909) 14.976 3.987 ( -4.850 -2.440 1.277) 5.577 4.218 ( 1.325 -8.673 -7.279) 11.400 5.444 ( -3.612 6.422 -3.035) 7.969 6.589 ( 4.652 -3.762 0.145) 5.985 6.702 ( -0.610 4.612 1.671) 4.943 6.954 ( -1.876 1.516 0.428) 2.450 7.920 ( 4.881 2.783 -5.718) 8.017 7.968 ( 2.194 5.113 0.221) 5.568 8.245 ( -0.913 -2.047 -2.888) 3.656 8.503 ( -4.125 -1.768 8.620) 9.718 9.545 ( 0.145 -7.680 -3.273) 8.349 9.771 ( -1.851 2.641 1.709) 3.650 16.239 ( 2.734 3.689 -1.960) 4.993 16.431 ( -0.119 -1.764 2.383) 2.967 16.853 ( -3.386 0.659 -1.806) 3.894 16.996 ( 0.420 -2.899 5.206) 5.974 17.460 ( 4.273 -6.247 -7.367) 10.562 18.517 ( -8.151 8.383 2.085) 11.877 ======================= Grid point 275 (163/294) ======================= q-point: ( 0.42 -0.17 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.213 ( 8.613 4.815 3.809) 10.577 1.757 ( -5.949 -2.110 0.814) 6.364 1.849 ( 1.609 8.022 -0.116) 8.183 2.977 ( 1.579 -1.800 2.644) 3.567 3.134 ( -12.195 4.273 -11.299) 17.165 3.381 ( 5.457 -3.663 6.258) 9.075 3.948 ( 1.816 -4.152 7.597) 8.846 4.128 ( 2.718 -6.658 -8.284) 10.970 5.444 ( -3.769 7.800 -0.035) 8.663 6.591 ( 1.283 -5.051 -0.501) 5.236 6.768 ( -0.302 6.532 3.448) 7.392 6.938 ( -2.386 1.995 0.153) 3.114 7.940 ( -3.349 2.392 -4.912) 6.408 8.033 ( 0.800 3.704 0.419) 3.812 8.212 ( 2.434 0.152 -3.022) 3.883 8.490 ( -1.316 -2.439 6.075) 6.677 9.494 ( 4.899 -8.677 -0.952) 10.010 9.769 ( -1.604 2.209 -0.422) 2.762 16.309 ( 0.776 4.058 -1.227) 4.310 16.407 ( -1.054 0.479 1.170) 1.646 16.779 ( -4.622 -0.568 0.154) 4.660 17.057 ( 5.857 -2.775 4.566) 7.928 17.422 ( 4.648 -7.603 -7.445) 11.612 18.471 ( -9.684 9.631 2.754) 13.933 ======================= Grid point 276 (164/294) ======================= q-point: (-0.50 -0.17 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.425 ( 5.508 9.413 5.780) 12.343 1.690 ( -3.102 0.460 3.009) 4.346 1.924 ( -2.059 5.839 2.842) 6.813 2.790 ( -12.999 -6.236 -5.990) 15.612 3.097 ( 4.602 4.998 -6.990) 9.747 3.400 ( 2.920 -7.841 -1.929) 8.587 4.041 ( 6.759 -4.415 9.921) 12.790 4.104 ( 3.228 -0.187 -5.027) 5.977 5.461 ( -4.081 7.725 2.293) 9.032 6.543 ( -1.414 -4.214 0.401) 4.463 6.836 ( -1.431 6.548 2.251) 7.070 6.913 ( -2.351 1.596 -1.003) 3.013 7.825 ( -6.782 -2.388 -1.339) 7.314 8.083 ( 1.408 1.752 1.612) 2.766 8.252 ( -2.278 5.115 1.136) 5.713 8.488 ( 4.442 -3.428 -3.360) 6.540 9.527 ( 7.889 -7.896 1.955) 11.332 9.758 ( -1.392 2.547 -2.330) 3.722 16.270 ( -5.115 -0.976 1.244) 5.354 16.487 ( 4.886 6.372 -1.822) 8.234 16.706 ( -3.756 -0.433 0.773) 3.859 17.155 ( 6.291 -2.905 2.087) 7.237 17.398 ( 5.453 -7.432 -3.348) 9.807 18.413 ( -10.706 10.073 2.761) 14.957 ======================= Grid point 277 (165/294) ======================= q-point: (-0.42 -0.17 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.561 ( -7.240 5.925 -4.570) 10.411 1.697 ( 2.816 7.212 4.829) 9.125 1.923 ( -5.551 0.333 7.317) 9.190 2.530 ( -6.931 -4.005 -2.636) 8.428 3.159 ( 8.423 -9.866 -10.628) 16.770 3.386 ( 3.941 2.851 -1.419) 5.066 4.152 ( 3.267 -1.991 7.312) 8.253 4.164 ( 4.765 2.809 -2.107) 5.919 5.481 ( -4.157 6.907 4.104) 9.046 6.481 ( -2.034 -3.593 1.386) 4.355 6.831 ( -6.450 5.661 -2.177) 8.854 6.913 ( 1.090 1.339 0.334) 1.758 7.687 ( -5.651 -5.215 2.235) 8.008 8.120 ( 0.249 -0.434 2.296) 2.350 8.231 ( -5.558 3.849 2.352) 7.158 8.541 ( 7.770 -0.887 -7.649) 10.939 9.605 ( 7.416 -6.275 3.203) 10.229 9.755 ( -0.406 3.955 -3.138) 5.065 16.182 ( -4.793 -1.830 2.262) 5.607 16.579 ( 2.304 -0.658 -5.592) 6.084 16.700 ( 0.742 6.560 3.384) 7.418 17.214 ( 4.761 -1.712 -4.692) 6.900 17.434 ( 6.371 -6.442 3.844) 9.842 18.348 ( -10.753 9.754 3.782) 15.002 ======================= Grid point 278 (166/294) ======================= q-point: (-0.33 -0.17 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.297 ( -16.430 -0.006 -16.260) 23.116 1.766 ( -13.966 -10.980 11.757) 21.303 1.901 ( 5.335 8.494 3.680) 10.684 2.528 ( 6.159 5.430 -1.388) 8.327 3.068 ( 6.436 -16.536 -10.078) 20.406 3.581 ( 8.216 11.923 2.604) 14.712 4.196 ( -1.086 -1.146 4.613) 4.876 4.245 ( 3.270 3.600 -2.927) 5.677 5.503 ( -3.812 5.796 5.403) 8.793 6.438 ( -0.295 -3.456 2.745) 4.424 6.742 ( -6.950 3.300 -4.230) 8.779 6.946 ( 0.561 1.950 0.469) 2.083 7.577 ( -3.565 -5.613 3.992) 7.756 8.095 ( -3.264 -1.247 1.995) 4.023 8.196 ( -0.747 -2.230 -0.778) 2.477 8.622 ( 5.138 3.721 -5.076) 8.125 9.673 ( 4.458 -3.541 2.434) 6.192 9.789 ( 1.207 4.697 -2.162) 5.310 16.114 ( -3.079 -2.029 2.905) 4.694 16.525 ( -0.313 -4.831 -5.119) 7.046 16.825 ( 1.989 7.303 2.413) 7.944 17.252 ( 5.296 1.270 -7.687) 9.421 17.495 ( 3.959 -4.515 3.096) 6.756 18.307 ( -8.026 8.436 7.620) 13.916 ======================= Grid point 279 (167/294) ======================= q-point: (-0.25 -0.17 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.928 ( -11.937 -4.480 -17.033) 21.276 1.417 ( -19.712 -17.424 12.787) 29.251 2.029 ( 5.205 -2.167 -4.766) 7.383 2.716 ( 9.389 8.662 -7.195) 14.661 3.032 ( 6.847 -5.458 0.886) 8.801 3.848 ( 5.291 14.099 4.978) 15.860 4.149 ( -4.015 -0.588 -0.897) 4.156 4.297 ( 1.372 1.324 -0.912) 2.114 5.529 ( -3.070 4.856 5.746) 8.125 6.441 ( 2.486 -3.499 2.988) 5.229 6.628 ( -6.308 0.758 -3.199) 7.114 6.974 ( 0.084 2.274 0.473) 2.324 7.520 ( -0.319 -4.381 3.790) 5.802 8.030 ( -4.018 -2.260 0.855) 4.688 8.137 ( 1.259 -7.370 -4.308) 8.629 8.723 ( 2.691 7.985 -1.265) 8.521 9.718 ( 2.002 -1.233 3.194) 3.966 9.840 ( 0.602 4.965 -2.066) 5.411 16.080 ( -1.004 -2.002 3.320) 4.005 16.432 ( -0.844 -6.198 -5.485) 8.320 16.907 ( -0.304 4.707 2.582) 5.377 17.317 ( 4.482 2.835 -6.383) 8.299 17.488 ( -1.463 -1.583 -3.504) 4.114 18.359 ( -0.823 6.775 11.792) 13.624 ======================= Grid point 280 (168/294) ======================= q-point: (-0.17 -0.17 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.725 ( 6.391 -9.835 -5.869) 13.115 0.975 ( -20.736 -20.405 12.611) 31.708 1.960 ( 4.697 -16.710 -13.151) 21.777 2.899 ( 6.729 11.851 -8.675) 16.155 3.149 ( 1.637 6.296 3.680) 7.474 4.002 ( -4.165 10.388 2.237) 11.414 4.123 ( 0.906 2.781 1.848) 3.460 4.308 ( 0.293 -0.928 1.404) 1.709 5.563 ( -1.903 4.413 4.748) 6.756 6.463 ( 1.923 -2.233 -4.522) 5.397 6.540 ( -2.001 -2.792 5.452) 6.444 7.000 ( 0.117 2.603 0.575) 2.668 7.533 ( 3.808 -2.987 3.029) 5.710 7.909 ( -4.787 -6.053 -4.109) 8.743 8.080 ( 2.659 -6.559 -3.010) 7.691 8.837 ( 0.745 9.873 0.437) 9.911 9.753 ( -0.124 0.513 5.061) 5.089 9.870 ( -1.129 4.784 -2.117) 5.352 16.080 ( 0.759 -1.971 3.689) 4.250 16.323 ( -1.052 -6.300 -5.693) 8.557 16.947 ( -1.041 3.321 2.711) 4.412 17.339 ( -3.017 3.466 -6.350) 7.838 17.406 ( -1.504 -2.443 -2.298) 3.676 18.529 ( 5.309 6.675 8.880) 12.312 ======================= Grid point 281 (169/294) ======================= q-point: (-0.08 -0.17 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.550 ( -13.325 -20.149 10.219) 26.229 0.896 ( 22.810 -10.887 9.148) 26.879 1.760 ( 5.574 -23.770 -16.341) 29.379 2.967 ( -10.053 10.509 -3.697) 15.006 3.232 ( 2.335 10.520 -6.082) 12.374 4.065 ( 0.549 5.203 2.889) 5.976 4.131 ( -5.611 3.148 5.893) 8.724 4.326 ( -0.695 2.225 1.731) 2.904 5.605 ( -0.455 3.893 2.781) 4.806 6.408 ( -0.875 -2.664 -3.255) 4.296 6.574 ( 3.960 -3.074 3.897) 6.349 7.033 ( 0.479 2.769 -0.063) 2.811 7.614 ( 6.115 -3.323 4.366) 8.216 7.741 ( -2.252 -6.878 -8.765) 11.367 8.052 ( 1.972 -5.587 -1.210) 6.047 8.916 ( -2.605 8.989 -0.335) 9.365 9.793 ( -0.991 4.056 5.123) 6.609 9.867 ( -2.820 2.835 -0.280) 4.009 16.104 ( 1.709 -1.953 3.353) 4.240 16.231 ( 0.682 -5.199 -4.678) 7.027 16.974 ( -0.824 2.478 2.854) 3.868 17.243 ( -5.005 3.052 -5.498) 8.037 17.371 ( -1.798 -3.620 3.943) 5.647 18.710 ( 4.516 6.304 0.322) 7.761 ======================= Grid point 321 (170/294) ======================= q-point: ( 0.17 0.17 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 294 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.844 ( -0.000 0.000 23.168) 23.168 0.844 ( -0.000 0.000 23.168) 23.168 1.200 ( -0.000 0.000 32.671) 32.671 3.230 ( 0.000 -0.000 -12.673) 12.673 3.230 ( 0.000 -0.000 -12.673) 12.673 4.104 ( 0.000 -0.000 -1.060) 1.060 4.104 ( 0.000 0.000 -1.060) 1.060 4.433 ( 0.000 -0.000 -16.549) 16.549 5.840 ( -0.000 0.000 0.888) 0.888 6.405 ( -0.000 0.000 3.206) 3.206 6.405 ( -0.000 0.000 3.206) 3.206 7.267 ( -0.000 0.000 10.282) 10.282 7.606 ( -0.000 0.000 5.879) 5.879 7.606 ( -0.000 0.000 5.879) 5.879 7.878 ( 0.000 -0.000 -1.448) 1.448 9.259 ( 0.000 -0.000 -3.855) 3.855 9.751 ( 0.000 -0.000 -7.584) 7.584 9.751 ( 0.000 -0.000 -7.584) 7.584 16.135 ( -0.000 0.000 4.256) 4.256 16.135 ( -0.000 0.000 4.256) 4.256 17.015 ( 0.000 -0.000 -2.821) 2.821 17.176 ( 0.000 -0.000 -3.645) 3.645 17.176 ( 0.000 -0.000 -3.645) 3.645 19.081 ( -0.000 0.000 2.506) 2.506 ======================= Grid point 322 (171/294) ======================= q-point: ( 0.25 0.17 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.816 ( -0.061 -2.878 19.088) 19.304 1.175 ( 2.052 15.991 22.419) 27.614 1.522 ( 13.902 -0.347 27.792) 31.077 2.974 ( -7.196 -8.021 -12.522) 16.520 3.291 ( 2.960 1.066 -10.540) 10.999 4.029 ( -1.488 -1.395 -2.364) 3.122 4.145 ( -2.194 3.971 -6.014) 7.533 4.270 ( -3.264 -4.015 -11.700) 12.793 5.789 ( -4.019 -2.565 -0.295) 4.777 6.368 ( -1.644 -1.836 3.139) 3.992 6.528 ( 5.353 4.384 2.744) 7.444 7.279 ( -3.582 -1.693 8.321) 9.216 7.594 ( -0.428 -1.359 7.079) 7.221 7.752 ( 5.674 3.308 7.728) 10.142 7.892 ( 2.214 1.003 -1.420) 2.815 9.163 ( -5.349 -3.982 -2.988) 7.307 9.621 ( -3.878 -2.116 -10.694) 11.570 9.801 ( 3.704 3.272 -6.533) 8.192 16.098 ( -1.946 -1.460 3.204) 4.023 16.245 ( 3.981 2.639 5.701) 7.437 16.976 ( -2.215 -0.041 -3.074) 3.789 17.081 ( -3.464 1.503 -5.628) 6.778 17.309 ( 8.539 2.598 -2.593) 9.294 19.001 ( -6.202 -5.561 3.273) 8.950 ======================= Grid point 323 (172/294) ======================= q-point: ( 0.33 0.17 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 868 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.997 ( 9.151 5.337 8.885) 13.826 1.483 ( -0.368 20.191 19.896) 28.349 1.878 ( 12.606 -2.606 18.493) 22.532 2.741 ( -2.600 -9.563 -6.852) 12.049 3.214 ( -1.842 -7.202 -4.585) 8.734 3.913 ( -12.158 -2.592 -12.462) 17.602 4.011 ( -1.439 2.448 -7.292) 7.826 4.257 ( 2.503 1.446 -1.792) 3.401 5.685 ( -3.952 -2.960 -2.476) 5.524 6.359 ( -0.046 -1.271 3.674) 3.887 6.668 ( 4.704 4.757 1.281) 6.812 7.239 ( -3.181 -1.527 3.528) 4.990 7.631 ( 0.749 -1.585 8.950) 9.120 7.909 ( 2.794 5.232 2.100) 6.292 7.970 ( 7.376 0.068 4.599) 8.693 9.005 ( -6.518 -5.009 -2.389) 8.561 9.456 ( -6.042 -1.671 -11.526) 13.121 9.848 ( 2.641 2.259 -4.409) 5.614 16.088 ( 0.369 -0.782 2.092) 2.264 16.367 ( 3.355 2.863 5.365) 6.945 16.929 ( -2.506 2.797 -3.092) 4.865 17.008 ( -2.593 0.145 -5.978) 6.517 17.426 ( 3.532 1.302 1.299) 3.982 18.860 ( -4.428 -6.988 0.177) 8.275 ======================= Grid point 324 (173/294) ======================= q-point: ( 0.42 0.17 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.270 ( 11.544 9.023 1.107) 14.694 1.744 ( -0.642 14.112 11.849) 18.437 2.029 ( -0.125 -1.024 6.172) 6.258 2.677 ( 6.633 -9.685 1.531) 11.838 3.112 ( 0.548 -8.540 5.240) 10.034 3.607 ( -12.807 -1.250 -12.068) 17.641 3.948 ( -3.442 1.166 -8.027) 8.811 4.289 ( -0.626 1.062 1.707) 2.106 5.590 ( -1.610 -1.821 -6.152) 6.615 6.383 ( 1.120 -0.683 4.192) 4.392 6.781 ( 3.621 3.988 0.294) 5.394 7.193 ( -1.816 -1.412 -0.850) 2.452 7.689 ( 1.737 -0.931 8.256) 8.488 7.986 ( 2.458 3.404 -1.198) 4.366 8.143 ( 6.603 2.183 5.857) 9.093 8.840 ( -6.285 -5.109 -0.844) 8.143 9.276 ( -6.370 -1.055 -9.381) 11.388 9.875 ( 1.039 0.979 -1.956) 2.422 16.125 ( 3.345 0.155 1.232) 3.568 16.452 ( 0.655 2.851 2.159) 3.636 16.912 ( -1.592 0.442 -2.615) 3.093 16.942 ( -0.837 2.082 -3.538) 4.190 17.456 ( -2.796 -0.991 6.399) 7.053 18.739 ( -1.127 -5.569 -5.568) 7.956 ======================= Grid point 325 (174/294) ======================= q-point: ( 0.50 0.17 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 868 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.535 ( 10.402 9.552 -3.264) 14.495 1.804 ( -1.004 -2.541 -0.748) 2.832 2.024 ( -4.164 1.297 3.937) 5.875 2.704 ( 2.765 -3.134 1.323) 4.384 3.164 ( 4.941 -5.951 14.834) 16.729 3.362 ( -9.780 3.466 -11.062) 15.167 3.849 ( -2.427 -1.999 -4.287) 5.316 4.270 ( -4.120 -0.654 4.679) 6.269 5.531 ( 1.117 -0.042 -9.787) 9.851 6.423 ( 1.245 -0.590 4.594) 4.797 6.865 ( 2.699 2.845 -0.247) 3.929 7.137 ( -1.070 -2.200 -4.975) 5.544 7.768 ( 2.998 0.943 5.504) 6.338 8.044 ( 2.291 1.630 -0.947) 2.967 8.249 ( 0.004 4.024 -0.588) 4.067 8.711 ( -3.367 -6.136 2.114) 7.311 9.150 ( -3.240 0.440 -2.544) 4.142 9.879 ( -0.517 0.113 -0.031) 0.530 16.213 ( 5.893 1.159 0.859) 6.067 16.462 ( -2.347 2.813 -2.599) 4.492 16.846 ( -0.607 -3.243 -4.040) 5.216 16.995 ( 1.773 4.502 2.952) 5.668 17.396 ( -7.440 -3.439 9.873) 12.832 18.654 ( 1.279 -2.774 -10.741) 11.167 ======================= Grid point 326 (175/294) ======================= q-point: ( 0.58 0.17 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.657 ( -2.597 -1.500 -2.196) 3.717 1.808 ( 9.515 0.733 -9.430) 13.416 1.950 ( -0.740 -5.987 0.760) 6.080 2.715 ( -4.150 4.039 0.027) 5.791 3.222 ( -7.943 1.575 4.932) 9.482 3.255 ( 0.742 3.420 1.408) 3.772 3.841 ( 6.069 -4.221 3.859) 8.339 4.209 ( -4.953 -1.835 5.214) 7.422 5.508 ( 2.609 1.483 -11.615) 11.996 6.459 ( 0.516 -0.891 4.937) 5.043 6.920 ( 1.757 1.768 -0.622) 2.569 7.052 ( -1.224 -3.646 -8.751) 9.559 7.864 ( 3.469 3.341 1.837) 5.154 8.054 ( -2.030 0.051 -3.388) 3.950 8.244 ( -1.077 4.113 -2.881) 5.136 8.612 ( -4.279 -6.127 2.513) 7.884 9.179 ( 3.907 1.683 6.566) 7.824 9.863 ( -1.675 -0.094 0.931) 1.918 16.339 ( 6.563 1.920 1.321) 6.964 16.411 ( -3.360 1.922 -5.572) 6.785 16.798 ( 0.979 -2.909 -3.443) 4.613 17.097 ( 2.381 3.778 5.757) 7.286 17.281 ( -8.503 -4.873 10.931) 14.681 18.598 ( 2.106 -0.202 -13.805) 13.966 ======================= Grid point 327 (176/294) ======================= q-point: (-0.33 0.17 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 868 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.490 ( -4.780 -11.430 -8.187) 14.850 1.863 ( 5.658 -2.075 -5.199) 7.959 1.981 ( 2.371 1.740 -4.275) 5.189 2.632 ( -5.837 2.453 -4.684) 7.876 3.139 ( -10.209 -0.078 15.940) 18.930 3.343 ( 3.286 8.853 -1.352) 9.540 3.981 ( 9.916 -2.856 5.704) 11.791 4.152 ( -2.697 -2.159 4.939) 6.027 5.504 ( 2.790 2.536 -11.520) 12.121 6.479 ( -0.563 -1.115 5.198) 5.346 6.929 ( -1.724 -4.611 -11.660) 12.656 6.950 ( 0.788 1.004 -0.681) 1.446 7.935 ( -5.733 2.096 -8.003) 10.065 7.957 ( 1.173 1.438 0.956) 2.087 8.296 ( 4.755 2.123 -3.671) 6.371 8.494 ( -6.529 -4.084 7.001) 10.408 9.346 ( 7.708 1.862 9.319) 12.236 9.836 ( -2.273 0.284 0.826) 2.435 16.332 ( -3.156 0.531 -6.737) 7.458 16.456 ( 3.247 1.371 3.336) 4.853 16.786 ( 3.089 -1.768 -3.812) 5.215 17.155 ( -6.697 2.032 7.810) 10.487 17.228 ( 3.323 -2.991 9.508) 10.507 18.555 ( 2.050 1.370 -15.125) 15.325 ======================= Grid point 328 (177/294) ======================= q-point: (-0.25 0.17 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.226 ( -4.741 -15.795 -10.077) 19.327 1.827 ( -15.969 5.091 -11.385) 20.262 1.973 ( 7.941 0.124 -4.519) 9.138 2.610 ( 4.283 -4.554 5.261) 8.171 3.075 ( -8.625 0.398 15.276) 17.548 3.513 ( 6.863 10.999 -1.080) 13.010 4.092 ( 1.661 0.179 -0.119) 1.675 4.187 ( 6.382 -2.795 7.325) 10.109 5.511 ( 2.348 3.292 -10.228) 10.998 6.482 ( -1.609 -0.957 5.489) 5.799 6.783 ( -2.147 -4.458 -12.126) 13.097 6.961 ( 0.509 0.660 -1.203) 1.463 7.777 ( -5.752 -2.650 -6.681) 9.206 7.999 ( -0.867 3.383 -0.472) 3.524 8.295 ( -3.190 -3.008 -1.977) 4.810 8.497 ( 3.794 2.066 6.979) 8.208 9.548 ( 8.079 2.084 8.055) 11.598 9.806 ( -2.199 0.854 -0.173) 2.365 16.243 ( -2.724 -0.841 -6.754) 7.331 16.481 ( -3.345 -1.420 5.731) 6.786 16.827 ( 4.987 0.882 -4.443) 6.737 17.140 ( -2.297 2.632 8.304) 9.009 17.326 ( 3.877 -1.714 8.105) 9.146 18.517 ( 2.401 1.768 -15.269) 15.557 ======================= Grid point 329 (178/294) ======================= q-point: (-0.17 0.17 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 868 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.943 ( -5.170 -16.168 -5.494) 17.841 1.440 ( -25.873 6.705 -15.919) 31.109 2.069 ( 2.599 -3.225 2.890) 5.050 2.699 ( 7.093 -7.059 12.777) 16.230 3.069 ( -0.788 3.360 4.688) 5.822 3.755 ( 10.244 11.236 -1.201) 15.252 4.107 ( 0.951 -0.452 -0.076) 1.056 4.292 ( 3.841 -1.249 2.723) 4.871 5.526 ( 2.056 3.792 -8.102) 9.178 6.475 ( -2.153 -0.851 5.800) 6.245 6.645 ( -2.152 -3.099 -10.354) 11.020 6.971 ( 1.052 0.712 -1.344) 1.849 7.634 ( -3.264 -4.500 -5.169) 7.591 7.981 ( -4.802 2.645 0.774) 5.537 8.188 ( -5.028 -5.072 3.446) 7.930 8.655 ( 8.062 4.023 1.375) 9.114 9.729 ( 6.556 2.331 3.925) 7.988 9.782 ( -1.265 1.322 -0.692) 1.956 16.154 ( -2.194 -1.709 -5.731) 6.370 16.413 ( -6.098 -2.593 6.103) 9.009 16.893 ( 3.713 2.329 -3.599) 5.671 17.221 ( 1.311 4.903 8.212) 9.654 17.399 ( 1.771 -1.944 5.941) 6.497 18.497 ( 4.422 0.722 -13.797) 14.506 ======================= Grid point 334 (179/294) ======================= q-point: ( 0.25 0.25 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.898 ( -2.981 -9.489 21.480) 23.671 1.223 ( 9.254 1.159 23.240) 25.041 1.740 ( -3.565 16.642 24.284) 29.655 2.960 ( -4.138 -3.296 -12.457) 13.534 3.199 ( 0.513 3.029 -12.084) 12.468 4.010 ( -1.151 -4.035 -5.568) 6.972 4.106 ( 5.768 -0.462 -2.900) 6.472 4.202 ( -2.646 -2.675 -12.604) 13.154 5.776 ( -0.284 -5.924 -1.283) 6.068 6.410 ( -1.280 -0.421 2.543) 2.878 6.522 ( 1.590 4.283 4.100) 6.138 7.322 ( 0.258 -6.881 10.264) 12.360 7.593 ( -0.648 -3.964 5.899) 7.136 7.827 ( 0.740 6.750 6.339) 9.289 7.892 ( -1.090 5.025 0.512) 5.167 9.136 ( -0.688 -7.033 -4.250) 8.246 9.577 ( 0.710 -2.272 -9.012) 9.321 9.757 ( 0.349 5.018 -8.235) 9.650 16.116 ( -0.304 -3.338 4.107) 5.301 16.277 ( 0.212 4.794 5.783) 7.514 16.963 ( 1.096 -1.854 -3.359) 3.991 17.086 ( 3.472 1.787 -6.314) 7.424 17.269 ( -2.818 8.020 -3.592) 9.229 19.002 ( -1.378 -10.980 3.892) 11.731 ======================= Grid point 335 (180/294) ======================= q-point: ( 0.33 0.25 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.964 ( 5.118 -1.042 14.407) 15.325 1.562 ( 13.185 0.663 18.760) 22.939 1.970 ( -1.135 12.247 18.447) 22.171 2.738 ( -9.353 -1.055 -8.284) 12.538 3.145 ( -0.681 -4.988 -6.361) 8.112 3.933 ( -1.495 -3.797 -10.849) 11.591 4.029 ( -5.661 -0.100 -8.670) 10.355 4.191 ( 5.616 1.987 -3.217) 6.771 5.673 ( -2.613 -7.346 -2.602) 8.220 6.390 ( -1.685 -0.179 3.465) 3.857 6.646 ( 4.392 4.665 2.486) 6.872 7.280 ( -2.841 -6.843 6.876) 10.108 7.610 ( 2.801 -5.546 8.280) 10.353 7.904 ( 2.620 2.005 -1.395) 3.582 7.984 ( 0.787 8.822 6.786) 11.158 9.006 ( -3.239 -7.423 -3.109) 8.676 9.489 ( -4.743 1.163 -8.590) 9.881 9.787 ( 3.505 3.382 -7.354) 8.821 16.095 ( -0.964 -2.542 3.465) 4.404 16.381 ( 2.458 4.250 5.454) 7.338 16.938 ( 0.337 -1.612 -3.413) 3.789 17.072 ( -4.368 6.125 -7.492) 10.617 17.357 ( 6.222 5.373 -2.640) 8.635 18.845 ( -4.702 -14.345 4.022) 15.622 ======================= Grid point 336 (181/294) ======================= q-point: ( 0.42 0.25 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.176 ( 10.012 5.328 5.462) 12.588 1.798 ( 4.768 -1.568 7.166) 8.749 2.101 ( 0.045 -0.838 7.218) 7.267 2.629 ( -2.771 5.856 2.588) 6.976 3.066 ( -0.199 -5.419 5.034) 7.399 3.708 ( -9.980 -3.499 -11.662) 15.743 3.953 ( -1.998 0.805 -8.051) 8.334 4.282 ( 3.879 2.931 -1.532) 5.097 5.541 ( -1.990 -6.981 -5.332) 9.007 6.401 ( -0.070 0.437 4.559) 4.581 6.760 ( 3.508 3.836 0.499) 5.222 7.199 ( -2.793 -5.903 2.458) 6.977 7.661 ( 3.758 -5.320 8.199) 10.471 7.959 ( 2.747 2.264 -1.675) 3.934 8.126 ( 3.942 5.185 4.808) 8.096 8.870 ( -4.530 -5.559 -0.922) 7.230 9.358 ( -7.644 3.625 -7.610) 11.379 9.835 ( 3.239 1.668 -4.317) 5.649 16.092 ( 1.090 -1.437 2.465) 3.055 16.479 ( 1.446 3.449 3.269) 4.967 16.889 ( -1.070 -3.070 -5.605) 6.479 17.029 ( -3.973 8.216 -2.921) 9.582 17.478 ( 3.549 2.498 0.884) 4.430 18.658 ( -2.799 -13.508 -0.241) 13.797 ======================= Grid point 337 (182/294) ======================= q-point: ( 0.50 0.25 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.420 ( 10.578 7.028 -1.325) 12.769 1.782 ( -2.331 -5.076 -1.288) 5.732 2.027 ( -2.111 -12.076 -2.224) 12.459 2.766 ( 1.748 12.253 8.404) 14.961 3.118 ( 3.678 -3.260 14.165) 14.994 3.467 ( -8.473 0.032 -10.550) 13.531 3.861 ( -3.923 -0.466 -5.802) 7.019 4.333 ( -0.637 0.735 2.375) 2.567 5.431 ( 0.942 -4.844 -9.251) 10.485 6.442 ( 0.534 0.956 5.278) 5.390 6.838 ( 2.748 2.328 -1.425) 3.873 7.107 ( -2.277 -5.745 -1.409) 6.338 7.730 ( 4.578 -2.752 5.590) 7.731 8.013 ( 2.486 1.723 -1.355) 3.314 8.244 ( 3.730 2.057 0.090) 4.261 8.743 ( -5.364 -4.298 1.499) 7.035 9.249 ( -6.595 5.698 -2.700) 9.124 9.868 ( 1.659 0.478 -1.484) 2.276 16.138 ( 4.226 -0.399 1.654) 4.556 16.515 ( -1.854 3.323 -1.434) 4.067 16.796 ( -1.131 -4.295 -5.252) 6.878 17.069 ( -0.989 8.178 2.504) 8.610 17.511 ( -2.946 -1.259 6.464) 7.214 18.513 ( 1.426 -9.594 -7.689) 12.378 ======================= Grid point 338 (183/294) ======================= q-point: ( 0.58 0.25 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.609 ( 8.049 1.315 -8.581) 11.839 1.672 ( -3.296 -4.259 -0.765) 5.439 1.857 ( 0.353 -12.412 -0.887) 12.449 2.889 ( -6.041 11.933 -0.678) 13.392 3.239 ( 4.149 -3.248 11.653) 12.789 3.352 ( -1.711 3.428 -3.925) 5.485 3.788 ( -1.651 -0.242 2.076) 2.664 4.302 ( -4.665 -2.208 5.499) 7.542 5.380 ( 4.074 -1.678 -12.001) 12.785 6.489 ( 0.014 1.092 5.604) 5.710 6.874 ( 2.298 -0.212 -5.149) 5.642 7.005 ( -2.104 -4.888 -2.554) 5.903 7.825 ( 5.353 0.560 2.389) 5.888 8.049 ( 1.000 0.814 -1.493) 1.973 8.264 ( -0.798 1.449 -6.817) 7.014 8.642 ( -3.794 -4.981 5.032) 8.033 9.239 ( -2.122 6.529 4.333) 8.118 9.880 ( -0.009 -0.267 0.452) 0.525 16.240 ( 7.068 0.351 1.308) 7.197 16.465 ( -4.572 2.423 -5.754) 7.738 16.732 ( 0.884 -3.986 -2.581) 4.831 17.162 ( 0.139 7.090 6.058) 9.326 17.440 ( -7.894 -3.892 9.781) 13.158 18.435 ( 4.659 -5.044 -13.767) 15.384 ======================= Grid point 339 (184/294) ======================= q-point: (-0.33 0.25 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.442 ( -6.969 -11.294 -5.411) 14.332 1.709 ( 5.635 -1.292 -4.631) 7.407 1.880 ( 7.796 -2.281 0.687) 8.152 2.790 ( -11.558 7.299 -9.902) 16.879 3.309 ( 0.974 -0.769 6.094) 6.219 3.374 ( -0.945 2.420 3.368) 4.254 3.862 ( 5.840 1.059 8.702) 10.534 4.226 ( -5.053 -2.625 5.918) 8.212 5.386 ( 5.233 1.044 -11.887) 13.030 6.524 ( -0.925 1.079 5.609) 5.786 6.816 ( -0.118 -5.072 -11.187) 12.284 6.954 ( -0.213 -0.762 0.359) 0.869 7.929 ( 4.214 1.425 -0.282) 4.458 8.012 ( -4.926 2.348 -5.766) 7.939 8.223 ( 1.422 0.941 -6.862) 7.071 8.578 ( -3.304 -5.162 8.422) 10.416 9.341 ( 2.874 5.196 8.076) 10.024 9.869 ( -1.239 -0.738 1.116) 1.823 16.349 ( -0.819 -0.342 -5.031) 5.108 16.397 ( 4.265 1.648 0.453) 4.594 16.711 ( 1.614 -2.470 -2.047) 3.591 17.255 ( -0.937 0.318 9.897) 9.946 17.333 ( -7.189 1.693 7.652) 10.635 18.398 ( 5.296 -2.111 -16.363) 17.328 ======================= Grid point 340 (185/294) ======================= q-point: (-0.25 0.25 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.192 ( -9.007 -8.524 -1.312) 12.470 1.794 ( 9.075 -0.468 -3.750) 9.830 1.955 ( 0.290 1.465 -5.055) 5.271 2.606 ( -7.403 1.426 -6.559) 9.993 3.290 ( -8.306 -4.449 15.845) 18.435 3.445 ( 7.914 3.494 -6.007) 10.532 4.043 ( 7.396 2.175 6.529) 10.103 4.177 ( -2.710 -0.861 5.523) 6.212 5.425 ( 4.654 3.036 -9.964) 11.408 6.546 ( -1.826 1.418 5.751) 6.198 6.688 ( -1.000 -4.890 -11.529) 12.563 6.954 ( 0.340 -0.226 -0.402) 0.573 7.835 ( -7.652 -1.488 -7.414) 10.758 8.029 ( 0.910 5.461 -2.042) 5.901 8.244 ( 3.503 0.057 -5.661) 6.658 8.540 ( -2.023 -4.020 10.708) 11.616 9.503 ( 5.761 3.494 7.904) 10.386 9.840 ( -1.776 -1.205 0.506) 2.205 16.250 ( -3.740 -0.661 -6.383) 7.428 16.514 ( 2.938 -0.776 5.511) 6.293 16.723 ( 4.365 -0.025 -3.891) 5.848 17.215 ( -2.988 -4.949 9.809) 11.386 17.387 ( -1.399 7.448 6.813) 10.191 18.370 ( 4.575 -0.436 -16.950) 17.562 ======================= Grid point 341 (186/294) ======================= q-point: (-0.17 0.25 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.996 ( -10.266 -1.749 6.817) 12.447 1.787 ( -17.868 6.493 -13.393) 23.255 1.940 ( 10.209 -0.168 -2.289) 10.464 2.575 ( 6.001 -5.018 4.266) 8.910 3.166 ( -8.490 -7.079 10.145) 15.004 3.617 ( 12.847 3.064 -4.698) 14.018 4.149 ( -2.167 4.053 2.254) 5.119 4.221 ( 5.726 -1.191 4.692) 7.498 5.475 ( 3.395 4.485 -7.753) 9.579 6.532 ( -3.262 -2.613 -0.165) 4.182 6.601 ( -0.160 1.892 -3.449) 3.937 6.955 ( 0.614 -0.044 -0.889) 1.082 7.657 ( -6.802 -1.754 -6.450) 9.537 8.055 ( -1.670 3.660 -1.461) 4.280 8.229 ( -2.067 -2.328 -0.834) 3.223 8.587 ( 4.418 -0.666 6.407) 7.811 9.669 ( 5.995 2.174 5.066) 8.144 9.799 ( -1.119 -1.479 -0.537) 1.931 16.153 ( -3.143 -0.738 -5.139) 6.069 16.510 ( -4.224 -2.880 6.168) 8.011 16.814 ( 6.552 2.513 -3.587) 7.881 17.229 ( 2.734 -3.246 8.605) 9.595 17.461 ( -1.628 5.017 6.137) 8.093 18.346 ( 4.047 1.220 -16.144) 16.688 ======================= Grid point 346 (187/294) ======================= q-point: ( 0.25 0.33 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.003 ( -4.270 -3.930 18.163) 19.067 1.301 ( -5.055 -6.030 22.718) 24.042 2.043 ( -1.631 11.268 12.622) 16.998 2.896 ( 5.452 7.778 -4.394) 10.465 3.197 ( -4.310 0.281 -10.500) 11.354 3.858 ( 5.480 -10.028 -13.155) 17.425 3.982 ( 4.452 -0.699 -3.388) 5.638 4.200 ( -3.781 0.739 -4.783) 6.142 5.689 ( 2.094 -6.409 -2.074) 7.054 6.420 ( 1.663 1.177 3.551) 4.094 6.603 ( -4.005 2.542 2.770) 5.493 7.275 ( 2.728 -7.104 7.424) 10.632 7.640 ( -3.707 -2.768 6.872) 8.284 7.862 ( -1.044 1.018 -0.094) 1.461 8.033 ( -2.403 9.166 5.413) 10.913 9.025 ( 2.753 -7.076 -3.545) 8.380 9.452 ( 5.677 -0.348 -9.706) 11.250 9.784 ( -3.172 3.277 -5.935) 7.485 16.111 ( 0.341 -1.549 3.714) 4.039 16.371 ( -1.821 3.604 5.501) 6.824 16.877 ( 1.820 -3.235 -4.556) 5.877 17.020 ( 3.168 2.664 -4.151) 5.862 17.395 ( -4.809 5.672 -2.404) 7.815 18.905 ( 2.532 -10.270 1.774) 10.725 ======================= Grid point 347 (188/294) ======================= q-point: ( 0.33 0.33 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 868 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.997 ( -1.082 -4.349 18.444) 18.981 1.469 ( 9.992 -2.057 21.097) 23.434 2.145 ( -1.578 3.694 3.717) 5.473 2.920 ( -11.308 7.190 -1.797) 13.520 3.085 ( 0.510 0.823 -5.533) 5.617 3.789 ( 4.744 -6.771 -11.794) 14.403 4.052 ( 2.053 0.389 -4.412) 4.882 4.108 ( -0.674 1.787 -5.954) 6.253 5.610 ( -1.046 -9.080 -2.302) 9.425 6.438 ( -1.705 -0.078 3.004) 3.455 6.649 ( 2.334 4.276 3.509) 6.003 7.267 ( 0.253 -10.403 8.775) 13.611 7.595 ( -1.850 -3.168 6.118) 7.134 7.879 ( 1.693 1.781 -1.302) 2.781 8.095 ( -1.461 5.645 2.578) 6.375 8.957 ( -0.662 -5.840 -1.433) 6.049 9.496 ( 2.251 2.988 -5.816) 6.915 9.743 ( -0.527 3.703 -8.230) 9.040 16.108 ( -0.944 -2.651 4.161) 5.023 16.435 ( 0.397 5.037 5.126) 7.197 16.854 ( 2.746 -4.024 -5.709) 7.505 17.101 ( 3.360 6.134 -4.362) 8.243 17.368 ( -2.467 7.000 -4.301) 8.578 18.786 ( -2.810 -16.414 4.030) 17.133 ======================= Grid point 348 (189/294) ======================= q-point: ( 0.42 0.33 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.125 ( 6.264 2.501 11.420) 13.262 1.716 ( 8.549 -4.211 13.899) 16.852 2.086 ( -3.303 -6.299 -4.124) 8.222 2.777 ( -5.734 0.802 -0.814) 5.847 3.132 ( -2.687 9.263 7.642) 12.306 3.702 ( -1.984 -5.174 -10.690) 12.041 3.965 ( -3.911 1.697 -6.280) 7.590 4.203 ( 7.276 3.923 -4.729) 9.523 5.471 ( -2.464 -10.114 -3.223) 10.897 6.437 ( -0.621 0.349 4.359) 4.417 6.749 ( 2.803 3.563 1.330) 4.725 7.193 ( -2.229 -10.153 5.656) 11.834 7.600 ( 2.040 -4.336 6.717) 8.251 7.926 ( 2.628 2.145 -1.726) 3.806 8.134 ( 1.515 1.735 -0.205) 2.313 8.889 ( -2.841 -2.757 1.277) 4.160 9.481 ( -5.412 6.019 -4.276) 9.154 9.758 ( 4.031 2.369 -6.686) 8.159 16.090 ( -0.731 -2.217 3.529) 4.231 16.519 ( 0.605 4.561 3.762) 5.944 16.815 ( 1.474 -4.430 -7.071) 8.473 17.154 ( -2.390 8.344 -2.351) 8.992 17.426 ( 4.696 5.491 -3.839) 8.182 18.581 ( -4.436 -18.167 3.785) 19.080 ======================= Grid point 349 (190/294) ======================= q-point: ( 0.50 0.33 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 868 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.336 ( 7.926 5.856 4.402) 10.793 1.768 ( -1.175 -6.234 2.473) 6.809 1.911 ( -3.024 -12.560 -5.525) 14.051 2.814 ( 6.539 0.542 8.618) 10.832 3.221 ( -3.376 8.821 6.793) 11.635 3.517 ( -7.621 -2.334 -9.944) 12.744 3.907 ( -3.177 3.299 -2.418) 5.180 4.321 ( 4.642 3.142 -1.931) 5.929 5.320 ( -1.086 -9.171 -5.631) 10.817 6.475 ( 0.660 1.069 5.471) 5.614 6.811 ( 1.669 1.562 -1.430) 2.697 7.083 ( -2.631 -8.470 1.739) 9.038 7.651 ( 4.415 -3.511 5.204) 7.675 7.980 ( 2.677 1.887 -1.602) 3.646 8.179 ( 3.938 -1.007 -1.273) 4.260 8.814 ( -5.203 -1.519 1.485) 5.620 9.418 ( -7.264 8.080 -1.981) 11.044 9.817 ( 3.924 1.220 -3.088) 5.140 16.095 ( 1.491 -1.269 2.583) 3.241 16.569 ( -1.183 3.917 0.318) 4.104 16.734 ( -0.523 -4.901 -7.023) 8.580 17.195 ( -2.129 9.261 2.552) 9.840 17.530 ( 3.524 2.515 -0.249) 4.336 18.367 ( -2.114 -16.119 -1.322) 16.311 ======================= Grid point 350 (191/294) ======================= q-point: ( 0.58 0.33 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.503 ( 3.967 4.091 -2.520) 6.231 1.674 ( -2.446 -5.631 0.219) 6.144 1.722 ( -0.379 -12.669 -1.787) 12.800 3.015 ( 6.105 3.829 6.178) 9.492 3.243 ( -1.489 0.245 3.035) 3.389 3.334 ( -4.864 -0.266 -10.632) 11.695 3.904 ( -4.191 6.660 6.257) 10.054 4.369 ( -1.314 -0.198 3.358) 3.612 5.222 ( 3.253 -5.311 -9.139) 11.059 6.532 ( 0.578 1.463 5.737) 5.949 6.809 ( 0.344 -1.939 -5.128) 5.494 6.985 ( -1.690 -4.932 0.123) 5.215 7.737 ( 6.099 -1.197 2.356) 6.647 8.026 ( 2.034 1.255 -1.285) 2.714 8.213 ( 2.776 -1.582 -3.310) 4.601 8.711 ( -6.027 -2.201 1.848) 6.677 9.393 ( -5.094 8.419 2.018) 10.045 9.862 ( 1.980 0.039 -0.446) 2.030 16.150 ( 4.670 -0.386 1.694) 4.983 16.533 ( -4.991 2.319 -6.234) 8.316 16.667 ( 1.141 -3.650 -1.420) 4.080 17.283 ( -1.114 8.247 6.715) 10.693 17.558 ( -3.211 -0.969 5.614) 6.540 18.216 ( 3.622 -10.654 -10.192) 15.182 ======================= Grid point 351 (192/294) ======================= q-point: ( 0.67 0.33 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 868 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.443 ( -5.340 -4.539 -2.487) 7.437 1.618 ( 1.297 -3.695 -0.254) 3.924 1.731 ( 7.333 -2.779 1.193) 7.932 2.992 ( -11.097 6.630 -10.808) 16.850 3.250 ( 2.332 -1.140 -10.037) 10.367 3.334 ( 7.751 -4.741 11.579) 14.719 3.954 ( -3.620 5.473 11.516) 13.254 4.325 ( -5.105 -1.782 5.814) 7.940 5.226 ( 6.848 -0.140 -10.057) 12.168 6.578 ( -0.184 1.135 4.120) 4.277 6.734 ( -1.492 -3.320 -6.537) 7.481 6.943 ( 0.067 -1.975 -0.245) 1.992 7.844 ( 6.312 0.174 -0.853) 6.372 8.048 ( -0.018 1.348 -1.791) 2.241 8.193 ( -0.712 0.711 -6.480) 6.558 8.619 ( -3.464 -4.627 5.625) 8.065 9.433 ( -1.628 7.030 4.948) 8.750 9.873 ( 0.073 -1.494 0.681) 1.643 16.254 ( 6.982 -0.045 0.549) 7.003 16.421 ( -4.697 0.597 -5.668) 7.386 16.662 ( 1.173 -1.422 -0.332) 1.873 17.357 ( -3.161 0.240 10.993) 11.441 17.502 ( -5.933 3.026 5.556) 8.673 18.165 ( 7.538 -4.804 -15.307) 17.726 ======================= Grid point 352 (193/294) ======================= q-point: (-0.25 0.33 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.313 ( -7.959 0.252 4.390) 9.093 1.640 ( 5.672 -1.449 -3.025) 6.590 1.850 ( 8.301 -1.321 0.275) 8.410 2.764 ( -13.385 3.985 -12.276) 18.594 3.265 ( 7.927 -2.622 -7.957) 11.534 3.419 ( -1.694 -4.857 12.150) 13.194 4.021 ( 1.568 0.287 9.864) 9.992 4.271 ( -4.141 1.184 3.569) 5.593 5.307 ( 6.947 3.565 -7.867) 11.084 6.587 ( 0.331 -0.440 -4.491) 4.525 6.653 ( -3.555 0.220 1.585) 3.899 6.934 ( 0.909 -1.276 -0.808) 1.763 7.870 ( -2.141 -1.888 -5.370) 6.082 8.060 ( 0.736 6.543 -3.264) 7.349 8.167 ( 1.298 0.649 -4.901) 5.112 8.574 ( -1.215 -6.441 9.120) 11.231 9.524 ( 1.758 5.003 6.056) 8.049 9.844 ( -1.134 -3.332 0.222) 3.527 16.274 ( -3.286 -0.179 -5.466) 6.380 16.438 ( 7.390 0.229 2.948) 7.959 16.666 ( 0.814 -0.331 -1.223) 1.506 17.292 ( -5.766 -6.472 10.377) 13.521 17.528 ( -2.571 7.261 3.909) 8.638 18.176 ( 7.052 -0.079 -14.826) 16.418 ======================= Grid point 353 (194/294) ======================= q-point: (-0.17 0.33 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 868 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.254 ( -9.045 7.701 11.187) 16.317 1.743 ( 10.179 0.376 -4.980) 11.338 1.928 ( -0.052 2.354 -5.472) 5.957 2.541 ( -7.135 0.036 -6.058) 9.360 3.289 ( -5.192 -11.697 8.517) 15.373 3.400 ( 7.508 -0.288 -0.744) 7.551 4.131 ( 6.149 -0.426 4.883) 7.864 4.242 ( -2.866 1.532 -0.010) 3.250 5.412 ( 5.141 5.565 -5.822) 9.555 6.523 ( -2.276 -1.148 -6.230) 6.732 6.663 ( -1.040 4.552 4.858) 6.738 6.934 ( 0.940 -0.846 -0.900) 1.552 7.729 ( -7.403 -0.681 -6.377) 9.794 8.109 ( -1.358 5.349 -2.355) 6.000 8.190 ( 3.416 0.642 -4.010) 5.307 8.565 ( 1.011 -5.895 9.536) 11.257 9.644 ( 3.704 3.030 5.447) 7.250 9.781 ( -1.044 -4.865 -1.393) 5.167 16.184 ( -3.931 0.619 -4.293) 5.854 16.553 ( 1.416 -2.382 6.491) 7.058 16.697 ( 6.002 1.981 -3.869) 7.410 17.228 ( -1.526 -4.933 8.284) 9.761 17.552 ( -2.002 1.540 1.091) 2.752 18.221 ( 4.730 5.592 -11.667) 13.776 ======================= Grid point 358 (195/294) ======================= q-point: ( 0.25 0.42 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.173 ( -7.258 1.699 10.377) 12.776 1.506 ( -13.338 -10.141 19.182) 25.470 2.110 ( 3.885 1.617 0.147) 4.211 2.919 ( 6.719 15.853 0.329) 17.221 3.213 ( -1.955 1.842 -0.012) 2.686 3.555 ( 8.421 -11.630 -13.393) 19.635 3.894 ( 2.138 -1.847 -4.732) 5.511 4.255 ( -3.608 0.608 -1.350) 3.900 5.576 ( 2.492 -5.249 -3.968) 7.037 6.435 ( 1.038 1.933 4.314) 4.839 6.709 ( -4.981 1.543 1.119) 5.333 7.204 ( 2.260 -5.474 3.030) 6.652 7.715 ( -2.500 -1.715 7.499) 8.089 7.906 ( -4.201 0.175 -0.709) 4.264 8.157 ( -1.993 3.962 1.160) 4.585 8.900 ( 4.110 -3.707 -0.066) 5.535 9.296 ( 6.923 1.067 -8.026) 10.653 9.833 ( -2.892 1.708 -3.561) 4.895 16.131 ( -1.108 0.617 2.975) 3.234 16.435 ( -0.155 0.856 1.843) 2.038 16.834 ( -2.563 -2.756 -2.193) 4.356 16.976 ( 3.264 3.829 -2.763) 5.740 17.481 ( -1.611 1.172 1.975) 2.806 18.762 ( 3.656 -7.633 -3.378) 9.113 ======================= Grid point 359 (196/294) ======================= q-point: ( 0.33 0.42 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.131 ( -6.483 -3.264 16.979) 18.465 1.458 ( 2.109 -4.027 19.411) 19.936 2.147 ( 1.062 -1.473 -4.117) 4.499 3.032 ( -4.854 -3.738 -9.767) 11.530 3.209 ( -2.643 16.128 6.859) 17.724 3.529 ( 9.732 -7.821 -11.436) 16.931 3.948 ( 6.199 1.533 -2.301) 6.788 4.168 ( -5.997 1.478 -4.305) 7.529 5.515 ( 0.359 -8.819 -2.629) 9.209 6.476 ( -0.683 0.066 3.609) 3.674 6.691 ( -0.747 3.201 2.566) 4.170 7.193 ( 1.741 -9.801 5.881) 11.561 7.671 ( -5.028 -2.311 6.855) 8.810 7.871 ( -0.123 1.248 -1.500) 1.955 8.140 ( -1.039 -0.542 -3.455) 3.649 8.921 ( 0.907 -1.518 2.295) 2.897 9.412 ( 7.625 4.949 -4.993) 10.371 9.775 ( -3.584 2.961 -5.587) 7.268 16.129 ( -1.245 -1.445 4.060) 4.486 16.488 ( 2.257 3.866 1.608) 4.756 16.759 ( -0.745 -3.774 -3.935) 5.503 17.075 ( 4.206 6.451 -1.347) 7.818 17.458 ( -3.549 3.784 -2.198) 5.635 18.673 ( -0.082 -15.107 0.093) 15.108 ======================= Grid point 360 (197/294) ======================= q-point: ( 0.42 0.42 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.159 ( 0.749 0.489 15.093) 15.119 1.624 ( 7.529 -4.700 15.699) 18.034 2.060 ( -3.728 -5.284 -6.295) 9.025 2.815 ( -6.336 -6.577 -5.206) 10.512 3.303 ( -0.748 4.401 -1.517) 4.715 3.621 ( 4.319 7.254 -0.996) 8.501 4.027 ( -3.253 2.135 -3.689) 5.362 4.090 ( 4.511 3.553 -6.001) 8.306 5.394 ( -2.011 -11.066 -1.769) 11.385 6.474 ( -0.908 -0.732 4.388) 4.540 6.751 ( 1.784 2.989 1.601) 3.831 7.138 ( -0.062 -11.712 5.510) 12.944 7.616 ( -3.081 -2.255 6.174) 7.259 7.895 ( 2.127 1.803 -1.774) 3.305 8.098 ( 0.900 -2.107 -4.069) 4.670 8.924 ( -1.496 -0.235 2.639) 3.043 9.554 ( 4.067 6.951 -1.020) 8.117 9.713 ( -2.319 3.287 -7.645) 8.638 16.111 ( -1.573 -2.183 4.106) 4.909 16.578 ( 1.506 5.660 1.132) 5.965 16.695 ( 1.320 -4.942 -5.680) 7.643 17.205 ( 3.735 7.167 0.352) 8.090 17.431 ( -1.825 5.344 -4.584) 7.273 18.490 ( -3.174 -18.905 2.689) 19.357 ======================= Grid point 361 (198/294) ======================= q-point: ( 0.50 0.42 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.314 ( 5.811 3.405 9.936) 12.003 1.703 ( 1.317 -8.920 4.271) 9.977 1.885 ( -6.645 -5.709 -3.746) 9.528 2.731 ( 4.375 -4.839 4.720) 8.052 3.275 ( 0.530 -3.563 -7.877) 8.662 3.668 ( -10.202 10.465 -1.850) 14.731 3.996 ( -1.571 6.863 2.598) 7.505 4.221 ( 8.733 4.344 -5.760) 11.327 5.233 ( -2.793 -11.888 -1.614) 12.318 6.499 ( 0.930 -0.351 5.755) 5.840 6.794 ( 0.783 0.548 -1.063) 1.430 7.046 ( -1.450 -9.457 2.895) 9.996 7.607 ( 0.705 -2.183 4.839) 5.355 7.944 ( 2.699 1.674 -1.467) 3.498 8.094 ( 3.171 -2.245 -1.913) 4.330 8.889 ( -3.920 -0.260 0.810) 4.012 9.598 ( -6.248 7.989 -1.274) 10.221 9.734 ( 5.530 2.538 -4.145) 7.362 16.093 ( -0.686 -1.754 3.419) 3.904 16.636 ( -1.328 5.252 0.159) 5.420 16.637 ( 1.446 -4.802 -6.805) 8.454 17.319 ( 0.186 7.489 4.343) 8.659 17.472 ( 4.201 5.239 -5.165) 8.472 18.260 ( -4.279 -19.279 2.123) 19.862 ======================= Grid point 362 (199/294) ======================= q-point: ( 0.58 0.42 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.490 ( 5.800 2.796 5.626) 8.550 1.591 ( -2.465 -9.639 -1.472) 10.057 1.716 ( -6.429 -4.238 -0.404) 7.711 2.891 ( 12.226 -3.151 9.925) 16.060 3.174 ( -0.232 -6.335 -10.342) 12.130 3.516 ( -13.387 8.352 -8.510) 17.927 4.082 ( -2.869 8.412 8.837) 12.533 4.364 ( 5.244 4.188 -1.148) 6.808 5.085 ( 0.058 -9.729 -3.379) 10.299 6.555 ( 1.631 -0.275 6.070) 6.291 6.769 ( -0.803 -2.219 -3.573) 4.282 6.966 ( -1.274 -4.691 0.796) 4.925 7.652 ( 4.057 -1.289 2.399) 4.886 7.993 ( 2.508 1.206 -1.147) 3.010 8.127 ( 3.789 -2.376 0.090) 4.473 8.802 ( -6.017 -0.560 -1.023) 6.129 9.562 ( -5.389 7.379 -0.961) 9.187 9.818 ( 3.400 1.242 -0.678) 3.682 16.104 ( 1.692 -0.839 2.447) 3.091 16.562 ( -1.636 -2.104 -7.510) 7.969 16.647 ( -1.510 2.463 0.647) 2.961 17.416 ( -0.836 6.109 8.374) 10.399 17.576 ( 4.257 5.245 -2.406) 7.171 18.030 ( -1.979 -16.739 -3.200) 17.156 ======================= Grid point 363 (200/294) ======================= q-point: ( 0.67 0.42 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.475 ( -2.561 -4.195 0.350) 4.928 1.604 ( -0.056 -4.315 2.140) 4.817 1.621 ( 2.102 1.616 2.855) 3.896 3.045 ( -0.783 -5.796 -10.682) 12.178 3.112 ( 9.376 -2.601 5.678) 11.265 3.344 ( -8.194 7.406 -7.818) 13.532 4.134 ( -4.483 3.353 9.510) 11.036 4.414 ( -3.035 0.055 3.864) 4.914 5.057 ( 6.864 -1.663 -5.558) 8.987 6.588 ( 0.048 -1.802 1.290) 2.217 6.728 ( -0.700 0.703 -0.267) 1.028 6.918 ( -0.509 -2.892 -0.797) 3.043 7.736 ( 5.983 -0.220 -0.384) 5.999 8.032 ( 1.841 0.835 -1.056) 2.281 8.160 ( 2.039 -1.298 -0.168) 2.423 8.685 ( -6.047 -1.627 -0.159) 6.264 9.558 ( -3.128 6.467 1.024) 7.256 9.851 ( 0.951 -1.618 0.180) 1.885 16.163 ( 4.597 0.008 1.384) 4.801 16.465 ( -3.982 -0.320 -5.397) 6.714 16.652 ( -0.337 1.266 0.426) 1.378 17.471 ( -3.278 -2.338 11.692) 12.366 17.643 ( -3.598 5.465 2.087) 6.868 17.903 ( 7.784 -6.607 -11.736) 15.556 ======================= Grid point 364 (201/294) ======================= q-point: (-0.25 0.42 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.429 ( -1.005 -0.317 0.831) 1.341 1.584 ( -0.928 1.303 2.541) 3.002 1.722 ( 6.424 -0.366 3.025) 7.110 2.899 ( -6.311 -1.897 -9.781) 11.794 3.115 ( -0.414 -0.224 -7.285) 7.300 3.404 ( 5.765 0.784 4.864) 7.584 4.106 ( -5.343 -3.516 11.137) 12.843 4.347 ( -3.934 -1.860 -0.391) 4.370 5.184 ( 8.614 5.035 -3.890) 10.709 6.559 ( -0.620 0.207 -3.541) 3.601 6.739 ( -2.372 2.455 4.171) 5.390 6.890 ( 1.392 -2.462 -1.639) 3.269 7.815 ( 3.866 -0.044 -2.884) 4.823 8.060 ( 1.726 1.550 -1.760) 2.912 8.165 ( -0.536 1.682 -2.039) 2.696 8.590 ( -3.197 -4.373 3.969) 6.716 9.593 ( -0.645 5.207 2.737) 5.918 9.820 ( -0.858 -4.898 -0.263) 4.980 16.253 ( 4.101 0.644 -1.027) 4.276 16.387 ( -1.231 0.344 -1.303) 1.825 16.663 ( -0.178 1.277 0.241) 1.312 17.388 ( -6.761 -8.328 9.926) 14.615 17.615 ( -1.746 0.072 -2.557) 3.097 18.004 ( 8.423 6.901 -7.150) 13.027 ======================= Grid point 365 (202/294) ======================= q-point: (-0.17 0.42 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.452 ( 1.651 3.592 1.153) 4.118 1.619 ( 1.194 3.614 0.356) 3.822 1.854 ( 6.673 1.817 0.793) 6.961 2.692 ( -12.288 2.528 -7.174) 14.452 3.130 ( 7.530 -4.206 -1.645) 8.780 3.448 ( -3.658 -4.379 6.808) 8.883 4.083 ( 1.285 -3.395 7.939) 8.729 4.260 ( -2.059 -3.108 -5.512) 6.654 5.350 ( 6.538 6.932 -2.970) 9.981 6.536 ( -1.985 2.177 -3.147) 4.311 6.749 ( -1.339 3.741 3.263) 5.142 6.897 ( 1.886 -1.120 -0.716) 2.307 7.794 ( -3.980 0.476 -3.908) 5.598 8.112 ( 3.857 0.860 -3.149) 5.053 8.168 ( -0.706 5.769 -2.533) 6.340 8.543 ( -0.221 -7.030 7.613) 10.365 9.663 ( 1.588 3.828 3.728) 5.574 9.732 ( -1.689 -7.783 -1.646) 8.132 16.238 ( -3.611 1.931 -3.183) 5.186 16.471 ( 8.146 -0.569 3.231) 8.782 16.668 ( -0.745 1.671 -0.746) 1.976 17.266 ( -4.070 -6.817 5.970) 9.934 17.551 ( -1.250 -5.144 -3.642) 6.426 18.178 ( 5.273 12.226 -4.112) 13.935 ======================= Grid point 370 (203/294) ======================= q-point: ( 0.25 0.50 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.377 ( -9.705 2.871 3.721) 10.783 1.718 ( -11.040 -8.612 10.924) 17.759 2.034 ( 3.932 -0.729 0.028) 3.999 2.890 ( 10.033 11.167 -5.140) 15.868 3.232 ( 4.951 -11.393 -10.392) 16.196 3.324 ( -0.141 3.361 6.644) 7.447 3.843 ( 0.286 1.129 -1.355) 1.786 4.293 ( -0.462 -1.121 2.972) 3.209 5.474 ( 0.907 -3.170 -7.277) 7.989 6.470 ( 0.258 2.224 4.327) 4.872 6.802 ( -4.499 1.068 -0.155) 4.627 7.133 ( 1.770 -4.172 -1.347) 4.728 7.772 ( -1.608 -0.780 4.774) 5.097 7.988 ( -5.077 0.491 0.396) 5.116 8.169 ( -1.050 -3.877 -4.581) 6.092 8.826 ( 5.055 0.412 2.227) 5.539 9.187 ( 4.315 3.683 -1.481) 5.863 9.862 ( -1.316 0.187 -1.445) 1.964 16.194 ( -3.259 2.014 2.169) 4.403 16.418 ( 1.013 -1.324 -2.674) 3.151 16.838 ( -1.214 -2.589 -2.815) 4.013 16.992 ( -0.379 6.182 2.699) 6.756 17.489 ( 2.763 -2.882 7.119) 8.162 18.615 ( 2.110 -5.030 -9.803) 11.218 ======================= Grid point 371 (204/294) ======================= q-point: ( 0.33 0.50 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 868 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.308 ( -6.567 0.011 10.408) 12.306 1.550 ( -6.649 -6.731 15.428) 18.098 2.077 ( 2.348 -1.030 -4.060) 4.802 3.003 ( -0.882 -2.102 -8.128) 8.441 3.208 ( 8.794 -8.786 -10.613) 16.345 3.379 ( 3.421 9.882 1.463) 10.559 3.909 ( 2.257 5.335 4.970) 7.633 4.258 ( -4.781 1.360 -0.839) 5.041 5.408 ( 0.786 -7.175 -4.447) 8.478 6.507 ( -0.560 0.248 3.687) 3.737 6.755 ( -2.650 2.138 0.773) 3.491 7.104 ( 1.594 -8.094 1.766) 8.437 7.758 ( -2.449 -1.688 5.388) 6.155 7.906 ( -4.642 0.323 -0.230) 4.658 8.090 ( 0.097 -4.111 -6.139) 7.389 8.907 ( 2.919 0.252 2.006) 3.551 9.327 ( 6.489 7.455 -0.885) 9.923 9.826 ( -2.567 1.626 -2.823) 4.147 16.171 ( -2.387 -0.469 3.261) 4.068 16.443 ( 4.038 1.166 -3.458) 5.443 16.760 ( -3.050 -2.370 -1.702) 4.221 17.094 ( 1.844 8.170 2.935) 8.875 17.514 ( -1.056 -0.348 2.443) 2.684 18.514 ( 1.210 -12.314 -6.224) 13.850 ======================= Grid point 372 (205/294) ======================= q-point: ( 0.42 0.50 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.274 ( -4.288 -0.416 12.447) 13.171 1.577 ( 3.401 -4.476 14.556) 15.604 2.031 ( -1.683 -3.449 -5.352) 6.586 2.829 ( -7.204 -7.218 -5.343) 11.512 3.171 ( 5.647 -8.011 -8.953) 13.275 3.644 ( 11.162 14.489 -2.198) 18.422 4.036 ( 1.576 6.467 6.182) 9.084 4.158 ( -7.913 3.345 -4.329) 9.620 5.306 ( -0.961 -10.398 -2.103) 10.652 6.501 ( -1.046 -2.354 4.163) 4.896 6.767 ( 0.127 2.393 0.729) 2.505 7.053 ( 0.878 -9.565 2.714) 9.981 7.710 ( -5.422 -2.322 7.179) 9.291 7.871 ( 0.763 1.196 -2.769) 3.111 8.035 ( 0.700 -2.467 -3.922) 4.686 8.946 ( 0.657 -0.109 1.105) 1.290 9.504 ( 6.906 7.321 -1.439) 10.167 9.780 ( -3.781 3.606 -3.327) 6.194 16.145 ( -2.025 -1.812 3.975) 4.815 16.508 ( 5.318 0.546 -6.595) 8.490 16.697 ( -2.395 0.562 0.419) 2.496 17.227 ( 2.444 8.050 3.588) 9.146 17.492 ( -2.462 2.120 -1.099) 3.429 18.354 ( -0.732 -17.146 -2.162) 17.298 ======================= Grid point 373 (206/294) ======================= q-point: ( 0.50 0.50 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 868 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.318 ( 1.919 -0.327 9.010) 9.217 1.651 ( 1.157 -5.422 8.440) 10.098 1.922 ( -4.315 -3.796 -2.232) 6.165 2.663 ( -0.980 -6.303 0.583) 6.405 3.136 ( 3.413 -5.909 -7.920) 10.454 3.893 ( -1.161 11.924 -6.288) 13.530 4.059 ( 2.954 5.238 -5.185) 7.940 4.152 ( -0.917 7.602 6.626) 10.126 5.160 ( -2.693 -12.516 0.102) 12.803 6.501 ( 0.986 -3.035 5.877) 6.687 6.782 ( -0.013 -0.333 -1.210) 1.255 6.993 ( -0.031 -6.799 2.027) 7.095 7.645 ( -3.835 -2.161 5.671) 7.179 7.905 ( 2.844 1.393 -1.716) 3.602 8.024 ( 1.874 -1.261 -0.897) 2.431 8.936 ( -1.828 -0.413 -0.533) 1.948 9.646 ( 5.015 3.711 -5.513) 8.325 9.748 ( -3.690 6.652 0.387) 7.617 16.118 ( -1.767 -2.072 3.955) 4.801 16.524 ( 2.934 -2.112 -7.078) 7.948 16.707 ( -0.740 4.806 0.075) 4.863 17.353 ( 2.906 5.387 1.685) 6.348 17.492 ( -0.693 5.341 0.844) 5.451 18.148 ( -2.773 -18.732 -0.027) 18.936 ======================= Grid point 374 (207/294) ======================= q-point: ( 0.58 0.50 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.405 ( 5.286 -3.373 4.819) 7.908 1.609 ( -4.343 -5.193 6.003) 9.048 1.795 ( -5.826 -1.606 -1.507) 6.228 2.719 ( 9.881 -3.842 6.741) 12.564 3.068 ( -0.258 -4.346 -7.747) 8.887 3.755 ( -12.966 7.146 -10.613) 18.216 4.209 ( 2.859 2.564 -0.989) 3.965 4.303 ( 6.082 12.443 3.865) 14.379 4.999 ( -2.602 -12.435 2.035) 12.866 6.541 ( 2.562 -3.331 6.929) 8.103 6.747 ( -0.891 -1.640 -2.852) 3.409 6.951 ( -0.798 -3.064 0.784) 3.261 7.622 ( -0.045 -1.398 3.295) 3.579 7.956 ( 2.635 1.009 -0.703) 2.908 8.058 ( 3.074 -1.151 1.897) 3.792 8.873 ( -4.278 -0.405 -2.598) 5.021 9.660 ( -1.149 3.959 -6.180) 7.428 9.800 ( 0.708 3.887 1.815) 4.348 16.102 ( -0.465 -1.400 3.281) 3.597 16.506 ( 1.179 -1.130 -4.579) 4.861 16.722 ( -2.647 4.551 -1.719) 5.538 17.446 ( 4.717 1.965 -1.440) 5.309 17.588 ( 1.475 8.381 6.113) 10.478 17.917 ( -4.236 -17.442 -0.764) 17.965 ======================= Grid point 375 (208/294) ======================= q-point: ( 0.67 0.50 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 868 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.461 ( -0.071 -5.083 3.747) 6.315 1.529 ( 1.718 -6.158 6.229) 8.926 1.720 ( -4.177 3.668 -0.407) 5.573 2.906 ( 7.680 -5.466 4.185) 10.314 2.989 ( 2.931 0.347 -4.672) 5.527 3.545 ( -12.638 7.375 -11.563) 18.650 4.240 ( -1.100 0.789 2.373) 2.732 4.462 ( -0.018 1.771 0.770) 1.932 4.929 ( 4.118 -3.238 2.961) 6.018 6.573 ( 0.601 -3.157 3.685) 4.890 6.732 ( 1.493 1.115 -0.263) 1.882 6.907 ( -1.783 -2.256 -0.344) 2.896 7.656 ( 3.478 -0.208 1.113) 3.658 7.998 ( 2.219 0.483 -0.676) 2.369 8.114 ( 2.904 -1.364 3.756) 4.940 8.766 ( -5.858 -0.235 -3.899) 7.041 9.649 ( -1.691 4.858 -3.293) 6.108 9.827 ( 0.001 -1.042 0.384) 1.110 16.121 ( 1.889 -0.340 2.389) 3.065 16.482 ( -1.472 0.613 -3.068) 3.458 16.701 ( -2.702 3.140 -0.964) 4.253 17.518 ( 2.568 -1.376 2.912) 4.119 17.676 ( -2.806 -16.189 -2.978) 16.698 17.763 ( 3.110 12.597 3.406) 13.415 ======================= Grid point 376 (209/294) ======================= q-point: (-0.25 -0.50 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.387 ( -0.320 -7.564 1.324) 7.686 1.612 ( 4.232 -0.534 6.925) 8.133 1.715 ( -1.025 5.085 -0.089) 5.188 2.863 ( -1.040 -2.110 -1.725) 2.918 3.117 ( 3.280 0.220 -2.233) 3.974 3.398 ( -3.801 6.900 -6.519) 10.225 4.215 ( -3.997 -2.687 5.821) 7.555 4.357 ( -4.980 -8.414 -2.470) 10.084 5.089 ( 8.655 6.611 2.027) 11.078 6.567 ( -0.464 0.997 0.223) 1.122 6.795 ( 2.922 1.517 2.434) 4.094 6.846 ( -2.469 -2.308 -1.079) 3.548 7.736 ( 4.975 1.325 -0.039) 5.148 8.029 ( 1.844 0.084 -1.090) 2.144 8.162 ( 1.569 -0.864 3.519) 3.948 8.645 ( -5.550 -0.713 -3.012) 6.354 9.660 ( -0.917 4.640 -0.866) 4.809 9.785 ( -1.338 -5.433 -0.490) 5.616 16.185 ( 4.324 0.580 1.466) 4.602 16.431 ( -3.668 1.289 -2.121) 4.429 16.697 ( -1.143 2.792 0.475) 3.054 17.445 ( -5.722 -12.128 1.844) 13.536 17.548 ( 1.968 -4.650 -2.280) 5.540 17.984 ( 5.575 13.992 1.961) 15.189 ======================= Grid point 377 (210/294) ======================= q-point: (-0.17 0.50 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 868 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.351 ( 4.416 -5.001 -2.819) 7.242 1.687 ( -0.771 3.546 1.680) 3.999 1.795 ( 5.340 3.696 1.314) 6.626 2.855 ( -3.702 4.194 3.911) 6.826 3.044 ( -2.939 -0.107 -5.515) 6.250 3.453 ( 2.531 0.813 -0.054) 2.659 4.127 ( -5.701 -7.012 10.449) 13.815 4.193 ( -1.315 -6.838 -9.426) 11.719 5.298 ( 7.166 7.750 0.253) 10.558 6.582 ( -1.252 3.316 -0.188) 3.550 6.788 ( -0.103 -1.093 -2.251) 2.505 6.866 ( 1.579 2.098 2.533) 3.648 7.819 ( 1.529 3.069 0.284) 3.441 8.052 ( 2.316 0.032 -1.876) 2.981 8.194 ( 0.995 0.984 1.371) 1.959 8.548 ( -3.285 -2.626 0.159) 4.208 9.669 ( -1.799 -6.017 -1.582) 6.476 9.707 ( -0.294 0.966 1.469) 1.783 16.269 ( 2.409 1.929 -0.321) 3.102 16.394 ( 0.567 0.675 0.183) 0.900 16.709 ( -1.413 2.947 0.629) 3.328 17.266 ( -3.035 -9.344 -2.354) 10.102 17.498 ( -1.466 -6.887 2.057) 7.335 18.214 ( 5.009 14.858 -0.203) 15.681 ======================= Grid point 383 (211/294) ======================= q-point: ( 0.25 0.58 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.567 ( -8.778 1.185 0.092) 8.858 1.793 ( -1.469 -1.976 -1.067) 2.684 1.990 ( 1.288 -2.004 1.080) 2.616 2.789 ( 9.278 6.229 -3.114) 11.600 3.024 ( -1.820 -11.079 -7.374) 13.433 3.367 ( 1.856 -0.739 5.851) 6.182 3.909 ( -1.754 6.820 4.342) 8.274 4.283 ( 3.126 -1.951 6.781) 7.717 5.407 ( -1.579 -1.226 -10.601) 10.788 6.512 ( 0.399 2.081 4.227) 4.728 6.871 ( -3.407 0.701 -1.542) 3.805 7.046 ( 2.231 -3.500 -5.221) 6.670 7.811 ( -2.512 -0.924 0.033) 2.676 8.033 ( 0.709 -1.279 -3.459) 3.755 8.143 ( -5.021 -2.688 -0.272) 5.702 8.727 ( 7.203 -1.504 0.136) 7.360 9.233 ( -0.858 7.432 6.862) 10.152 9.861 ( 0.243 -1.384 0.045) 1.406 16.288 ( -4.554 0.699 0.261) 4.615 16.370 ( 0.569 -0.240 -3.223) 3.282 16.806 ( 0.187 -0.544 -3.621) 3.667 17.100 ( -1.803 5.056 5.973) 8.031 17.428 ( 6.260 -4.070 10.632) 12.993 18.493 ( -0.846 -3.289 -14.758) 15.144 ======================= Grid point 384 (212/294) ======================= q-point: ( 0.33 0.58 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.461 ( -6.609 0.949 4.562) 8.086 1.679 ( -6.910 -6.597 7.317) 12.034 2.008 ( 2.403 -1.347 -4.389) 5.182 2.884 ( 3.331 -7.718 -5.751) 10.185 3.012 ( 6.914 3.970 -3.851) 8.854 3.360 ( 1.239 -0.547 -3.495) 3.748 4.005 ( 0.485 7.098 9.135) 11.578 4.329 ( -1.176 1.237 3.962) 4.314 5.312 ( -0.406 -4.520 -7.858) 9.074 6.542 ( -1.050 0.336 2.760) 2.972 6.818 ( -2.825 1.381 -1.115) 3.337 7.008 ( 1.682 -6.696 -1.525) 7.071 7.775 ( -0.294 -0.998 -0.957) 1.414 8.012 ( -2.154 0.758 -0.476) 2.332 8.028 ( -4.682 -3.754 0.282) 6.008 8.823 ( 6.637 -1.264 -1.634) 6.951 9.354 ( 1.501 8.912 4.896) 10.278 9.848 ( -0.497 -0.249 -0.760) 0.942 16.227 ( -3.083 -0.663 0.965) 3.298 16.377 ( 1.976 0.841 -3.051) 3.731 16.762 ( -1.382 -1.449 -3.099) 3.690 17.193 ( 0.320 8.372 6.930) 10.873 17.516 ( 1.953 -2.938 7.370) 8.171 18.346 ( -0.191 -8.860 -12.895) 15.647 ======================= Grid point 385 (213/294) ======================= q-point: ( 0.42 0.58 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.406 ( -5.152 -0.354 6.180) 8.054 1.602 ( -1.877 -3.671 10.879) 11.634 1.972 ( 0.896 -4.400 -6.544) 7.937 2.835 ( -2.459 -6.144 -1.482) 6.781 2.992 ( 0.776 -4.521 -5.280) 6.994 3.506 ( 13.215 8.130 -6.065) 16.659 4.129 ( 0.556 4.861 7.223) 8.724 4.317 ( -5.749 6.097 1.627) 8.536 5.210 ( -0.665 -8.056 -4.564) 9.282 6.515 ( -1.773 -3.292 2.709) 4.617 6.799 ( -1.332 1.941 -0.699) 2.455 6.966 ( 1.523 -6.674 0.602) 6.872 7.773 ( 0.431 -0.823 1.574) 1.828 7.904 ( -6.457 -1.500 1.823) 6.875 8.003 ( -0.115 0.239 -0.956) 0.992 8.895 ( 4.680 -1.097 -2.197) 5.285 9.489 ( 3.036 7.549 0.698) 8.166 9.837 ( -1.142 1.815 -0.706) 2.257 16.186 ( -2.264 -1.435 2.679) 3.790 16.407 ( 3.216 0.662 -4.883) 5.884 16.721 ( -0.619 0.402 -2.013) 2.144 17.330 ( 0.136 9.659 8.124) 12.622 17.527 ( -1.102 -1.466 2.971) 3.491 18.176 ( 0.217 -13.673 -8.839) 16.283 ======================= Grid point 386 (214/294) ======================= q-point: ( 0.50 0.58 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.357 ( -2.956 -1.562 4.155) 5.333 1.652 ( 1.595 -2.212 11.236) 11.562 1.900 ( -0.086 -5.100 -4.701) 6.937 2.658 ( -6.172 -7.269 -0.425) 9.546 3.007 ( 3.967 -0.760 -2.110) 4.557 3.777 ( 14.247 7.716 -7.456) 17.835 4.131 ( -5.721 2.164 -3.562) 7.078 4.334 ( -3.576 9.833 5.888) 12.006 5.086 ( -1.940 -10.396 -0.362) 10.581 6.482 ( 0.277 -4.816 5.026) 6.966 6.779 ( -1.283 -0.492 -1.938) 2.375 6.947 ( 1.117 -3.259 1.180) 3.641 7.740 ( -5.566 -3.508 7.177) 9.736 7.862 ( 1.900 1.867 -2.236) 3.478 8.007 ( 0.119 0.801 0.847) 1.171 8.923 ( 1.679 -1.156 -2.607) 3.309 9.588 ( 3.091 4.866 -4.511) 7.320 9.842 ( -1.335 3.688 0.656) 3.977 16.153 ( -2.083 -2.204 3.907) 4.946 16.433 ( 2.876 0.866 -5.196) 6.002 16.734 ( 1.331 3.015 -2.147) 3.934 17.422 ( -3.857 6.631 1.218) 7.767 17.548 ( 1.938 2.339 8.060) 8.613 17.995 ( -0.431 -15.883 -5.318) 16.755 ======================= Grid point 387 (215/294) ======================= q-point: ( 0.58 0.58 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.347 ( 1.562 -2.302 4.060) 4.922 1.675 ( -4.077 -6.025 10.280) 12.594 1.817 ( -1.092 -2.539 -4.789) 5.530 2.593 ( 4.482 -3.577 3.396) 6.664 3.036 ( -0.542 1.846 -0.860) 2.107 3.914 ( -4.776 4.061 -11.818) 13.378 4.082 ( 6.620 4.435 -5.448) 9.652 4.412 ( -0.464 6.791 3.261) 7.547 4.962 ( -3.154 -9.241 5.798) 11.356 6.499 ( 2.647 -4.802 7.448) 9.248 6.733 ( -1.136 -1.126 -3.117) 3.504 6.943 ( -0.074 -1.251 0.725) 1.448 7.663 ( -3.955 -2.604 5.210) 7.040 7.918 ( 2.881 1.471 -0.329) 3.252 8.035 ( 1.207 0.773 2.856) 3.195 8.895 ( -1.450 -1.166 -3.907) 4.328 9.635 ( 2.147 3.746 -6.922) 8.158 9.859 ( -1.430 2.662 0.979) 3.176 16.124 ( -1.510 -2.119 3.951) 4.731 16.464 ( 1.945 2.353 -2.631) 4.030 16.770 ( 0.343 3.645 -3.624) 5.151 17.405 ( -0.660 2.837 -3.952) 4.909 17.683 ( 1.582 2.562 14.981) 15.281 17.807 ( -1.614 -12.174 -5.731) 13.552 ======================= Grid point 388 (216/294) ======================= q-point: (-0.33 -0.42 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.409 ( 4.544 -3.711 5.969) 8.369 1.537 ( -6.407 -10.193 8.440) 14.703 1.779 ( -1.366 1.944 -3.281) 4.051 2.744 ( 11.319 -0.125 4.321) 12.117 3.015 ( -4.679 4.415 -0.440) 6.448 3.723 ( -10.758 3.773 -13.573) 17.726 4.200 ( 5.270 0.782 -4.658) 7.077 4.454 ( 0.711 -1.377 -2.800) 3.200 4.923 ( -0.516 -0.583 11.910) 11.936 6.549 ( 2.402 -3.782 7.603) 8.825 6.703 ( 0.995 -0.056 -3.100) 3.256 6.923 ( -1.532 -0.854 0.508) 1.826 7.636 ( -0.074 -0.896 3.361) 3.479 7.966 ( 1.961 0.574 -0.112) 2.046 8.092 ( 2.107 0.303 5.056) 5.485 8.813 ( -3.762 -0.811 -5.876) 7.024 9.661 ( 1.387 3.985 -5.885) 7.241 9.843 ( -2.244 -0.785 0.001) 2.377 16.117 ( 0.054 -1.200 3.401) 3.606 16.503 ( -0.099 3.687 -0.680) 3.751 16.761 ( -2.003 2.385 -3.202) 4.467 17.415 ( 3.185 -1.202 -6.305) 7.165 17.610 ( -3.083 -12.906 2.788) 13.559 17.862 ( 2.281 9.482 8.437) 12.895 ======================= Grid point 389 (217/294) ======================= q-point: (-0.25 -0.42 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.346 ( -3.862 -11.483 5.036) 13.120 1.542 ( 6.587 -5.942 9.135) 12.734 1.778 ( -1.305 6.579 -2.713) 7.235 2.915 ( 0.914 2.082 4.422) 4.972 3.019 ( 3.710 6.240 -2.169) 7.577 3.517 ( -8.453 3.307 -12.110) 15.134 4.204 ( 0.727 -3.355 -6.309) 7.183 4.365 ( -4.754 -7.572 2.226) 9.214 5.066 ( 5.268 6.682 8.689) 12.162 6.585 ( 0.598 -0.035 3.980) 4.025 6.726 ( 3.475 -1.939 -1.626) 4.299 6.891 ( -2.169 0.388 1.353) 2.586 7.686 ( 3.697 1.301 2.807) 4.821 7.994 ( 1.583 -0.343 -0.445) 1.680 8.156 ( 1.488 -0.321 5.964) 6.155 8.699 ( -4.699 -0.136 -7.279) 8.665 9.690 ( 0.935 4.115 -3.642) 5.574 9.769 ( -3.340 -4.569 -0.588) 5.690 16.146 ( 2.249 -0.229 2.690) 3.513 16.500 ( -3.571 2.991 -1.516) 4.899 16.744 ( -0.895 2.312 0.006) 2.479 17.337 ( -0.686 -9.606 -8.932) 13.135 17.530 ( -0.601 -4.577 5.846) 7.449 18.058 ( 3.940 12.110 6.104) 14.122 ======================= Grid point 390 (218/294) ======================= q-point: (-0.17 -0.42 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.225 ( 0.652 -10.771 1.317) 10.870 1.670 ( 8.634 -2.985 7.102) 11.571 1.801 ( -2.943 6.955 -2.635) 7.998 2.950 ( -0.623 5.347 3.387) 6.360 3.102 ( -2.159 4.778 -2.365) 5.751 3.416 ( 0.644 1.350 -7.156) 7.311 4.090 ( -2.231 -6.895 -9.214) 11.722 4.233 ( -6.912 -6.253 8.939) 12.914 5.270 ( 6.300 7.565 3.961) 10.612 6.625 ( 0.140 2.253 2.310) 3.230 6.724 ( 1.951 -3.513 -3.660) 5.436 6.898 ( -0.046 2.585 2.071) 3.313 7.807 ( 5.418 3.726 4.169) 7.786 8.008 ( 1.610 -1.088 -1.140) 2.253 8.197 ( 0.164 -0.827 5.086) 5.155 8.584 ( -4.162 0.294 -7.177) 8.301 9.646 ( -4.356 -7.298 -0.337) 8.506 9.727 ( 0.905 3.493 -1.293) 3.833 16.216 ( 4.458 0.376 1.972) 4.889 16.444 ( -3.984 1.705 -1.813) 4.698 16.767 ( -0.846 3.430 1.538) 3.853 17.176 ( -1.554 -8.524 -7.884) 11.715 17.500 ( -2.137 -6.175 6.974) 9.557 18.277 ( 4.606 13.861 1.676) 14.702 ======================= Grid point 395 (219/294) ======================= q-point: ( 0.25 -0.33 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.609 ( 4.948 -1.133 -1.808) 5.388 1.799 ( -5.133 1.904 -8.540) 10.145 1.927 ( 2.036 -4.632 -6.786) 8.465 2.685 ( 6.815 5.468 1.075) 8.803 3.025 ( -9.468 -8.140 2.624) 12.758 3.348 ( 2.915 -1.647 6.680) 7.472 4.026 ( -2.023 4.164 3.463) 5.781 4.257 ( 3.910 1.342 8.216) 9.197 5.377 ( -3.517 -0.223 -12.341) 12.835 6.540 ( 1.318 1.515 4.405) 4.841 6.894 ( -0.368 -0.165 -8.560) 8.569 6.946 ( 1.482 -2.617 -2.062) 3.646 7.825 ( -2.375 -1.965 -6.118) 6.851 7.974 ( 1.749 -0.589 -0.641) 1.954 8.233 ( -4.916 1.731 -0.686) 5.257 8.593 ( 6.362 -4.100 3.695) 8.422 9.393 ( -3.367 7.852 8.712) 12.202 9.831 ( 1.076 -2.946 0.569) 3.188 16.281 ( 0.277 -2.207 -5.634) 6.057 16.428 ( -4.366 1.525 2.572) 5.292 16.791 ( -0.360 1.429 -3.578) 3.870 17.163 ( 1.752 -2.381 7.117) 7.706 17.384 ( 4.190 3.172 10.452) 11.699 18.411 ( -3.332 -2.186 -16.329) 16.808 ======================= Grid point 396 (220/294) ======================= q-point: ( 0.33 0.67 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 868 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.597 ( -6.100 0.549 2.753) 6.715 1.688 ( 0.306 -6.193 -3.795) 7.270 1.895 ( 3.588 -3.973 -9.194) 10.639 2.819 ( -2.967 -1.038 2.109) 3.785 2.936 ( 6.671 5.252 0.943) 8.542 3.342 ( -2.662 -2.754 -0.758) 3.905 4.082 ( 1.739 1.573 8.029) 8.365 4.367 ( 1.990 2.052 6.169) 6.799 5.253 ( -2.484 -1.284 -10.961) 11.312 6.577 ( -0.993 0.425 1.884) 2.172 6.843 ( -0.186 -0.082 -4.948) 4.952 6.919 ( 0.517 -4.338 -0.916) 4.463 7.761 ( -0.815 0.585 -4.817) 4.920 7.989 ( 0.728 -0.003 -0.124) 0.738 8.155 ( -6.533 0.156 2.678) 7.063 8.677 ( 7.077 -3.041 -0.363) 7.711 9.473 ( -1.641 7.798 6.321) 10.171 9.827 ( 1.389 -2.518 0.335) 2.895 16.241 ( -0.245 -0.574 -3.797) 3.848 16.387 ( -2.824 0.309 1.533) 3.228 16.758 ( -1.574 -0.112 -3.369) 3.721 17.256 ( 4.572 0.661 8.590) 9.754 17.519 ( 1.898 2.446 8.594) 9.135 18.224 ( -3.771 -5.002 -15.975) 17.159 ======================= Grid point 397 (221/294) ======================= q-point: ( 0.42 0.67 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.506 ( -5.133 -1.338 2.217) 5.749 1.651 ( -0.296 -1.931 2.513) 3.183 1.839 ( 2.343 -6.573 -7.892) 10.535 2.806 ( 0.542 0.088 2.814) 2.867 3.000 ( -4.902 -2.783 -0.306) 5.645 3.355 ( 8.426 6.081 -3.957) 11.119 4.175 ( 1.893 0.550 6.880) 7.156 4.428 ( -0.137 2.026 3.323) 3.894 5.144 ( -2.269 -2.213 -7.461) 8.106 6.535 ( -2.948 -2.537 0.627) 3.939 6.833 ( -1.181 2.050 -2.046) 3.128 6.885 ( 1.947 -4.908 0.392) 5.294 7.753 ( 0.920 1.657 -2.273) 2.959 7.988 ( -1.854 -0.802 1.905) 2.777 8.062 ( -6.291 0.444 3.611) 7.267 8.761 ( 7.264 -1.988 -3.322) 8.232 9.546 ( -0.658 6.202 1.999) 6.549 9.837 ( 1.619 -1.002 0.620) 2.002 16.215 ( -1.197 -0.017 -0.477) 1.288 16.367 ( 0.005 0.312 -0.846) 0.902 16.716 ( -0.761 0.133 -3.018) 3.115 17.406 ( 5.854 0.169 10.849) 12.329 17.587 ( -2.381 4.402 5.428) 7.383 18.018 ( -3.104 -7.849 -14.077) 16.414 ======================= Grid point 398 (222/294) ======================= q-point: ( 0.50 0.67 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 868 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.421 ( -4.672 -1.750 0.571) 5.022 1.679 ( 1.498 1.231 5.668) 5.991 1.783 ( 2.649 -6.560 -4.673) 8.478 2.714 ( -8.643 -7.877 1.577) 11.800 2.978 ( 2.594 4.787 2.488) 5.986 3.581 ( 12.571 6.632 -5.219) 15.141 4.200 ( -2.401 0.289 0.269) 2.433 4.444 ( -0.263 0.121 0.201) 0.352 5.058 ( -3.015 -1.410 -0.613) 3.384 6.474 ( -1.569 -3.667 3.328) 5.195 6.790 ( -2.295 -0.930 -2.543) 3.549 6.906 ( 2.326 -0.954 1.024) 2.715 7.781 ( 0.865 -0.818 2.375) 2.657 7.916 ( -6.114 0.101 3.394) 6.993 8.037 ( -1.203 1.801 1.904) 2.884 8.828 ( 5.569 -1.701 -4.651) 7.452 9.588 ( -0.043 4.685 -3.018) 5.572 9.865 ( 1.428 0.117 0.923) 1.705 16.189 ( -2.124 -1.612 3.022) 4.030 16.389 ( 2.076 3.025 -2.705) 4.558 16.710 ( 1.479 1.001 -3.093) 3.572 17.524 ( 1.321 -4.118 5.748) 7.193 17.630 ( -2.448 10.409 9.195) 14.103 17.821 ( -1.144 -10.686 -11.164) 15.497 ======================= Grid point 399 (223/294) ======================= q-point: (-0.42 -0.33 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.348 ( -2.121 -1.942 0.829) 2.993 1.725 ( -0.788 -5.985 -1.005) 6.120 1.759 ( 1.557 0.445 5.604) 5.833 2.554 ( -2.448 -4.983 2.742) 6.192 3.094 ( 0.916 7.348 4.131) 8.479 3.785 ( 10.659 2.137 -9.153) 14.211 4.118 ( -5.543 2.199 -5.163) 7.888 4.424 ( 1.020 -3.526 -3.571) 5.121 5.023 ( -3.921 1.609 8.186) 9.218 6.465 ( 1.198 -3.709 6.871) 7.900 6.726 ( -1.807 -1.240 -3.688) 4.290 6.934 ( 0.929 -0.237 0.838) 1.274 7.741 ( -4.617 -5.092 6.813) 9.678 7.907 ( 0.403 3.986 0.313) 4.018 8.058 ( -0.051 1.837 3.210) 3.699 8.847 ( 2.305 -2.050 -5.594) 6.388 9.608 ( 0.876 4.469 -6.140) 7.645 9.884 ( 0.336 -0.391 0.264) 0.579 16.154 ( -2.003 -2.633 4.237) 5.376 16.458 ( 2.353 5.889 -1.107) 6.437 16.737 ( 2.800 1.036 -4.283) 5.221 17.470 ( -5.086 1.185 -2.164) 5.653 17.651 ( -0.291 -11.897 -5.177) 12.978 17.790 ( 2.175 6.491 12.547) 14.293 ======================= Grid point 400 (224/294) ======================= q-point: (-0.33 -0.33 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 868 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.318 ( 2.458 -7.297 1.304) 7.810 1.629 ( -7.640 -6.744 9.862) 14.181 1.787 ( 0.645 1.451 0.177) 1.597 2.606 ( 8.156 1.751 1.670) 8.507 3.175 ( -3.915 9.286 4.890) 11.201 3.759 ( -2.926 -4.092 -16.973) 17.703 4.105 ( 3.107 3.275 -3.410) 5.658 4.380 ( 1.825 -4.222 -5.324) 7.035 5.054 ( -3.445 4.392 13.560) 14.664 6.516 ( 3.035 -3.458 9.326) 10.399 6.671 ( -0.486 -0.904 -4.761) 4.870 6.939 ( -0.504 -0.241 0.764) 0.947 7.670 ( -2.753 -3.372 5.650) 7.133 7.953 ( 0.816 2.032 0.392) 2.225 8.110 ( 0.995 2.085 5.279) 5.763 8.799 ( -0.847 -2.230 -7.373) 7.750 9.636 ( 1.759 4.698 -6.425) 8.151 9.863 ( -1.589 -1.798 -0.676) 2.493 16.131 ( -0.930 -2.215 4.272) 4.901 16.548 ( 0.756 6.965 0.683) 7.039 16.750 ( 1.458 -0.736 -4.606) 4.887 17.381 ( -3.841 -0.791 -4.878) 6.259 17.531 ( 0.577 -6.786 -3.845) 7.821 17.963 ( 2.300 5.940 14.227) 15.588 ======================= Grid point 401 (225/294) ======================= q-point: (-0.25 -0.33 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.309 ( 3.586 -10.305 4.415) 11.771 1.459 ( -5.975 -13.887 11.404) 18.937 1.855 ( 0.587 8.793 0.905) 8.859 2.809 ( 10.811 4.797 -0.949) 11.865 3.201 ( -7.780 11.699 3.763) 14.545 3.531 ( -4.612 -6.073 -17.570) 19.153 4.129 ( 0.475 -1.445 -4.550) 4.798 4.354 ( 0.852 -2.281 -1.588) 2.907 5.150 ( -0.353 5.997 12.800) 14.140 6.588 ( 2.056 -2.040 7.881) 8.396 6.645 ( 2.086 -1.929 -3.811) 4.754 6.928 ( -1.166 0.287 1.030) 1.582 7.669 ( 1.617 -0.952 4.872) 5.221 7.973 ( 0.398 0.078 -0.035) 0.407 8.181 ( 0.891 1.787 6.467) 6.768 8.703 ( -2.521 -1.394 -9.342) 9.777 9.677 ( 1.911 4.225 -4.638) 6.558 9.791 ( -3.704 -2.958 -1.123) 4.871 16.135 ( 0.652 -1.345 3.882) 4.159 16.580 ( -3.444 3.558 -2.805) 5.691 16.748 ( 1.851 -0.204 0.691) 1.987 17.259 ( -3.860 -3.836 -7.394) 9.180 17.506 ( 1.772 -2.319 0.321) 2.936 18.146 ( 3.143 8.142 11.061) 14.089 ======================= Grid point 402 (226/294) ======================= q-point: (-0.17 -0.33 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 868 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.167 ( -6.129 -15.542 7.607) 18.357 1.489 ( 12.058 -7.432 8.120) 16.327 1.934 ( -3.247 8.933 1.647) 9.647 2.966 ( 2.973 3.138 -4.715) 6.397 3.209 ( -1.968 10.518 -5.830) 12.185 3.349 ( -1.708 -4.252 -6.352) 7.832 4.061 ( -3.263 -0.997 -3.937) 5.209 4.317 ( -3.731 -3.354 4.148) 6.509 5.294 ( 2.905 6.516 8.079) 10.778 6.627 ( 2.871 -0.616 -4.579) 5.439 6.649 ( 0.636 -3.237 5.859) 6.724 6.930 ( -0.310 1.588 1.060) 1.935 7.764 ( 6.056 0.929 5.880) 8.492 7.968 ( 0.534 -1.828 -1.021) 2.161 8.236 ( -0.366 1.013 5.718) 5.818 8.595 ( -3.077 0.557 -9.926) 10.406 9.671 ( -4.915 -4.636 1.385) 6.897 9.730 ( 1.094 4.303 -4.043) 6.005 16.172 ( 2.514 -0.714 3.163) 4.103 16.502 ( -3.786 -0.618 -3.899) 5.470 16.805 ( 1.342 2.307 3.361) 4.292 17.115 ( -4.027 -2.948 -8.007) 9.435 17.508 ( -0.302 -4.321 4.655) 6.359 18.342 ( 3.947 10.923 4.747) 12.546 ======================= Grid point 407 (227/294) ======================= q-point: ( 0.25 -0.25 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.432 ( 11.508 2.273 -9.138) 14.870 1.676 ( 6.888 -16.265 -12.256) 21.499 1.913 ( -6.806 5.164 -6.117) 10.507 2.732 ( 0.565 10.588 6.643) 12.512 3.136 ( -4.466 -8.156 13.840) 16.673 3.343 ( -2.702 -0.258 1.864) 3.293 4.075 ( -1.347 -0.934 1.217) 2.041 4.292 ( 1.340 4.948 5.649) 7.628 5.372 ( -4.586 0.282 -12.272) 13.104 6.548 ( 2.323 0.799 4.956) 5.532 6.777 ( 3.534 -1.495 -11.465) 12.090 6.941 ( -0.952 -0.505 -0.360) 1.136 7.777 ( 1.780 0.116 -7.392) 7.604 7.966 ( -0.160 -0.345 0.936) 1.010 8.288 ( -1.355 1.633 -5.767) 6.145 8.528 ( 1.075 -3.261 10.286) 10.844 9.571 ( -4.109 6.369 7.368) 10.570 9.782 ( 0.796 -4.243 0.056) 4.317 16.218 ( 1.304 -1.174 -5.583) 5.853 16.505 ( -1.746 -1.813 4.658) 5.295 16.801 ( -1.044 2.940 -4.210) 5.240 17.125 ( 0.879 -5.878 7.791) 9.799 17.446 ( 2.001 6.495 6.539) 9.431 18.376 ( -4.624 0.346 -14.373) 15.102 ======================= Grid point 408 (228/294) ======================= q-point: ( 0.33 -0.25 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.487 ( 7.677 -10.146 -9.942) 16.147 1.660 ( 4.871 -1.944 -1.813) 5.549 1.799 ( -5.159 2.476 -7.681) 9.578 2.908 ( 4.600 8.222 5.299) 10.809 2.973 ( -11.123 0.069 3.257) 11.590 3.365 ( -0.913 -2.715 4.814) 5.602 4.078 ( 2.210 -3.147 6.697) 7.722 4.371 ( 2.164 0.264 2.145) 3.058 5.245 ( -3.820 2.327 -11.064) 11.934 6.604 ( -0.161 1.051 1.976) 2.243 6.758 ( 3.465 -2.139 -5.791) 7.080 6.913 ( -1.515 -0.733 -0.755) 1.845 7.763 ( -0.609 3.624 -5.995) 7.031 7.983 ( 0.946 0.521 0.990) 1.466 8.241 ( -2.610 0.954 -3.075) 4.144 8.571 ( 2.538 -4.119 6.509) 8.110 9.610 ( -2.918 5.663 5.454) 8.386 9.763 ( 2.259 -4.899 0.224) 5.400 16.206 ( 1.169 0.666 -4.218) 4.428 16.457 ( -4.100 -1.616 2.956) 5.306 16.776 ( -2.184 1.162 -3.096) 3.964 17.179 ( 6.248 -5.116 8.699) 11.869 17.561 ( 2.580 3.691 2.615) 5.208 18.213 ( -7.126 1.489 -11.454) 13.572 ======================= Grid point 409 (229/294) ======================= q-point: ( 0.42 -0.25 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.458 ( 6.020 -8.752 -6.214) 12.307 1.665 ( -4.255 2.058 2.946) 5.570 1.750 ( 1.605 0.079 -5.803) 6.022 2.862 ( -4.078 2.568 -0.350) 4.832 3.041 ( -0.711 -0.479 4.007) 4.097 3.336 ( -0.764 4.191 1.134) 4.408 4.158 ( 4.323 -2.972 8.787) 10.234 4.385 ( 2.927 -5.786 -2.331) 6.891 5.170 ( -3.649 5.482 -6.570) 9.302 6.574 ( -3.468 -0.158 -0.722) 3.546 6.796 ( 4.243 -1.528 0.700) 4.564 6.869 ( -2.272 -0.069 -2.004) 3.031 7.763 ( -0.636 4.317 -3.224) 5.425 8.008 ( 0.334 0.822 1.437) 1.689 8.183 ( -4.708 0.139 1.386) 4.910 8.615 ( 4.990 -3.338 0.141) 6.006 9.635 ( -2.454 4.085 2.063) 5.193 9.773 ( 3.746 -4.063 0.798) 5.584 16.220 ( 0.770 2.527 -2.461) 3.610 16.395 ( -3.023 -1.389 1.918) 3.840 16.725 ( -2.304 0.274 -2.597) 3.483 17.310 ( 8.465 -5.732 10.008) 14.307 17.624 ( 3.145 -0.251 -2.681) 4.140 18.049 ( -9.968 4.963 -6.508) 12.897 ======================= Grid point 410 (230/294) ======================= q-point: (-0.50 -0.25 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.443 ( 1.171 -3.083 -1.338) 3.559 1.637 ( -0.358 -0.585 -2.453) 2.547 1.754 ( -0.202 2.821 0.698) 2.913 2.792 ( -7.249 -6.092 2.037) 9.686 3.013 ( 0.799 3.423 3.208) 4.759 3.461 ( 6.685 6.618 -1.862) 9.589 4.216 ( 0.454 -1.779 1.926) 2.661 4.346 ( 4.157 -9.521 -3.335) 10.911 5.152 ( -3.919 7.826 -0.003) 8.753 6.510 ( -3.579 -0.712 1.636) 3.999 6.800 ( -1.992 -2.359 -1.623) 3.488 6.868 ( 2.559 1.316 0.176) 2.883 7.782 ( 0.039 1.510 0.674) 1.654 8.019 ( -2.091 1.282 2.951) 3.837 8.114 ( -5.049 0.728 3.282) 6.066 8.673 ( 6.854 -2.497 -4.906) 8.791 9.633 ( -2.116 3.551 -1.755) 4.491 9.809 ( 4.075 -3.486 0.971) 5.449 16.228 ( -1.860 0.222 1.600) 2.463 16.384 ( 1.174 3.117 -0.649) 3.393 16.687 ( -0.562 -0.035 -2.456) 2.520 17.428 ( 6.731 -8.394 7.370) 13.042 17.632 ( 3.450 -3.548 -6.588) 8.239 17.928 ( -10.716 10.047 1.525) 14.768 ======================= Grid point 411 (231/294) ======================= q-point: (-0.42 -0.25 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.388 ( -5.212 -0.923 -3.012) 6.091 1.631 ( 3.559 -0.686 -2.460) 4.380 1.814 ( 0.604 3.429 5.489) 6.500 2.603 ( -7.503 -7.906 5.465) 12.193 3.154 ( 4.755 8.483 4.137) 10.568 3.589 ( 7.523 -0.672 -7.466) 10.621 4.165 ( -1.917 -0.944 -5.572) 5.968 4.314 ( 2.257 -6.307 -2.192) 7.048 5.184 ( -3.882 8.113 6.354) 11.011 6.478 ( -1.375 -1.329 5.336) 5.668 6.726 ( -2.572 -1.434 -3.964) 4.938 6.917 ( 1.811 0.391 0.899) 2.060 7.774 ( -1.757 -4.728 5.075) 7.156 8.002 ( -4.673 4.807 3.083) 7.379 8.099 ( -0.490 1.574 3.172) 3.575 8.720 ( 5.695 -2.656 -7.309) 9.639 9.621 ( -1.188 4.261 -4.926) 6.620 9.841 ( 3.050 -3.299 0.514) 4.522 16.190 ( -2.626 -2.648 3.997) 5.466 16.476 ( 3.326 8.140 -1.054) 8.857 16.676 ( 1.416 -0.919 -2.750) 3.227 17.432 ( 3.117 -9.491 -2.582) 10.318 17.589 ( -2.221 -0.781 -5.347) 5.842 17.939 ( -3.484 8.651 11.563) 14.855 ======================= Grid point 412 (232/294) ======================= q-point: (-0.33 -0.25 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.237 ( -3.636 -7.421 -5.550) 9.955 1.722 ( 2.395 5.047 4.403) 7.113 1.826 ( -5.133 -3.626 8.616) 10.664 2.538 ( 2.718 -0.006 2.412) 3.634 3.330 ( 1.230 10.802 5.712) 12.281 3.569 ( 4.166 -10.214 -15.229) 18.805 4.123 ( -1.665 3.774 -3.100) 5.160 4.275 ( 2.037 -3.136 -5.304) 6.489 5.244 ( -3.756 7.107 10.715) 13.395 6.504 ( 1.449 -2.122 8.843) 9.208 6.649 ( -1.847 -1.271 -5.434) 5.878 6.943 ( 0.517 0.022 0.813) 0.964 7.708 ( -2.965 -6.442 6.533) 9.642 7.999 ( -2.685 3.708 1.451) 4.803 8.151 ( 0.875 3.042 5.042) 5.953 8.713 ( 2.514 -3.143 -8.835) 9.709 9.627 ( 0.540 5.313 -6.228) 8.204 9.845 ( 0.819 -2.948 -0.149) 3.063 16.153 ( -1.604 -2.951 4.713) 5.787 16.603 ( 2.297 8.344 -2.091) 8.903 16.676 ( 1.996 -2.177 -1.092) 3.149 17.364 ( 1.335 -5.946 -6.121) 8.637 17.497 ( -4.717 2.070 -6.160) 8.030 18.072 ( 1.020 4.897 16.367) 17.114 ======================= Grid point 413 (233/294) ======================= q-point: (-0.25 -0.25 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.131 ( 4.805 -11.071 0.430) 12.076 1.587 ( -14.626 -14.326 14.003) 24.804 1.916 ( 3.986 9.579 2.672) 10.714 2.688 ( 9.652 6.495 -2.315) 11.862 3.373 ( -0.619 -12.030 -17.420) 21.179 3.455 ( -5.075 12.657 3.962) 14.201 4.113 ( -0.864 0.830 -2.088) 2.407 4.288 ( 3.834 1.152 -4.404) 5.952 5.315 ( -3.232 5.919 12.108) 13.859 6.575 ( 2.387 -3.127 8.303) 9.188 6.586 ( 0.120 -1.354 -3.648) 3.893 6.948 ( -0.356 0.202 0.784) 0.885 7.662 ( -0.062 -4.625 5.880) 7.481 7.991 ( -1.936 0.958 0.601) 2.242 8.224 ( 0.798 1.977 5.368) 5.776 8.653 ( 0.000 -1.349 -9.590) 9.685 9.665 ( 1.630 5.580 -5.225) 7.817 9.809 ( -1.911 -2.314 -0.600) 3.060 16.140 ( -0.256 -2.416 4.934) 5.499 16.596 ( -0.726 -3.204 -7.317) 8.021 16.746 ( 1.406 4.909 4.863) 7.051 17.279 ( -4.109 -0.456 -7.187) 8.292 17.447 ( 1.627 0.944 -5.275) 5.600 18.239 ( 2.287 4.854 15.592) 16.489 ======================= Grid point 414 (234/294) ======================= q-point: (-0.17 -0.25 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.191 ( 3.282 -11.549 10.108) 15.695 1.286 ( -3.730 -17.279 12.291) 21.530 2.058 ( 0.347 8.383 1.946) 8.613 2.891 ( 9.364 7.095 -6.428) 13.392 3.107 ( -4.367 -10.959 -19.122) 22.468 3.510 ( -6.081 14.128 3.529) 15.781 4.096 ( -1.358 1.120 -0.348) 1.794 4.331 ( 1.264 0.223 -0.680) 1.453 5.393 ( -1.399 5.202 10.189) 11.526 6.540 ( 1.503 -2.459 -5.681) 6.371 6.648 ( 1.781 -3.134 9.447) 10.112 6.952 ( -0.261 1.092 0.769) 1.360 7.700 ( 4.847 -2.490 5.715) 7.897 7.954 ( -1.978 -2.125 -1.042) 3.085 8.259 ( 0.734 -1.895 1.764) 2.691 8.602 ( -1.657 4.216 -6.594) 8.000 9.712 ( 0.076 2.640 -0.499) 2.688 9.743 ( -2.812 0.848 -2.798) 4.057 16.155 ( 0.984 -1.802 4.623) 5.059 16.490 ( -1.715 -5.222 -6.148) 8.247 16.832 ( 0.868 3.641 4.721) 6.025 17.153 ( -6.069 1.745 -7.918) 10.127 17.474 ( 2.670 -1.329 -0.683) 3.060 18.412 ( 2.825 7.112 9.560) 12.245 ======================= Grid point 480 (235/294) ======================= q-point: ( 0.25 0.25 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 292 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.227 ( -0.000 0.000 20.832) 20.832 1.227 ( -0.000 0.000 20.832) 20.832 1.736 ( -0.000 0.000 28.750) 28.750 3.001 ( 0.000 -0.000 -13.250) 13.250 3.001 ( 0.000 -0.000 -13.250) 13.250 4.060 ( 0.000 -0.000 -3.826) 3.826 4.060 ( 0.000 -0.000 -3.826) 3.826 4.144 ( 0.000 -0.000 -16.224) 16.224 5.820 ( 0.000 -0.000 -2.966) 2.966 6.467 ( -0.000 0.000 3.756) 3.756 6.467 ( -0.000 0.000 3.756) 3.756 7.470 ( -0.000 0.000 12.559) 12.559 7.726 ( -0.000 0.000 7.791) 7.791 7.726 ( -0.000 0.000 7.791) 7.791 7.851 ( 0.000 -0.000 -1.516) 1.516 9.178 ( 0.000 -0.000 -5.310) 5.310 9.598 ( 0.000 -0.000 -9.782) 9.782 9.598 ( 0.000 -0.000 -9.782) 9.782 16.222 ( -0.000 0.000 5.613) 5.613 16.222 ( -0.000 0.000 5.613) 5.613 16.963 ( 0.000 -0.000 -3.109) 3.109 17.100 ( 0.000 -0.000 -4.952) 4.952 17.100 ( 0.000 -0.000 -4.952) 4.952 19.127 ( -0.000 0.000 2.737) 2.737 ======================= Grid point 481 (236/294) ======================= q-point: ( 0.33 0.25 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.155 ( -4.522 -6.387 19.353) 20.875 1.532 ( 3.752 11.427 18.350) 21.940 1.967 ( 6.206 0.940 22.669) 23.521 2.772 ( -4.158 -7.261 -10.247) 13.230 3.091 ( 6.182 4.242 -11.495) 13.724 3.949 ( -6.789 -3.062 -12.240) 14.328 3.974 ( -3.804 -0.503 -5.483) 6.692 4.135 ( 4.418 1.856 -5.817) 7.537 5.754 ( -3.824 -2.592 -3.518) 5.806 6.435 ( -1.352 -1.928 4.389) 4.981 6.575 ( 4.090 3.724 2.543) 6.088 7.435 ( -7.374 -4.372 9.562) 12.842 7.739 ( -0.026 0.353 9.112) 9.119 7.853 ( 0.777 2.840 -0.074) 2.945 7.905 ( 7.574 1.104 6.619) 10.119 9.092 ( -4.192 -3.101 -4.899) 7.155 9.433 ( -5.389 -1.611 -10.544) 11.950 9.671 ( 6.333 3.339 -8.387) 11.027 16.170 ( -3.141 -2.238 5.051) 6.355 16.347 ( 3.982 2.508 5.817) 7.482 16.920 ( -3.155 0.979 -3.248) 4.633 16.986 ( -2.346 -0.926 -5.204) 5.783 17.244 ( 9.988 3.871 -4.828) 11.750 19.054 ( -7.011 -5.002 2.831) 9.066 ======================= Grid point 482 (237/294) ======================= q-point: ( 0.42 0.25 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.200 ( 2.304 -1.354 13.706) 13.964 1.764 ( 0.263 10.778 11.552) 15.802 2.127 ( -0.891 1.429 9.965) 10.106 2.663 ( 5.134 -8.891 -2.391) 10.542 3.148 ( 4.579 -0.215 -1.643) 4.870 3.687 ( -12.221 -1.944 -12.612) 17.669 3.898 ( -1.983 -0.289 -5.677) 6.020 4.207 ( 4.950 3.266 -4.146) 7.236 5.624 ( -5.043 -4.122 -4.273) 7.789 6.438 ( 0.118 -1.337 5.273) 5.441 6.687 ( 3.709 4.015 0.719) 5.513 7.317 ( -6.969 -4.265 5.597) 9.904 7.783 ( -0.134 -1.342 7.272) 7.396 7.904 ( 2.109 3.529 -0.269) 4.120 8.079 ( 6.699 1.850 5.408) 8.806 8.955 ( -5.021 -4.016 -2.984) 7.088 9.276 ( -5.453 -0.628 -8.479) 10.100 9.757 ( 5.466 2.988 -6.088) 8.710 16.144 ( -0.844 -1.763 4.319) 4.741 16.443 ( 1.290 2.045 2.923) 3.794 16.884 ( -1.908 4.630 -1.725) 5.297 16.919 ( -0.895 -2.446 -4.150) 4.900 17.410 ( 8.270 3.576 -3.087) 9.524 18.868 ( -9.086 -7.673 0.746) 11.916 ======================= Grid point 483 (238/294) ======================= q-point: ( 0.50 0.25 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.340 ( 6.152 2.761 6.538) 9.392 1.839 ( -1.506 0.107 0.513) 1.595 2.128 ( -4.984 2.526 3.969) 6.853 2.691 ( 5.103 -4.377 1.071) 6.808 3.257 ( 6.471 -1.917 9.344) 11.526 3.399 ( -12.198 -0.043 -10.693) 16.222 3.831 ( -1.848 -0.195 -4.821) 5.166 4.296 ( 3.503 3.198 -1.358) 4.934 5.476 ( -4.042 -4.235 -6.313) 8.610 6.471 ( 0.857 -0.571 5.768) 5.859 6.776 ( 3.138 3.236 -1.077) 4.635 7.197 ( -5.623 -3.962 1.384) 7.016 7.803 ( 0.401 -1.208 3.990) 4.188 7.975 ( 2.856 2.277 0.234) 3.660 8.190 ( 1.649 3.051 -1.053) 3.624 8.835 ( -3.504 -4.541 0.488) 5.757 9.169 ( -3.065 0.729 -2.061) 3.765 9.828 ( 3.512 2.122 -3.548) 5.425 16.166 ( 2.312 -0.839 3.521) 4.295 16.450 ( -2.596 2.070 -2.301) 4.040 16.844 ( -1.040 -2.940 -3.981) 5.057 16.951 ( 2.248 5.220 3.355) 6.600 17.528 ( 3.140 1.906 1.426) 3.941 18.644 ( -7.564 -7.496 -4.875) 11.712 ======================= Grid point 484 (239/294) ======================= q-point: ( 0.58 0.25 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.507 ( 7.717 4.170 -0.548) 8.789 1.773 ( -2.302 -5.150 -1.952) 5.969 2.046 ( -3.863 -5.312 -0.811) 6.618 2.733 ( -1.154 2.238 0.468) 2.561 3.176 ( -7.620 4.800 -8.069) 12.092 3.408 ( 2.542 -0.750 11.476) 11.778 3.811 ( 3.258 -1.820 0.553) 3.773 4.345 ( -0.765 0.665 3.125) 3.285 5.354 ( -1.029 -2.378 -9.668) 10.010 6.516 ( 0.768 -0.191 5.863) 5.917 6.833 ( 2.508 1.621 -3.655) 4.719 7.074 ( -4.548 -3.829 -2.124) 6.313 7.827 ( 1.070 0.729 1.188) 1.757 8.026 ( 1.085 0.775 -1.537) 2.034 8.181 ( -1.965 2.946 -6.343) 7.264 8.756 ( -2.983 -4.205 3.188) 6.062 9.187 ( 2.286 1.835 6.277) 6.928 9.868 ( 1.156 1.210 -1.245) 2.086 16.245 ( 5.259 0.472 2.767) 5.962 16.390 ( -3.893 1.781 -5.214) 6.746 16.784 ( -0.299 -2.761 -3.107) 4.167 17.076 ( 3.416 4.710 5.978) 8.342 17.553 ( -3.642 -1.556 7.583) 8.555 18.445 ( -3.192 -4.380 -12.682) 13.792 ======================= Grid point 485 (240/294) ======================= q-point: ( 0.67 0.25 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.609 ( -0.679 -9.022 -9.920) 13.426 1.661 ( 1.962 2.279 0.554) 3.058 1.958 ( -0.351 -3.502 -1.592) 3.863 2.665 ( -5.468 -0.061 -4.021) 6.787 3.158 ( -0.072 9.953 -4.318) 10.850 3.461 ( -3.951 0.598 13.220) 13.811 3.911 ( 8.386 -2.396 4.569) 9.846 4.321 ( -4.083 -2.606 6.638) 8.217 5.292 ( 2.107 0.884 -12.462) 12.670 6.554 ( 0.054 -0.370 5.810) 5.822 6.824 ( 0.341 -2.214 -9.608) 9.865 6.974 ( -2.398 -1.414 -0.965) 2.947 7.857 ( -0.637 4.349 -2.949) 5.293 7.978 ( -2.910 -1.152 -4.401) 5.400 8.175 ( 2.986 0.634 -4.580) 5.504 8.691 ( -4.351 -2.320 6.205) 7.926 9.326 ( 6.072 1.759 9.556) 11.458 9.874 ( -1.073 0.598 0.316) 1.268 16.306 ( -3.788 1.231 -6.071) 7.261 16.373 ( 7.087 1.549 2.373) 7.633 16.748 ( 0.531 -2.130 -2.092) 3.033 17.206 ( 2.480 4.203 6.540) 8.161 17.476 ( -7.632 -5.127 11.186) 14.480 18.319 ( 1.216 -0.338 -17.859) 17.904 ======================= Grid point 486 (241/294) ======================= q-point: (-0.25 0.25 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.371 ( -7.220 -11.635 -5.109) 14.615 1.762 ( 7.248 1.604 -5.555) 9.272 1.874 ( -8.174 2.594 -8.296) 11.932 2.600 ( 2.648 -3.429 0.820) 4.409 3.270 ( 4.907 10.411 -4.869) 12.497 3.454 ( -7.785 -1.200 17.542) 19.229 4.047 ( 5.939 -0.361 3.235) 6.773 4.271 ( -1.928 -3.971 7.196) 8.442 5.287 ( 3.329 3.843 -13.161) 14.109 6.576 ( -0.831 -0.694 5.785) 5.885 6.707 ( -1.604 -4.400 -12.258) 13.122 6.951 ( -0.429 0.342 -0.353) 0.652 7.791 ( -5.833 1.580 -8.021) 10.042 7.960 ( 1.825 0.802 -0.318) 2.019 8.206 ( 3.622 0.104 -5.668) 6.727 8.650 ( -4.038 -1.181 9.487) 10.378 9.504 ( 6.929 1.491 8.577) 11.126 9.850 ( -2.701 0.397 0.808) 2.847 16.220 ( -3.027 -0.047 -5.953) 6.679 16.521 ( 5.617 2.766 3.539) 7.192 16.731 ( 1.135 -2.176 -1.982) 3.155 17.281 ( -4.218 3.914 6.591) 8.749 17.401 ( -0.405 -5.010 9.681) 10.908 18.259 ( 3.261 1.403 -18.148) 18.492 ======================= Grid point 493 (242/294) ======================= q-point: ( 0.33 0.33 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.255 ( -3.513 -10.121 19.366) 22.132 1.591 ( 6.692 2.980 18.787) 20.165 2.104 ( -0.605 4.777 16.198) 16.899 2.788 ( -6.208 2.313 -6.409) 9.218 2.983 ( 2.510 5.215 -12.050) 13.368 3.859 ( 1.629 -7.431 -10.914) 13.304 4.017 ( 0.601 0.530 -6.438) 6.487 4.047 ( -0.808 1.332 -5.882) 6.085 5.727 ( -0.318 -5.049 -3.960) 6.425 6.468 ( -1.158 -1.209 3.873) 4.220 6.584 ( 1.292 4.384 2.870) 5.397 7.513 ( -0.274 -8.696 11.313) 14.272 7.716 ( 0.365 -5.049 7.961) 9.434 7.846 ( 0.793 0.983 -1.016) 1.621 7.982 ( -1.336 8.791 6.365) 10.935 9.053 ( -0.439 -5.622 -4.847) 7.436 9.423 ( 1.586 -0.033 -8.361) 8.510 9.596 ( -0.723 5.857 -10.048) 11.653 16.202 ( -0.413 -4.229 5.590) 7.022 16.379 ( 0.193 4.494 5.658) 7.229 16.895 ( 2.145 -3.423 -4.477) 6.030 16.994 ( 0.734 1.998 -3.914) 4.455 17.188 ( -1.928 8.456 -5.596) 10.321 19.063 ( -0.638 -9.834 3.023) 10.308 ======================= Grid point 494 (243/294) ======================= q-point: ( 0.42 0.33 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.240 ( -0.577 -5.413 16.604) 17.474 1.827 ( 5.048 1.496 11.172) 12.351 2.182 ( 1.520 -4.194 5.142) 6.807 2.662 ( -7.568 6.947 -0.608) 10.291 3.064 ( 5.253 3.374 -1.581) 6.440 3.729 ( -4.056 -4.807 -11.575) 13.173 3.905 ( -4.022 0.546 -5.844) 7.116 4.114 ( 6.197 2.536 -5.314) 8.548 5.616 ( -3.309 -6.965 -3.755) 8.577 6.464 ( -0.711 -0.533 4.796) 4.878 6.678 ( 2.804 4.395 1.028) 5.314 7.413 ( -6.754 -8.549 8.359) 13.732 7.754 ( 3.270 -6.577 7.256) 10.325 7.881 ( 2.621 1.593 -0.668) 3.140 8.078 ( 1.826 4.923 3.454) 6.285 8.956 ( -2.602 -4.365 -2.261) 5.562 9.352 ( -6.118 4.128 -6.679) 9.954 9.649 ( 6.325 4.256 -8.461) 11.389 16.171 ( -1.855 -3.528 5.141) 6.505 16.465 ( 1.290 3.420 3.775) 5.254 16.858 ( 0.870 -3.968 -5.484) 6.825 16.988 ( -3.429 7.261 -1.942) 8.261 17.287 ( 7.769 6.225 -5.316) 11.286 18.908 ( -6.295 -13.496 3.078) 15.206 ======================= Grid point 495 (244/294) ======================= q-point: ( 0.50 0.33 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.322 ( 3.257 -0.035 10.699) 11.183 1.861 ( -3.070 -2.358 0.993) 3.997 2.126 ( 0.217 -11.672 -2.791) 12.003 2.718 ( 0.689 11.039 5.795) 12.487 3.195 ( 5.423 1.128 8.611) 10.239 3.504 ( -9.515 -2.905 -11.271) 15.033 3.842 ( -2.159 1.440 -4.005) 4.773 4.226 ( 6.911 4.250 -4.759) 9.406 5.458 ( -4.367 -7.764 -3.886) 9.719 6.493 ( 0.479 0.287 5.757) 5.784 6.756 ( 2.217 3.208 -1.158) 4.068 7.259 ( -6.773 -8.031 4.309) 11.355 7.771 ( 2.290 -5.237 3.672) 6.794 7.941 ( 3.026 1.267 -0.108) 3.283 8.166 ( 3.348 1.677 -0.439) 3.770 8.863 ( -3.940 -2.927 0.159) 4.911 9.268 ( -5.970 6.122 -2.046) 8.792 9.748 ( 5.987 3.237 -5.555) 8.785 16.153 ( 0.093 -2.571 4.442) 5.133 16.501 ( -1.821 2.889 -1.179) 3.613 16.790 ( -0.040 -4.619 -4.643) 6.550 17.031 ( -0.942 9.121 2.520) 9.509 17.450 ( 8.366 4.552 -3.857) 10.276 18.662 ( -8.437 -14.381 0.571) 16.683 ======================= Grid point 496 (245/294) ======================= q-point: ( 0.58 0.33 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.437 ( 3.900 2.057 2.725) 5.183 1.771 ( -3.277 -4.083 0.277) 5.243 1.973 ( -0.620 -13.886 -3.049) 14.231 2.852 ( -2.707 11.197 0.700) 11.541 3.259 ( -6.125 -0.259 -7.642) 9.797 3.371 ( 6.723 -3.498 8.913) 11.699 3.820 ( -2.307 4.218 1.620) 5.074 4.342 ( 4.250 3.459 -1.701) 5.738 5.298 ( -3.002 -6.751 -5.389) 9.145 6.544 ( 0.628 0.839 6.136) 6.224 6.791 ( 1.236 0.833 -3.805) 4.086 7.100 ( -5.371 -6.770 0.400) 8.651 7.790 ( 3.115 -2.636 1.472) 4.338 7.997 ( 2.495 1.008 -0.616) 2.761 8.185 ( -0.596 1.157 -6.615) 6.741 8.784 ( -2.857 -3.470 3.322) 5.589 9.265 ( -2.545 6.648 4.179) 8.255 9.831 ( 3.829 2.193 -2.760) 5.205 16.184 ( 3.359 -1.582 3.543) 5.132 16.451 ( -4.522 2.487 -5.388) 7.461 16.732 ( 0.562 -4.104 -2.233) 4.706 17.143 ( 0.808 9.034 5.543) 10.629 17.577 ( 4.028 1.842 0.722) 4.488 18.391 ( -6.762 -12.312 -5.764) 15.184 ======================= Grid point 497 (246/294) ======================= q-point: ( 0.67 0.33 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.479 ( 1.094 -1.899 -5.915) 6.308 1.695 ( -2.639 -3.669 3.278) 5.582 1.864 ( 2.807 -9.303 0.662) 9.740 2.798 ( -10.102 6.695 -7.710) 14.363 3.172 ( 0.294 2.716 -8.447) 8.877 3.515 ( 7.024 -5.387 11.259) 14.322 3.878 ( -0.353 6.839 7.661) 10.276 4.387 ( -1.532 -0.302 3.458) 3.795 5.193 ( 1.079 -2.624 -8.595) 9.051 6.591 ( -0.064 0.553 5.468) 5.497 6.753 ( -1.004 -2.763 -7.299) 7.869 6.986 ( -2.291 -3.055 -0.629) 3.870 7.842 ( 4.089 0.172 0.037) 4.093 8.008 ( -2.709 1.000 -4.136) 5.044 8.122 ( -0.678 1.401 -7.915) 8.067 8.744 ( -1.440 -4.042 6.408) 7.712 9.350 ( 1.403 5.289 7.676) 9.427 9.878 ( 1.298 0.927 -0.599) 1.704 16.269 ( 5.955 -0.947 1.481) 6.210 16.361 ( -4.177 2.032 -5.161) 6.943 16.704 ( 0.945 -2.794 -0.743) 3.041 17.277 ( 0.831 8.500 6.646) 10.822 17.600 ( -4.179 -3.278 8.090) 9.678 18.177 ( -0.253 -6.430 -15.108) 16.421 ======================= Grid point 498 (247/294) ======================= q-point: (-0.25 0.33 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.374 ( -5.188 -5.200 -2.470) 7.750 1.671 ( 1.625 -1.900 0.848) 2.640 1.873 ( 3.385 -2.014 -3.175) 5.059 2.633 ( -8.756 2.720 -6.955) 11.508 3.203 ( 5.759 3.432 -7.938) 10.390 3.602 ( 0.756 -5.386 12.726) 13.839 4.004 ( 2.475 5.477 7.521) 9.628 4.336 ( -4.790 -3.578 6.131) 8.563 5.186 ( 4.257 2.960 -10.662) 11.856 6.595 ( -0.513 -2.749 -3.498) 4.478 6.661 ( -2.745 -0.644 -0.752) 2.918 6.950 ( -0.096 -0.894 -0.773) 1.186 7.875 ( -6.839 -0.569 -7.914) 10.475 7.922 ( 3.034 4.120 -1.509) 5.335 8.125 ( 2.699 0.683 -4.542) 5.327 8.726 ( -1.595 -3.879 8.096) 9.118 9.484 ( 4.086 3.377 7.976) 9.577 9.883 ( -0.903 -0.571 0.431) 1.152 16.243 ( -3.618 -0.000 -5.891) 6.913 16.431 ( 8.231 1.570 2.063) 8.629 16.695 ( 0.656 -2.346 0.543) 2.496 17.399 ( -0.143 8.052 6.023) 10.057 17.489 ( -8.287 -6.945 10.239) 14.891 18.089 ( 4.698 -0.793 -18.530) 19.132 ======================= Grid point 505 (248/294) ======================= q-point: ( 0.33 0.42 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.313 ( 0.178 -4.579 17.218) 17.817 1.658 ( -2.827 -4.668 17.530) 18.360 2.157 ( 1.398 -2.181 0.931) 2.753 2.867 ( 6.132 14.381 -1.939) 15.754 3.044 ( -11.407 3.857 -4.104) 12.722 3.642 ( 6.679 -9.907 -11.056) 16.279 3.920 ( 4.909 0.211 -3.165) 5.845 4.106 ( -6.171 1.809 -6.070) 8.843 5.633 ( 2.579 -5.658 -4.051) 7.422 6.494 ( 0.357 0.468 4.719) 4.756 6.642 ( -2.229 2.921 1.436) 3.945 7.417 ( 6.614 -8.759 8.715) 14.014 7.779 ( -5.044 -4.146 8.777) 10.939 7.845 ( -0.935 0.594 -1.435) 1.813 8.099 ( -1.915 4.129 1.254) 4.721 8.972 ( 1.901 -3.541 -1.988) 4.484 9.306 ( 6.733 2.208 -6.757) 9.791 9.662 ( -5.783 4.750 -7.935) 10.907 16.192 ( 1.082 -2.267 5.534) 6.077 16.447 ( -0.079 2.019 2.662) 3.342 16.807 ( -0.329 -3.627 -3.095) 4.779 16.968 ( 3.125 3.683 -1.716) 5.126 17.323 ( -7.246 7.481 -5.638) 11.843 18.936 ( 5.133 -11.441 1.737) 12.659 ======================= Grid point 506 (249/294) ======================= q-point: ( 0.42 0.42 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.311 ( -2.759 -6.168 17.227) 18.505 1.797 ( 7.049 -2.498 16.335) 17.966 2.113 ( -0.673 -5.566 -6.075) 8.267 2.844 ( -7.622 0.324 -6.592) 10.082 3.099 ( 0.773 15.975 5.367) 16.871 3.602 ( 4.772 -6.258 -9.164) 12.080 3.969 ( -5.598 1.386 -5.130) 7.719 4.007 ( 4.794 1.867 -4.752) 7.004 5.559 ( -0.941 -7.951 -3.254) 8.643 6.505 ( -1.337 -0.076 4.493) 4.688 6.688 ( 1.637 4.124 0.879) 4.523 7.427 ( 0.030 -13.260 9.114) 16.090 7.718 ( -2.112 -4.165 7.516) 8.848 7.856 ( 1.690 1.334 -0.968) 2.361 8.097 ( 0.123 0.422 -2.160) 2.205 8.950 ( -0.963 -1.583 0.370) 1.889 9.416 ( 3.416 6.159 -2.920) 7.624 9.582 ( -1.995 5.061 -10.021) 11.402 16.193 ( -1.257 -3.552 5.526) 6.689 16.501 ( 1.333 3.419 1.605) 4.005 16.757 ( 1.373 -4.729 -4.406) 6.608 17.067 ( 2.492 7.275 0.329) 7.697 17.271 ( -2.633 7.735 -6.640) 10.529 18.847 ( -1.267 -16.290 2.818) 16.581 ======================= Grid point 507 (250/294) ======================= q-point: ( 0.50 0.42 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.358 ( 1.108 -1.052 14.572) 14.652 1.899 ( -0.614 -5.085 7.716) 9.261 1.974 ( -1.634 -9.744 -8.266) 12.882 2.786 ( 2.368 1.998 1.316) 3.366 3.242 ( -0.177 6.520 3.661) 7.479 3.530 ( -4.837 -0.453 -8.875) 10.118 3.890 ( -2.220 4.233 -1.431) 4.990 4.112 ( 7.462 3.695 -5.195) 9.814 5.425 ( -3.371 -9.334 -2.031) 10.130 6.525 ( 0.073 0.624 5.454) 5.490 6.749 ( 1.409 3.020 -1.307) 3.580 7.295 ( -5.081 -12.974 5.749) 15.072 7.706 ( 1.036 -5.025 4.673) 6.940 7.906 ( 2.759 1.503 -0.103) 3.144 8.110 ( 3.153 -0.623 -2.001) 3.786 8.906 ( -3.363 -1.147 0.256) 3.562 9.433 ( -6.440 8.424 -1.453) 10.702 9.637 ( 7.410 4.347 -6.687) 10.887 16.165 ( -1.505 -3.238 4.930) 6.087 16.544 ( -0.441 3.163 -2.382) 3.984 16.707 ( 1.070 -4.964 -3.196) 6.000 17.165 ( -1.564 10.349 3.112) 10.919 17.335 ( 6.788 5.822 -6.352) 10.969 18.638 ( -5.846 -18.347 2.647) 19.437 ======================= Grid point 508 (251/294) ======================= q-point: ( 0.58 0.42 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.463 ( 0.746 2.933 9.255) 9.737 1.808 ( -4.381 -7.738 2.543) 9.249 1.810 ( -0.577 -10.581 -5.375) 11.882 2.927 ( 6.251 4.450 2.840) 8.182 3.259 ( 2.513 -6.738 -2.518) 7.619 3.352 ( -10.599 3.546 -7.050) 13.214 3.950 ( -1.749 9.501 6.564) 11.680 4.256 ( 8.430 4.970 -5.156) 11.061 5.262 ( -4.093 -9.588 -1.141) 10.488 6.577 ( 0.832 1.238 6.020) 6.202 6.765 ( 0.103 0.420 -3.700) 3.725 7.118 ( -5.227 -9.987 2.081) 11.462 7.714 ( 2.836 -3.669 2.169) 5.119 7.963 ( 2.577 1.308 -0.320) 2.908 8.145 ( 2.448 -0.287 -2.817) 3.743 8.827 ( -4.190 -2.163 0.460) 4.738 9.414 ( -4.568 7.979 0.893) 9.238 9.760 ( 5.790 3.669 -3.045) 7.500 16.154 ( 0.581 -2.444 4.080) 4.791 16.507 ( -3.311 1.852 -6.856) 7.836 16.674 ( 0.778 -3.295 0.073) 3.387 17.272 ( -0.683 11.230 5.296) 12.435 17.483 ( 8.477 3.982 -4.542) 10.409 18.358 ( -7.974 -17.962 0.232) 19.654 ======================= Grid point 509 (252/294) ======================= q-point: ( 0.67 0.42 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.489 ( -4.037 1.696 0.154) 4.382 1.702 ( -1.042 -6.797 2.373) 7.275 1.735 ( 2.617 -7.605 3.515) 8.777 2.978 ( -6.436 5.836 -7.013) 11.165 3.136 ( -3.713 -0.805 -11.061) 11.695 3.340 ( 9.569 -6.876 6.260) 13.343 4.053 ( -2.799 9.674 8.998) 13.505 4.391 ( 4.059 3.805 -0.917) 5.639 5.120 ( -1.579 -6.866 -2.143) 7.364 6.622 ( -0.671 -0.288 2.877) 2.969 6.724 ( -0.943 -1.095 -2.871) 3.214 6.986 ( -2.694 -4.976 -0.143) 5.661 7.757 ( 4.595 -1.932 0.327) 4.996 8.007 ( 1.604 1.066 -0.986) 2.164 8.130 ( -2.034 2.047 -6.265) 6.898 8.756 ( -1.870 -4.193 3.670) 5.878 9.446 ( -1.542 6.485 3.304) 7.439 9.847 ( 3.113 1.676 -1.094) 3.701 16.189 ( 3.552 -1.568 2.617) 4.683 16.417 ( -4.234 1.375 -6.019) 7.486 16.666 ( 0.726 -1.798 0.759) 2.082 17.406 ( -0.362 11.033 6.496) 12.808 17.609 ( 4.977 1.276 -0.355) 5.150 18.065 ( -6.152 -14.683 -5.783) 16.938 ======================= Grid point 510 (253/294) ======================= q-point: (-0.25 0.42 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.421 ( -4.257 0.896 -0.146) 4.353 1.654 ( -0.706 -5.198 4.038) 6.620 1.763 ( 4.458 -2.980 1.061) 5.466 2.807 ( -12.339 4.504 -8.904) 15.869 3.078 ( 4.155 -0.517 -8.664) 9.623 3.491 ( 9.991 -5.944 6.405) 13.273 4.132 ( -2.729 5.951 7.828) 10.205 4.411 ( -3.760 -2.133 3.731) 5.710 5.091 ( 3.952 1.240 -4.908) 6.422 6.557 ( -2.375 -2.712 -5.485) 6.564 6.723 ( -1.649 1.834 4.225) 4.892 6.928 ( 0.020 -2.449 -1.284) 2.765 7.817 ( 4.205 -1.591 -1.949) 4.900 7.996 ( -3.842 3.715 -4.452) 6.956 8.089 ( -0.174 2.684 -4.586) 5.317 8.728 ( 0.270 -5.784 6.464) 8.678 9.520 ( 1.201 4.645 4.695) 6.713 9.876 ( 0.587 -1.183 -0.311) 1.357 16.242 ( 1.397 -0.410 -2.440) 2.841 16.363 ( 1.049 1.275 -0.424) 1.705 16.670 ( 0.738 -1.189 1.349) 1.944 17.526 ( -1.171 8.790 5.212) 10.286 17.607 ( -6.709 -7.047 8.929) 13.206 17.890 ( 4.883 -2.568 -15.667) 16.610 ======================= Grid point 517 (254/294) ======================= q-point: ( 0.33 0.50 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.379 ( -0.389 -0.072 12.740) 12.746 1.764 ( -5.860 -6.463 9.073) 12.587 2.089 ( 1.207 -4.214 -1.656) 4.686 2.861 ( 6.012 10.742 -4.849) 13.231 3.265 ( -6.765 5.220 3.477) 9.225 3.353 ( 7.597 -11.216 -8.764) 16.134 3.852 ( 3.013 2.249 0.371) 3.778 4.204 ( -6.842 2.563 -4.563) 8.614 5.499 ( 4.344 -5.186 -4.606) 8.184 6.523 ( 0.599 1.011 5.621) 5.743 6.716 ( -3.531 1.876 -0.573) 4.039 7.271 ( 6.428 -7.448 4.499) 10.818 7.821 ( 0.070 -1.558 2.425) 2.884 7.915 ( -5.796 -0.626 3.308) 6.703 8.122 ( -1.351 -2.329 -4.685) 5.403 8.911 ( 3.560 -0.059 0.482) 3.593 9.210 ( 4.582 3.854 -1.014) 6.073 9.755 ( -5.162 3.431 -5.340) 8.182 16.201 ( 0.020 -0.169 5.050) 5.053 16.426 ( 2.207 -1.318 -2.686) 3.718 16.804 ( -2.728 -3.136 -1.958) 4.594 16.972 ( 1.133 6.267 2.780) 6.949 17.469 ( -6.405 4.605 -3.170) 8.502 18.715 ( 8.405 -11.061 -1.939) 14.027 ======================= Grid point 518 (255/294) ======================= q-point: ( 0.42 0.50 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.402 ( -3.306 -4.762 13.811) 14.978 1.760 ( 3.811 -5.044 14.658) 15.963 2.040 ( -0.275 -2.833 -7.932) 8.427 2.882 ( -4.674 -1.214 -6.789) 8.332 3.257 ( -0.535 1.204 -1.838) 2.262 3.404 ( 9.603 4.047 -2.137) 10.638 3.950 ( 2.895 4.946 2.284) 6.169 4.072 ( -8.008 2.349 -6.372) 10.500 5.461 ( 1.442 -7.822 -3.267) 8.599 6.552 ( -1.124 -0.386 4.917) 5.058 6.711 ( 0.098 3.387 -0.302) 3.402 7.298 ( 4.367 -12.906 5.662) 14.754 7.812 ( -4.987 -3.358 9.015) 10.836 7.837 ( -0.461 0.801 -2.267) 2.448 8.057 ( 0.288 -2.609 -5.061) 5.701 8.951 ( 1.008 -0.019 0.336) 1.063 9.358 ( 6.993 7.173 -1.065) 10.074 9.669 ( -6.021 5.193 -6.137) 10.044 16.213 ( -0.836 -2.451 5.522) 6.099 16.460 ( 4.355 0.451 -4.369) 6.185 16.723 ( -2.442 -2.650 -0.364) 3.622 17.091 ( 2.834 8.080 3.028) 9.082 17.388 ( -6.260 6.393 -5.332) 10.416 18.678 ( 3.714 -16.893 0.358) 17.300 ======================= Grid point 519 (256/294) ======================= q-point: ( 0.50 0.50 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.410 ( 0.445 -2.989 12.840) 13.191 1.826 ( 0.702 -8.991 4.543) 10.098 1.964 ( -1.552 -1.419 -1.307) 2.476 2.754 ( -1.412 -3.153 -2.100) 4.043 3.223 ( 2.004 -6.389 -5.035) 8.378 3.616 ( 1.691 13.866 -1.864) 14.093 3.944 ( -2.504 3.218 -6.267) 7.477 4.055 ( 1.463 5.657 2.896) 6.521 5.365 ( -1.342 -9.644 -1.437) 9.843 6.562 ( -0.328 -0.195 5.320) 5.334 6.748 ( 0.885 2.536 -1.789) 3.227 7.228 ( 0.075 -14.992 4.094) 15.541 7.733 ( -4.819 -3.013 6.472) 8.614 7.874 ( 2.908 1.033 0.273) 3.098 8.039 ( 2.438 -1.255 -2.363) 3.620 8.942 ( -1.749 -0.578 -0.741) 1.985 9.525 ( 6.528 5.193 -6.617) 10.648 9.604 ( -5.146 8.466 -0.335) 9.913 16.194 ( -1.955 -3.106 5.293) 6.441 16.498 ( 3.724 -0.171 -7.936) 8.768 16.681 ( -1.311 -0.867 2.201) 2.704 17.240 ( 4.312 7.349 1.273) 8.615 17.347 ( -3.595 8.644 -2.878) 9.794 18.528 ( -1.241 -19.921 1.655) 20.028 ======================= Grid point 520 (257/294) ======================= q-point: ( 0.58 0.50 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.504 ( 4.749 -1.992 10.417) 11.621 1.707 ( -4.432 -5.552 -2.528) 7.540 1.881 ( -6.450 -5.539 3.423) 9.165 2.807 ( 9.374 -1.758 2.599) 9.885 3.141 ( 0.232 -7.755 -6.302) 9.995 3.563 ( -12.649 7.275 -8.147) 16.712 4.083 ( 8.732 11.318 0.806) 14.317 4.140 ( 1.301 5.039 1.328) 5.371 5.228 ( -3.209 -10.636 0.867) 11.143 6.605 ( 1.231 0.428 6.181) 6.317 6.748 ( -0.488 -0.048 -4.034) 4.064 7.095 ( -2.525 -11.379 2.436) 11.908 7.685 ( -1.321 -2.839 4.083) 5.145 7.933 ( 2.540 1.105 0.456) 2.807 8.079 ( 3.745 -0.439 0.016) 3.770 8.876 ( -4.048 -1.336 -1.886) 4.661 9.530 ( -1.903 5.517 -6.943) 9.070 9.712 ( 3.547 6.551 1.865) 7.679 16.164 ( -1.495 -2.701 4.563) 5.510 16.485 ( 1.130 -0.414 -8.254) 8.341 16.675 ( -1.360 0.467 2.396) 2.794 17.356 ( 6.111 5.002 -7.329) 10.774 17.430 ( -0.427 10.877 7.090) 12.991 18.294 ( -5.102 -20.439 1.932) 21.154 ======================= Grid point 521 (258/294) ======================= q-point: ( 0.67 0.50 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.576 ( -0.694 -5.684 -0.502) 5.748 1.632 ( 0.030 2.353 8.719) 9.031 1.736 ( -5.078 -6.826 3.582) 9.231 2.961 ( 4.520 -0.280 -4.778) 6.583 3.049 ( 5.639 -7.724 -1.329) 9.656 3.361 ( -11.921 5.132 -7.322) 14.902 4.202 ( -0.544 4.582 2.424) 5.212 4.335 ( 7.732 9.793 -0.272) 12.480 5.087 ( -3.059 -9.395 3.164) 10.374 6.645 ( -1.849 -2.044 1.969) 3.388 6.713 ( 1.206 0.639 -0.598) 1.491 6.980 ( -2.606 -5.925 0.784) 6.520 7.685 ( 2.037 -1.992 1.895) 3.422 7.981 ( 2.069 0.945 -0.240) 2.288 8.128 ( 1.526 1.016 -0.628) 1.938 8.779 ( -3.900 -2.721 -0.862) 4.832 9.530 ( -0.892 5.547 -3.174) 6.453 9.814 ( 2.542 2.721 0.435) 3.749 16.157 ( 0.645 -1.761 3.511) 3.980 16.441 ( -1.521 0.887 -6.005) 6.258 16.670 ( -1.176 0.418 1.833) 2.218 17.484 ( 8.792 4.412 -7.379) 12.297 17.562 ( -0.886 10.074 6.492) 12.018 18.016 ( -7.308 -18.593 2.376) 20.119 ======================= Grid point 522 (259/294) ======================= q-point: ( 0.75 0.50 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.505 ( -4.220 -0.972 2.171) 4.845 1.644 ( -1.321 -2.519 1.871) 3.405 1.710 ( 1.976 -2.499 6.793) 7.503 2.889 ( -1.089 -2.820 -6.879) 7.513 3.068 ( -5.692 3.450 -6.894) 9.583 3.310 ( 7.617 -1.169 1.856) 7.927 4.232 ( -0.893 1.944 1.036) 2.377 4.453 ( -0.812 0.197 0.437) 0.943 5.038 ( 1.960 -0.646 3.457) 4.026 6.563 ( -3.378 -1.356 -2.449) 4.387 6.776 ( 1.292 2.337 4.076) 4.872 6.900 ( -1.640 -3.824 -1.123) 4.310 7.730 ( 3.950 -0.717 0.247) 4.023 8.013 ( 1.087 0.837 -1.149) 1.790 8.131 ( -2.266 3.824 -3.325) 5.551 8.705 ( -1.060 -5.174 2.551) 5.865 9.567 ( 0.603 4.768 -0.244) 4.812 9.847 ( 0.786 -1.434 -0.483) 1.705 16.193 ( 2.791 -0.445 1.808) 3.355 16.388 ( -2.616 1.448 -3.087) 4.298 16.672 ( -0.331 0.575 1.912) 2.024 17.584 ( 3.645 -2.318 -6.090) 7.466 17.647 ( -0.901 1.710 -1.041) 2.196 17.801 ( -3.502 -1.990 6.938) 8.022 ======================= Grid point 530 (260/294) ======================= q-point: ( 0.33 0.58 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.470 ( -2.932 1.675 6.342) 7.185 1.800 ( -0.863 -2.571 -1.002) 2.891 2.036 ( -0.264 -5.540 -1.070) 5.648 2.827 ( 6.561 7.698 -1.949) 10.301 3.079 ( 5.212 -10.392 -4.709) 12.543 3.398 ( -4.540 -2.567 1.567) 5.446 3.893 ( 0.683 8.469 6.121) 10.472 4.310 ( -5.104 1.968 -1.425) 5.653 5.350 ( 4.301 -3.990 -6.451) 8.720 6.558 ( 0.191 0.723 5.601) 5.651 6.778 ( -3.106 1.417 -2.781) 4.403 7.123 ( 5.563 -5.921 0.070) 8.125 7.807 ( -0.061 -2.301 -0.960) 2.494 8.000 ( -1.781 0.247 -0.557) 1.883 8.087 ( -2.965 -3.050 -2.795) 5.090 8.837 ( 4.936 -1.020 -0.294) 5.049 9.241 ( -0.066 6.277 6.824) 9.272 9.825 ( -3.225 1.685 -2.881) 4.641 16.246 ( -1.944 0.365 3.385) 3.921 16.355 ( 1.862 -1.100 -3.859) 4.424 16.780 ( -0.087 -2.037 -3.506) 4.056 17.082 ( -2.307 6.816 6.961) 10.012 17.571 ( -3.122 0.864 1.796) 3.704 18.451 ( 8.038 -9.050 -8.359) 14.710 ======================= Grid point 531 (261/294) ======================= q-point: ( 0.42 0.58 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.480 ( -2.492 -2.740 8.797) 9.544 1.744 ( 0.074 -4.931 6.059) 7.812 1.977 ( 0.234 -2.144 -7.338) 7.648 2.907 ( -1.552 -0.381 -2.230) 2.744 3.094 ( 5.445 -8.512 -1.791) 10.262 3.358 ( 5.206 4.223 -2.250) 7.071 4.034 ( 0.426 9.510 7.803) 12.309 4.206 ( -8.666 4.154 -5.178) 10.916 5.330 ( 3.229 -7.244 -4.230) 8.989 6.586 ( -0.462 -1.444 5.165) 5.383 6.744 ( -1.324 2.676 -2.171) 3.691 7.135 ( 4.439 -10.173 1.528) 11.204 7.790 ( 1.875 -1.474 -1.964) 3.090 7.955 ( -6.268 -0.566 5.420) 8.305 8.007 ( -0.699 -2.232 -2.525) 3.441 8.897 ( 4.371 -0.775 -2.524) 5.106 9.359 ( 2.094 7.362 3.689) 8.497 9.771 ( -4.091 3.949 -3.247) 6.548 16.234 ( -0.642 -1.972 3.383) 3.969 16.372 ( 2.681 0.209 -3.576) 4.474 16.728 ( -1.130 -2.020 -2.012) 3.067 17.186 ( -0.362 9.690 6.978) 11.947 17.510 ( -5.599 3.484 -2.712) 7.131 18.423 ( 6.897 -15.800 -3.989) 17.695 ======================= Grid point 532 (262/294) ======================= q-point: ( 0.50 0.58 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.439 ( -2.033 -4.188 6.100) 7.673 1.779 ( 2.094 -5.774 7.388) 9.608 1.934 ( 1.676 -0.829 -4.622) 4.986 2.778 ( -7.174 -4.989 -0.403) 8.747 3.075 ( 4.021 -7.344 -1.417) 8.491 3.584 ( 12.325 9.383 -3.619) 15.907 4.047 ( -9.631 3.414 -7.392) 12.612 4.170 ( -1.415 10.686 7.059) 12.885 5.268 ( 1.054 -9.407 -2.008) 9.676 6.587 ( -0.200 -2.397 5.257) 5.781 6.748 ( 0.051 2.026 -2.611) 3.306 7.094 ( 2.200 -11.388 1.743) 11.729 7.822 ( 2.420 0.995 -2.222) 3.433 7.858 ( -6.374 -3.626 9.481) 11.986 7.996 ( 0.934 0.346 -0.839) 1.302 8.926 ( 1.856 -0.928 -3.074) 3.709 9.464 ( 2.851 5.445 -3.984) 7.325 9.746 ( -3.337 6.664 0.076) 7.453 16.224 ( -1.132 -2.683 4.787) 5.603 16.390 ( 2.994 -0.081 -6.206) 6.891 16.702 ( -0.086 -0.047 0.203) 0.226 17.292 ( -1.745 7.886 1.554) 8.225 17.472 ( -2.359 7.326 0.759) 7.734 18.325 ( 3.304 -19.627 -0.990) 19.928 ======================= Grid point 533 (263/294) ======================= q-point: ( 0.58 0.58 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.434 ( 2.743 -4.356 4.396) 6.769 1.764 ( -2.496 -0.352 2.925) 3.861 1.917 ( -1.757 -6.975 3.170) 7.861 2.682 ( 2.414 -3.946 0.995) 4.732 3.052 ( 0.310 -4.416 -1.317) 4.619 3.751 ( -5.054 6.847 -9.148) 12.494 3.955 ( 5.972 5.104 -5.688) 9.699 4.281 ( -1.408 9.553 6.355) 11.560 5.171 ( -1.040 -10.202 1.318) 10.339 6.611 ( 1.730 -1.803 6.203) 6.687 6.732 ( -0.769 -0.648 -3.906) 4.033 7.029 ( 0.160 -8.199 1.807) 8.397 7.749 ( -5.740 -2.731 5.600) 8.471 7.901 ( 3.277 0.394 1.848) 3.783 8.031 ( 2.505 0.945 1.481) 3.060 8.898 ( -1.682 -1.418 -3.596) 4.215 9.507 ( 2.120 4.579 -9.500) 10.757 9.786 ( -1.159 6.233 2.956) 6.995 16.198 ( -2.211 -2.875 5.151) 6.300 16.405 ( 2.903 1.019 -6.335) 7.043 16.714 ( -0.208 1.275 0.837) 1.539 17.306 ( 0.096 4.701 -5.750) 7.428 17.577 ( 0.079 10.264 6.413) 12.103 18.157 ( -0.606 -20.532 1.867) 20.626 ======================= Grid point 534 (264/294) ======================= q-point: ( 0.67 0.58 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.496 ( 4.783 -2.345 5.869) 7.926 1.740 ( -2.995 1.592 0.682) 3.460 1.782 ( -6.613 -9.967 7.422) 14.076 2.783 ( 11.284 -2.105 -0.003) 11.478 2.982 ( -3.701 -2.142 -1.727) 4.612 3.569 ( -12.308 4.825 -9.938) 16.539 4.128 ( 9.006 3.552 -5.831) 11.302 4.383 ( 0.903 7.350 2.599) 7.848 5.075 ( -2.181 -8.064 6.522) 10.598 6.663 ( -1.189 -3.359 3.784) 5.198 6.685 ( 2.217 0.419 -0.885) 2.424 6.969 ( -1.401 -4.400 1.231) 4.779 7.686 ( -2.344 -2.053 4.297) 5.308 7.956 ( 2.099 0.553 0.653) 2.267 8.104 ( 3.055 1.145 2.888) 4.357 8.810 ( -3.925 -2.062 -4.189) 6.100 9.532 ( 2.047 5.046 -8.359) 9.976 9.832 ( -0.460 2.567 1.688) 3.106 16.170 ( -1.359 -2.074 4.411) 5.061 16.427 ( 1.080 2.662 -4.312) 5.181 16.716 ( -1.614 1.320 0.928) 2.282 17.352 ( 5.353 3.390 -7.239) 9.621 17.686 ( -0.689 6.727 -0.001) 6.762 17.972 ( -3.482 -15.495 9.831) 18.678 ======================= Grid point 536 (265/294) ======================= q-point: (-0.25 -0.42 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.564 ( -2.319 -3.553 7.296) 8.440 1.653 ( -1.182 -1.742 1.408) 2.533 1.720 ( -0.810 -3.456 6.646) 7.535 2.881 ( -3.854 2.112 -3.865) 5.853 2.969 ( 11.059 -2.425 -1.119) 11.377 3.379 ( -9.597 4.774 -6.232) 12.399 4.206 ( 2.829 -0.289 -5.408) 6.110 4.444 ( 1.075 -0.234 -2.755) 2.967 5.059 ( -0.058 -0.423 10.557) 10.565 6.601 ( -2.756 -0.558 -0.421) 2.843 6.761 ( 3.611 -0.572 3.650) 5.166 6.909 ( -2.746 -2.171 0.457) 3.530 7.690 ( 1.484 -0.166 3.021) 3.370 7.991 ( 1.563 0.306 -0.254) 1.612 8.167 ( 0.713 2.233 1.547) 2.808 8.700 ( -3.266 -3.505 -3.041) 5.674 9.575 ( 2.193 5.019 -5.202) 7.554 9.830 ( -0.890 -1.706 -0.027) 1.924 16.174 ( 0.770 -0.825 3.601) 3.774 16.428 ( -1.863 3.016 -2.965) 4.622 16.710 ( -1.290 1.543 1.874) 2.749 17.417 ( 5.201 -2.849 -9.391) 11.107 17.639 ( -0.950 -4.227 -4.789) 6.458 17.944 ( -3.038 3.174 15.383) 15.998 ======================= Grid point 543 (266/294) ======================= q-point: ( 0.33 0.67 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.574 ( -4.826 3.463 -1.196) 6.059 1.733 ( 5.307 -2.131 -2.849) 6.390 1.943 ( 2.123 -6.512 -7.010) 9.801 2.762 ( 7.519 5.871 0.426) 9.549 2.975 ( -3.614 -6.491 -0.030) 7.429 3.439 ( -4.627 -5.971 4.650) 8.871 4.016 ( 0.400 9.210 6.966) 11.555 4.376 ( -0.495 0.648 3.307) 3.406 5.222 ( 1.629 -2.148 -10.128) 10.480 6.592 ( -0.066 0.155 4.920) 4.923 6.797 ( -0.336 0.990 -6.528) 6.611 6.991 ( 3.496 -3.958 -1.537) 5.500 7.767 ( -0.645 -3.700 -4.472) 5.840 7.979 ( 0.930 0.133 -2.166) 2.361 8.141 ( -3.005 2.014 -0.977) 3.747 8.747 ( 3.647 -3.592 2.560) 5.723 9.378 ( -2.654 6.760 9.062) 11.613 9.854 ( -1.037 -0.501 -0.861) 1.438 16.249 ( 0.150 -2.839 -4.323) 5.174 16.365 ( -2.790 3.151 2.442) 4.866 16.749 ( -0.258 -0.709 -2.786) 2.886 17.221 ( -1.484 5.620 7.572) 9.546 17.597 ( 2.749 -2.635 8.321) 9.151 18.218 ( 2.616 -4.895 -16.240) 17.162 ======================= Grid point 544 (267/294) ======================= q-point: ( 0.42 0.67 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.540 ( -2.641 -0.708 3.767) 4.655 1.722 ( -0.135 -3.598 -1.687) 3.977 1.875 ( 2.806 -4.699 -10.077) 11.468 2.867 ( 2.272 -2.964 3.364) 5.026 3.012 ( 4.454 2.900 2.907) 6.058 3.309 ( -2.490 -4.004 -1.054) 4.831 4.149 ( 0.665 6.543 6.648) 9.351 4.358 ( -5.537 5.609 -0.693) 7.912 5.179 ( 3.380 -5.740 -6.980) 9.648 6.601 ( -0.596 -2.675 3.865) 4.738 6.770 ( -0.877 2.417 -4.021) 4.773 6.992 ( 3.405 -6.481 -0.617) 7.347 7.729 ( 1.726 -1.082 -3.171) 3.769 7.985 ( 0.220 0.972 -0.781) 1.266 8.090 ( -5.486 -0.066 3.681) 6.607 8.787 ( 4.818 -2.619 -1.729) 5.750 9.451 ( -1.645 6.114 5.578) 8.438 9.830 ( -1.457 1.567 -1.207) 2.457 16.216 ( 0.851 -1.413 -2.623) 3.099 16.365 ( -1.386 0.742 2.245) 2.740 16.710 ( -0.774 -1.231 -2.769) 3.128 17.336 ( 0.163 9.730 8.925) 13.204 17.603 ( -3.922 0.335 1.965) 4.400 18.133 ( 6.257 -12.372 -10.614) 17.460 ======================= Grid point 545 (268/294) ======================= q-point: ( 0.50 0.67 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.479 ( -4.244 -3.661 2.057) 5.970 1.716 ( 3.566 -2.895 2.048) 5.029 1.839 ( 3.620 -2.775 -7.778) 9.017 2.866 ( -6.258 -5.204 4.624) 9.361 2.987 ( -0.046 -3.818 4.936) 6.240 3.425 ( 12.313 6.621 -3.906) 14.516 4.169 ( -5.699 1.928 -3.121) 6.778 4.352 ( -3.758 9.940 2.831) 10.997 5.137 ( 2.797 -7.503 -3.296) 8.659 6.582 ( 0.090 -4.548 4.552) 6.436 6.757 ( -1.084 1.955 -3.672) 4.299 6.979 ( 2.537 -6.213 0.680) 6.745 7.765 ( 3.644 1.358 -0.926) 3.997 7.983 ( -3.601 -1.833 3.369) 5.261 8.016 ( -3.981 0.861 4.479) 6.054 8.831 ( 5.021 -1.696 -4.556) 6.988 9.488 ( -1.523 4.400 -1.222) 4.814 9.832 ( -0.963 3.685 0.372) 3.826 16.220 ( 1.411 -0.592 0.167) 1.539 16.354 ( -0.908 -0.342 0.140) 0.980 16.687 ( 0.697 -0.182 -1.701) 1.847 17.456 ( -6.075 9.350 3.217) 11.605 17.559 ( -0.161 4.439 2.529) 5.111 18.053 ( 6.218 -17.435 -4.259) 18.994 ======================= Grid point 546 (269/294) ======================= q-point: ( 0.58 0.67 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.408 ( -0.904 -3.020 2.716) 4.161 1.762 ( 2.460 -1.609 -1.870) 3.483 1.848 ( 3.870 -4.641 1.550) 6.238 2.688 ( -7.105 -6.522 4.049) 10.460 3.040 ( 1.079 1.005 5.621) 5.811 3.665 ( 11.813 5.491 -6.493) 14.555 4.023 ( -9.066 3.521 -8.110) 12.664 4.404 ( -1.353 5.072 1.669) 5.509 5.099 ( 0.984 -5.989 2.480) 6.556 6.588 ( 1.992 -4.054 6.282) 7.738 6.720 ( -1.428 -0.579 -3.974) 4.263 6.970 ( 1.263 -3.653 1.279) 4.071 7.841 ( 1.395 2.835 -0.262) 3.171 7.884 ( -4.961 -5.002 8.844) 11.307 8.036 ( 0.364 2.260 2.596) 3.461 8.851 ( 2.468 -1.839 -5.485) 6.289 9.483 ( -0.434 4.454 -7.251) 8.521 9.861 ( -0.658 3.273 1.258) 3.567 16.231 ( -0.976 -2.326 4.813) 5.434 16.355 ( 1.673 2.974 -3.484) 4.877 16.706 ( 1.875 0.530 -0.920) 2.154 17.379 ( -6.713 4.964 -4.798) 9.630 17.677 ( 1.294 6.519 1.859) 6.901 17.968 ( 3.774 -16.335 5.686) 17.703 ======================= Grid point 548 (270/294) ======================= q-point: (-0.33 -0.33 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.444 ( 4.477 -2.374 7.627) 9.157 1.722 ( -0.434 -3.893 -5.102) 6.433 1.860 ( -2.778 -4.315 9.300) 10.622 2.626 ( 3.904 -3.011 0.826) 4.999 3.072 ( -4.031 4.163 4.629) 7.416 3.695 ( -6.068 0.908 -13.349) 14.691 3.994 ( 6.373 5.460 -4.815) 9.675 4.410 ( 0.161 -0.603 -3.067) 3.130 5.096 ( -0.915 -1.722 9.692) 9.886 6.639 ( 3.205 -1.850 3.446) 5.057 6.666 ( -1.060 -2.666 0.796) 2.978 6.960 ( -0.261 -1.913 1.003) 2.176 7.767 ( -6.047 -2.623 6.442) 9.216 7.928 ( 2.654 0.475 1.488) 3.079 8.097 ( 2.045 2.272 4.159) 5.162 8.804 ( -1.384 -2.579 -6.287) 6.935 9.492 ( 1.854 5.502 -9.199) 10.877 9.873 ( -1.223 0.867 0.486) 1.576 16.206 ( -2.074 -2.728 5.345) 6.350 16.418 ( 2.213 5.847 -2.684) 6.804 16.733 ( 1.028 0.438 -0.508) 1.227 17.316 ( -1.898 3.647 -5.986) 7.262 17.658 ( 0.341 -6.885 -9.417) 11.670 17.997 ( 0.726 -1.714 18.581) 18.674 ======================= Grid point 549 (271/294) ======================= q-point: (-0.25 -0.33 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.537 ( 4.642 -9.308 7.610) 12.888 1.690 ( -0.114 3.789 4.560) 5.930 1.770 ( -6.996 -6.418 7.165) 11.894 2.742 ( 11.250 0.469 -3.629) 11.831 3.038 ( -8.612 6.847 1.723) 11.136 3.498 ( -7.067 -0.208 -11.375) 13.393 4.108 ( 4.568 1.249 -5.472) 7.236 4.380 ( 2.056 -2.705 -5.712) 6.646 5.149 ( -1.240 2.184 13.503) 13.735 6.616 ( -0.427 -0.387 -3.504) 3.551 6.721 ( 2.895 -3.137 8.905) 9.875 6.936 ( -1.574 -0.790 0.652) 1.878 7.716 ( -2.023 -0.862 5.760) 6.165 7.968 ( 1.416 0.156 0.230) 1.443 8.181 ( 1.933 2.222 4.638) 5.494 8.696 ( -3.278 -3.255 -7.163) 8.523 9.539 ( 3.238 5.896 -7.922) 10.393 9.839 ( -2.210 -2.008 -0.356) 3.007 16.189 ( -0.847 -1.652 4.846) 5.189 16.475 ( -0.861 5.446 -2.479) 6.045 16.745 ( 0.094 0.747 1.280) 1.485 17.292 ( 0.587 -1.980 -7.513) 7.791 17.547 ( 2.010 -5.217 -7.691) 9.508 18.111 ( -1.556 3.774 17.376) 17.849 ======================= Grid point 641 (272/294) ======================= q-point: ( 0.33 0.33 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 294 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.558 ( -0.000 0.000 16.976) 16.976 1.558 ( -0.000 0.000 16.976) 16.976 2.184 ( -0.000 0.000 22.412) 22.412 2.784 ( 0.000 -0.000 -11.429) 11.429 2.784 ( 0.000 -0.000 -11.429) 11.429 3.887 ( 0.000 -0.000 -12.952) 12.952 3.980 ( 0.000 -0.000 -5.049) 5.049 3.980 ( 0.000 -0.000 -5.049) 5.049 5.749 ( 0.000 -0.000 -4.806) 4.806 6.529 ( -0.000 0.000 3.226) 3.226 6.529 ( -0.000 0.000 3.226) 3.226 7.681 ( -0.000 0.000 10.718) 10.718 7.832 ( 0.000 -0.000 -0.184) 0.184 7.868 ( -0.000 0.000 8.204) 8.204 7.868 ( -0.000 0.000 8.204) 8.204 9.080 ( 0.000 -0.000 -5.830) 5.830 9.423 ( 0.000 -0.000 -9.925) 9.925 9.423 ( 0.000 -0.000 -9.925) 9.925 16.324 ( -0.000 0.000 6.018) 6.018 16.324 ( -0.000 0.000 6.018) 6.018 16.912 ( 0.000 -0.000 -2.581) 2.581 17.008 ( 0.000 -0.000 -5.482) 5.482 17.008 ( 0.000 -0.000 -5.482) 5.482 19.171 ( -0.000 0.000 2.251) 2.251 ======================= Grid point 642 (273/294) ======================= q-point: ( 0.42 0.33 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.474 ( -5.738 -6.941 17.182) 19.399 1.793 ( 2.537 6.523 10.975) 13.017 2.274 ( -3.940 1.316 11.629) 12.349 2.632 ( 1.879 -7.194 -5.637) 9.331 2.929 ( 10.261 8.114 -5.962) 14.376 3.736 ( -7.561 -2.072 -10.695) 13.260 3.897 ( -1.995 -2.784 -3.844) 5.148 4.032 ( 4.477 3.072 -5.997) 8.089 5.680 ( -3.529 -2.313 -4.503) 6.171 6.513 ( -0.434 -1.453 4.299) 4.559 6.610 ( 2.887 2.930 1.297) 4.313 7.605 ( -9.461 -5.967 9.641) 14.767 7.832 ( 0.272 0.408 -0.814) 0.950 7.895 ( 0.050 1.496 7.665) 7.810 8.022 ( 5.672 1.739 5.450) 8.056 9.006 ( -2.949 -2.211 -4.525) 5.836 9.273 ( -4.508 -1.043 -7.309) 8.650 9.516 ( 8.160 4.044 -9.211) 12.953 16.269 ( -3.607 -2.724 6.127) 7.614 16.435 ( 2.354 1.859 3.877) 4.902 16.869 ( -3.631 2.732 -2.376) 5.128 16.908 ( -0.085 -3.080 -3.404) 4.591 17.146 ( 9.989 4.564 -6.126) 12.575 19.097 ( -7.411 -4.695 2.063) 9.012 ======================= Grid point 643 (274/294) ======================= q-point: ( 0.50 0.33 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 868 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.451 ( -1.850 -4.890 14.778) 15.675 1.864 ( -2.428 2.031 0.289) 3.179 2.232 ( -6.467 2.144 2.083) 7.125 2.643 ( 6.529 -4.243 0.286) 7.792 3.171 ( 11.045 5.796 3.285) 12.899 3.499 ( -11.347 -2.397 -8.316) 14.271 3.827 ( -1.365 -2.183 -2.216) 3.397 4.117 ( 6.184 4.142 -5.897) 9.496 5.549 ( -5.525 -4.051 -3.870) 7.869 6.533 ( 0.791 -1.041 5.380) 5.537 6.687 ( 2.643 3.190 -0.814) 4.222 7.430 ( -10.398 -6.429 7.097) 14.136 7.833 ( 0.161 -0.316 -0.770) 0.848 7.947 ( 1.201 0.314 4.166) 4.347 8.121 ( 1.877 2.325 -1.059) 3.170 8.917 ( -2.582 -2.881 -1.061) 4.011 9.188 ( -2.273 0.788 -1.018) 2.612 9.640 ( 7.813 4.091 -7.322) 11.462 16.235 ( -1.525 -2.605 6.067) 6.776 16.453 ( -2.393 1.058 -1.816) 3.185 16.838 ( -1.345 -0.979 -3.585) 3.952 16.912 ( 2.383 3.119 3.437) 5.218 17.328 ( 10.606 4.919 -6.051) 13.165 18.883 ( -12.080 -8.033 0.857) 14.533 ======================= Grid point 644 (275/294) ======================= q-point: ( 0.58 0.33 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.476 ( 0.414 -2.783 8.229) 8.697 1.810 ( -2.391 -0.629 -3.104) 3.968 2.137 ( -4.595 -2.980 -2.524) 6.031 2.719 ( 2.275 1.008 1.277) 2.797 3.228 ( -9.900 -1.368 -6.069) 11.693 3.427 ( 6.377 4.361 7.569) 10.815 3.799 ( 1.555 -2.160 1.069) 2.868 4.238 ( 6.871 4.971 -5.018) 9.854 5.387 ( -6.240 -4.926 -3.605) 8.729 6.575 ( 0.962 -0.438 5.838) 5.933 6.741 ( 2.000 2.204 -2.863) 4.130 7.234 ( -9.481 -6.233 2.465) 11.611 7.825 ( 0.004 -0.373 -0.693) 0.787 7.988 ( 1.613 0.035 0.654) 1.741 8.110 ( -1.989 2.011 -7.156) 7.694 8.859 ( -2.042 -2.445 2.222) 3.884 9.212 ( 1.712 1.814 6.467) 6.932 9.753 ( 5.908 3.491 -4.936) 8.453 16.246 ( 1.359 -1.925 5.656) 6.127 16.384 ( -4.307 1.248 -4.928) 6.663 16.780 ( -0.963 -2.072 -3.376) 4.076 17.041 ( 4.250 4.607 6.620) 9.117 17.502 ( 8.615 4.524 -4.149) 10.578 18.580 ( -13.909 -9.403 -2.453) 16.967 ======================= Grid point 645 (276/294) ======================= q-point: ( 0.67 0.33 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 868 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.489 ( 1.725 -2.633 -2.073) 3.769 1.761 ( -1.988 -1.017 0.810) 2.376 2.004 ( -4.682 -4.596 -4.349) 7.871 2.706 ( -2.957 -1.383 -2.232) 3.955 3.079 ( -4.417 2.391 -3.678) 6.226 3.585 ( 0.596 6.375 9.680) 11.606 3.865 ( 7.284 -3.415 4.724) 9.329 4.356 ( 4.461 3.668 -2.025) 6.120 5.222 ( -5.303 -4.071 -5.120) 8.421 6.618 ( 0.553 -0.118 5.429) 5.459 6.747 ( 0.017 -0.475 -5.632) 5.652 7.052 ( -6.332 -4.256 -0.954) 7.689 7.817 ( -1.487 2.190 -2.158) 3.415 7.971 ( -2.299 -0.196 -4.928) 5.441 8.077 ( 2.493 -0.632 -4.271) 4.985 8.824 ( -2.709 -0.961 4.475) 5.319 9.335 ( 4.786 1.638 9.842) 11.066 9.835 ( 3.159 2.547 -2.494) 4.763 16.293 ( -4.256 1.160 -5.635) 7.156 16.309 ( 4.288 -0.838 4.584) 6.333 16.739 ( -0.075 -1.247 -2.056) 2.406 17.191 ( 3.960 3.979 6.965) 8.945 17.634 ( 4.145 2.510 0.908) 4.930 18.247 ( -11.805 -8.041 -8.914) 16.837 ======================= Grid point 654 (277/294) ======================= q-point: ( 0.42 0.42 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.561 ( -2.866 -9.345 15.602) 18.411 1.856 ( 3.539 4.371 10.738) 12.122 2.261 ( 2.453 -11.275 2.720) 11.855 2.738 ( -12.270 6.656 -3.841) 14.478 2.830 ( 8.409 13.159 -1.377) 15.677 3.682 ( 1.718 -6.533 -8.564) 10.908 3.920 ( -4.426 0.734 -4.476) 6.337 3.953 ( 3.466 1.298 -4.759) 6.029 5.653 ( -0.190 -4.266 -4.063) 5.894 6.536 ( -1.003 -0.691 3.696) 3.892 6.618 ( 1.036 3.618 0.986) 3.891 7.696 ( -0.714 -8.144 8.977) 12.142 7.821 ( 0.727 -2.088 0.553) 2.279 7.872 ( 0.276 -3.519 7.567) 8.350 8.057 ( -0.456 3.606 1.812) 4.061 8.983 ( -0.405 -2.394 -2.967) 3.834 9.302 ( 2.018 3.040 -5.055) 6.234 9.418 ( -1.383 5.682 -10.026) 11.607 16.305 ( -0.644 -4.545 6.062) 7.604 16.459 ( 0.584 2.771 2.948) 4.088 16.821 ( 1.585 -4.544 -3.247) 5.805 16.954 ( -0.068 4.234 -0.829) 4.315 17.080 ( -1.179 7.945 -6.661) 10.435 19.106 ( -0.262 -9.203 1.887) 9.398 ======================= Grid point 655 (278/294) ======================= q-point: ( 0.50 0.42 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.521 ( -2.629 -6.564 15.291) 16.847 1.930 ( -3.115 1.429 0.118) 3.429 2.192 ( 2.032 -13.264 -1.548) 13.508 2.676 ( -2.163 8.923 1.245) 9.265 3.092 ( 8.223 10.795 3.299) 13.966 3.553 ( -5.085 -5.455 -8.264) 11.131 3.837 ( -2.533 0.326 -1.613) 3.021 4.022 ( 5.340 2.926 -4.831) 7.773 5.555 ( -3.249 -5.938 -2.819) 7.332 6.547 ( 0.181 0.003 4.549) 4.553 6.679 ( 1.735 3.511 -1.000) 4.042 7.561 ( -9.013 -10.280 8.053) 15.867 7.807 ( 0.665 -2.649 -0.859) 2.863 7.918 ( 2.638 -2.750 4.296) 5.742 8.097 ( 2.410 0.922 -1.088) 2.800 8.931 ( -2.326 -1.511 -0.762) 2.877 9.279 ( -4.982 6.438 -1.305) 8.245 9.502 ( 8.572 5.160 -7.937) 12.771 16.268 ( -2.109 -4.226 5.911) 7.566 16.488 ( -0.985 1.576 -1.731) 2.540 16.784 ( 0.961 -4.696 -2.299) 5.316 16.993 ( -1.664 9.021 2.158) 9.423 17.182 ( 8.353 6.243 -6.244) 12.155 18.950 ( -6.946 -12.848 1.748) 14.710 ======================= Grid point 656 (279/294) ======================= q-point: ( 0.58 0.42 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.518 ( -2.503 -2.907 10.434) 11.117 1.852 ( -4.153 -0.431 -1.455) 4.421 2.055 ( 0.027 -13.395 -4.587) 14.159 2.787 ( 0.319 9.759 1.906) 9.949 3.291 ( -0.740 1.599 -1.871) 2.570 3.365 ( 1.243 -4.539 -0.700) 4.757 3.833 ( -1.533 4.878 3.040) 5.949 4.132 ( 7.539 4.607 -5.652) 10.488 5.412 ( -5.158 -6.873 -1.288) 8.689 6.590 ( 0.955 0.683 5.060) 5.195 6.720 ( 1.255 2.134 -2.899) 3.812 7.336 ( -9.985 -10.652 3.845) 15.098 7.792 ( 1.384 -2.987 -0.241) 3.301 7.955 ( 2.210 -0.734 1.339) 2.687 8.110 ( -0.467 1.158 -5.874) 6.005 8.879 ( -1.807 -2.318 1.913) 3.507 9.288 ( -1.982 6.231 3.610) 7.469 9.650 ( 7.686 5.243 -5.286) 10.701 16.242 ( -0.341 -3.752 5.641) 6.783 16.439 ( -3.691 1.487 -5.359) 6.675 16.741 ( 0.150 -3.765 -1.413) 4.024 17.101 ( 1.187 9.348 4.943) 10.641 17.360 ( 10.115 5.700 -5.747) 12.955 18.674 ( -11.464 -14.569 0.655) 18.551 ======================= Grid point 657 (280/294) ======================= q-point: ( 0.67 0.42 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.481 ( -3.585 -1.279 1.028) 3.943 1.795 ( -2.793 -1.224 2.425) 3.896 1.930 ( 1.713 -10.996 -2.281) 11.360 2.812 ( -7.015 6.912 -3.611) 10.489 3.121 ( -5.183 -3.040 -6.111) 8.571 3.511 ( 11.424 -5.862 5.661) 14.033 3.909 ( -1.883 9.779 7.613) 12.535 4.278 ( 7.741 5.629 -5.195) 10.890 5.250 ( -5.985 -6.809 -0.436) 9.076 6.634 ( 0.180 0.459 2.644) 2.690 6.722 ( 0.085 -0.174 -2.537) 2.545 7.108 ( -7.677 -7.779 0.093) 10.930 7.800 ( 2.505 -1.893 0.422) 3.168 7.987 ( 0.428 0.434 -0.906) 1.092 8.037 ( -3.238 2.069 -9.301) 10.064 8.856 ( -0.437 -3.117 4.578) 5.555 9.366 ( 1.369 4.537 6.596) 8.122 9.778 ( 5.303 4.229 -2.992) 7.413 16.253 ( 2.016 -3.184 3.509) 5.149 16.356 ( -3.991 1.704 -4.279) 6.094 16.709 ( 0.350 -2.265 -0.701) 2.397 17.245 ( 1.846 8.761 5.503) 10.509 17.537 ( 9.094 4.481 -4.637) 11.148 18.327 ( -13.532 -14.244 -1.575) 19.710 ======================= Grid point 667 (281/294) ======================= q-point: ( 0.42 0.50 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.590 ( 0.758 -5.727 14.243) 15.370 1.864 ( 4.164 0.220 4.152) 5.884 2.139 ( -0.817 -11.164 -0.392) 11.201 2.775 ( 2.083 8.238 -6.013) 10.409 3.076 ( -9.896 12.089 4.190) 16.175 3.494 ( 6.656 -8.888 -5.492) 12.389 3.885 ( 3.523 2.251 -1.130) 4.331 3.999 ( -6.501 1.816 -5.514) 8.716 5.564 ( 2.823 -5.169 -3.367) 6.784 6.576 ( -0.855 0.726 4.445) 4.584 6.648 ( -0.989 2.588 -0.750) 2.870 7.566 ( 8.794 -10.503 7.794) 15.761 7.816 ( -0.728 0.065 -1.902) 2.037 7.929 ( -3.756 -3.290 7.900) 9.346 8.071 ( -0.747 -1.486 -3.877) 4.219 8.952 ( 1.634 -0.239 -1.026) 1.944 9.238 ( 4.655 4.489 -0.451) 6.483 9.520 ( -7.628 6.024 -7.921) 12.539 16.298 ( 1.102 -2.700 6.498) 7.122 16.447 ( 2.558 -1.061 -2.600) 3.799 16.778 ( -1.818 -3.268 -0.553) 3.780 16.969 ( 2.108 6.213 2.028) 6.867 17.212 ( -8.074 7.970 -6.784) 13.219 18.961 ( 6.487 -12.049 0.996) 13.720 ======================= Grid point 668 (282/294) ======================= q-point: ( 0.50 0.50 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 868 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.579 ( -1.320 -6.609 13.107) 14.738 1.942 ( -0.584 -1.649 -8.615) 8.791 2.056 ( 2.834 -9.186 9.091) 13.231 2.742 ( -2.279 2.294 -4.792) 5.781 3.182 ( 0.216 13.563 3.299) 13.960 3.479 ( 2.382 -4.503 -5.131) 7.231 3.876 ( -2.901 0.506 -4.716) 5.560 3.973 ( 1.762 4.220 0.670) 4.622 5.510 ( -0.401 -6.933 -1.964) 7.217 6.582 ( -0.945 0.659 4.026) 4.187 6.681 ( 1.056 3.290 -1.599) 3.808 7.554 ( 0.243 -15.934 4.228) 16.487 7.792 ( -1.743 -0.445 0.223) 1.812 7.905 ( -0.426 -2.413 7.483) 7.874 8.045 ( 2.166 -1.108 -2.910) 3.793 8.948 ( -1.064 -0.521 -1.078) 1.601 9.383 ( 6.349 5.517 -6.413) 10.577 9.435 ( -5.390 8.894 -0.785) 10.429 16.294 ( -1.666 -3.985 5.869) 7.287 16.464 ( 2.441 -0.647 -5.395) 5.957 16.734 ( -0.364 -3.083 1.501) 3.448 17.100 ( 4.249 8.028 1.426) 9.195 17.153 ( -4.266 9.148 -4.767) 11.163 18.882 ( -0.406 -16.081 1.281) 16.137 ======================= Grid point 669 (283/294) ======================= q-point: ( 0.58 0.50 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.605 ( -0.748 -2.083 12.984) 13.171 1.805 ( -0.091 -7.770 -10.673) 13.202 2.010 ( -6.262 -5.891 5.000) 9.946 2.800 ( 6.546 3.349 0.097) 7.354 3.258 ( 1.813 -4.166 -0.792) 4.612 3.397 ( -8.036 4.275 -6.260) 11.047 3.909 ( 4.232 7.046 1.768) 8.407 4.050 ( 2.539 4.641 -0.793) 5.349 5.406 ( -2.901 -7.989 0.019) 8.499 6.616 ( 0.687 1.391 4.739) 4.987 6.705 ( 0.478 1.967 -3.727) 4.242 7.368 ( -5.653 -15.145 1.758) 16.261 7.759 ( -1.137 -2.398 2.344) 3.541 7.933 ( 1.236 -0.460 2.927) 3.211 8.075 ( 2.521 0.195 -2.099) 3.286 8.899 ( -2.446 -1.775 -0.547) 3.072 9.384 ( -1.118 5.665 -5.704) 8.116 9.579 ( 5.141 8.383 1.523) 9.951 16.255 ( -1.934 -3.949 5.311) 6.895 16.441 ( 0.094 -0.260 -7.472) 7.477 16.714 ( -0.641 -2.413 2.311) 3.403 17.186 ( 2.568 8.009 -5.848) 10.243 17.275 ( 3.902 9.567 4.419) 11.237 18.672 ( -6.191 -18.050 1.420) 19.135 ======================= Grid point 670 (284/294) ======================= q-point: ( 0.67 0.50 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 868 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.578 ( -6.789 0.921 0.019) 6.851 1.758 ( 5.942 -8.760 1.393) 10.676 1.867 ( -6.400 -3.629 4.234) 8.489 2.917 ( 1.410 3.796 -2.265) 4.640 3.145 ( -5.319 -5.952 -6.811) 10.494 3.326 ( 2.597 -2.893 1.279) 4.093 4.087 ( -1.126 11.433 8.059) 14.033 4.156 ( 9.491 5.585 -6.214) 12.645 5.273 ( -4.588 -8.239 2.137) 9.670 6.661 ( -1.525 0.862 0.494) 1.820 6.699 ( 1.748 0.449 -0.893) 2.013 7.145 ( -6.688 -10.678 0.615) 12.614 7.746 ( 1.102 -2.867 2.155) 3.752 7.967 ( 1.571 0.498 0.777) 1.822 8.073 ( -2.115 2.663 -5.518) 6.481 8.849 ( -0.761 -3.744 2.332) 4.476 9.414 ( 1.196 4.831 -1.730) 5.269 9.733 ( 4.324 6.045 0.453) 7.447 16.228 ( -0.298 -3.413 3.876) 5.173 16.389 ( -1.673 0.759 -5.528) 5.825 16.694 ( -0.791 -1.470 1.750) 2.419 17.303 ( 5.392 8.578 -4.522) 11.095 17.445 ( 4.031 7.262 2.910) 8.801 18.375 ( -10.185 -17.665 1.749) 20.466 ======================= Grid point 680 (285/294) ======================= q-point: ( 0.42 0.58 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.599 ( 2.773 -2.816 12.267) 12.888 1.785 ( 3.233 -0.565 -5.910) 6.760 2.068 ( -2.006 -9.552 -1.564) 9.884 2.805 ( 2.189 8.385 -1.267) 8.758 3.253 ( 8.052 -5.964 -1.435) 10.122 3.323 ( -8.031 -0.910 2.494) 8.458 3.892 ( 1.364 7.703 3.049) 8.396 4.107 ( -7.984 3.023 -5.909) 10.382 5.431 ( 5.059 -5.577 -2.872) 8.059 6.621 ( 0.028 1.149 5.330) 5.453 6.686 ( -2.417 1.447 -2.790) 3.965 7.347 ( 9.597 -10.213 3.586) 14.466 7.805 ( -0.022 -1.370 -2.587) 2.927 7.982 ( -0.615 -1.135 0.342) 1.336 8.043 ( -1.921 -1.681 -1.206) 2.823 8.902 ( 2.873 -0.975 -0.893) 3.163 9.265 ( 0.090 5.340 6.386) 8.325 9.655 ( -6.785 5.374 -5.774) 10.404 16.299 ( 0.821 -2.071 4.999) 5.473 16.362 ( 2.690 -1.307 -3.123) 4.324 16.760 ( -0.246 -2.576 -2.817) 3.825 17.062 ( -1.941 7.350 6.911) 10.274 17.383 ( -8.759 6.637 -6.323) 12.679 18.692 ( 11.398 -13.428 -1.013) 17.643 ======================= Grid point 681 (286/294) ======================= q-point: ( 0.50 0.58 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.582 ( -1.225 -7.144 5.160) 8.897 1.885 ( 1.790 0.986 -6.484) 6.799 1.960 ( 5.005 -8.287 6.780) 11.820 2.809 ( -6.150 1.727 -1.870) 6.656 3.233 ( 0.542 -7.014 1.092) 7.120 3.391 ( 7.570 8.063 -0.854) 11.093 3.927 ( -6.779 4.121 -6.519) 10.269 4.041 ( -0.746 6.531 4.332) 7.873 5.416 ( 2.375 -7.490 -1.632) 8.026 6.630 ( -1.691 0.125 2.751) 3.232 6.687 ( 0.621 2.871 -1.357) 3.235 7.364 ( 5.178 -15.329 1.212) 16.225 7.798 ( 1.340 0.397 -1.556) 2.092 7.969 ( -1.994 -1.584 6.410) 6.898 7.994 ( -1.010 -1.702 -0.017) 1.979 8.925 ( 1.947 -0.832 -2.815) 3.522 9.347 ( 0.890 4.912 -1.753) 5.291 9.598 ( -4.650 8.679 -0.611) 9.865 16.305 ( 0.844 -3.308 2.979) 4.531 16.375 ( 1.463 -1.361 -2.888) 3.512 16.727 ( 0.137 -2.035 0.450) 2.088 17.150 ( -1.377 7.962 1.521) 8.222 17.307 ( -4.654 9.384 -1.954) 10.655 18.681 ( 5.729 -17.728 -0.109) 18.631 ======================= Grid point 682 (287/294) ======================= q-point: ( 0.58 0.58 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.558 ( 3.871 -6.651 1.956) 7.940 1.781 ( -4.744 -1.560 -2.350) 5.519 2.055 ( 1.352 -4.967 6.620) 8.386 2.731 ( 0.208 -0.326 -0.689) 0.790 3.176 ( 0.020 -8.448 0.006) 8.448 3.545 ( -2.333 10.440 -5.853) 12.194 3.849 ( 2.859 2.396 -4.305) 5.696 4.140 ( -0.941 8.925 5.847) 10.711 5.353 ( -0.073 -8.663 0.420) 8.673 6.636 ( 0.594 0.867 1.383) 1.737 6.706 ( -0.356 1.722 -1.287) 2.179 7.262 ( 0.455 -14.887 -0.210) 14.895 7.801 ( -2.194 -0.378 1.866) 2.905 7.946 ( -1.448 -2.302 6.709) 7.239 8.021 ( 3.301 0.572 0.613) 3.406 8.907 ( -0.949 -1.488 -2.884) 3.381 9.362 ( 1.179 4.442 -9.943) 10.954 9.664 ( -0.564 8.994 5.010) 10.311 16.290 ( -2.273 -3.484 5.592) 6.970 16.361 ( 2.551 -0.756 -7.383) 7.848 16.726 ( -0.059 -1.187 2.851) 3.089 17.166 ( -0.174 6.049 -7.180) 9.390 17.403 ( 0.006 11.815 6.322) 13.400 18.551 ( -0.008 -19.734 1.176) 19.769 ======================= Grid point 684 (288/294) ======================= q-point: (-0.33 -0.42 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.570 ( 3.238 -4.479 -3.924) 6.778 1.727 ( -2.339 1.077 5.822) 6.366 1.971 ( -7.219 -5.636 5.735) 10.806 2.816 ( 9.043 -1.159 -0.423) 9.127 3.069 ( -2.157 -8.062 -2.282) 8.652 3.442 ( -10.549 4.185 -4.797) 12.321 4.005 ( 10.673 5.398 -5.988) 13.376 4.244 ( -0.892 9.517 5.879) 11.222 5.264 ( -2.018 -8.580 3.407) 9.450 6.656 ( 0.639 0.011 -5.138) 5.178 6.710 ( -0.280 1.457 4.517) 4.755 7.122 ( -2.589 -10.715 0.602) 11.039 7.756 ( -2.914 -2.352 4.075) 5.535 7.959 ( 0.735 -0.143 2.441) 2.553 8.081 ( 1.538 2.005 -0.206) 2.535 8.843 ( -1.986 -3.097 -1.349) 3.918 9.385 ( 3.220 4.807 -8.965) 10.670 9.766 ( 0.720 5.967 3.648) 7.031 16.244 ( -2.393 -2.995 4.171) 5.665 16.362 ( 1.676 0.969 -5.436) 5.771 16.723 ( -1.475 -0.621 3.049) 3.444 17.217 ( 5.251 5.744 -8.230) 11.327 17.543 ( -0.179 9.560 4.798) 10.698 18.342 ( -4.712 -18.492 4.150) 19.529 ======================= Grid point 805 (289/294) ======================= q-point: ( 0.42 0.42 0.42) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 292 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.802 ( -0.000 0.000 10.555) 10.555 1.802 ( -0.000 0.000 10.555) 10.555 2.496 ( -0.000 0.000 12.843) 12.843 2.617 ( 0.000 -0.000 -7.348) 7.348 2.617 ( 0.000 -0.000 -7.348) 7.348 3.707 ( 0.000 -0.000 -7.435) 7.435 3.900 ( 0.000 -0.000 -3.666) 3.666 3.900 ( 0.000 -0.000 -3.666) 3.666 5.671 ( 0.000 -0.000 -3.635) 3.635 6.574 ( -0.000 0.000 1.833) 1.833 6.574 ( -0.000 0.000 1.833) 1.833 7.777 ( -0.000 0.000 0.703) 0.703 7.893 ( -0.000 0.000 6.195) 6.195 7.995 ( -0.000 0.000 5.843) 5.843 7.995 ( -0.000 0.000 5.843) 5.843 8.988 ( 0.000 -0.000 -4.316) 4.316 9.272 ( 0.000 -0.000 -6.828) 6.828 9.272 ( 0.000 -0.000 -6.828) 6.828 16.420 ( -0.000 0.000 4.626) 4.626 16.420 ( -0.000 0.000 4.626) 4.626 16.877 ( 0.000 -0.000 -1.448) 1.448 16.919 ( 0.000 -0.000 -4.331) 4.331 16.919 ( 0.000 -0.000 -4.331) 4.331 19.202 ( -0.000 0.000 1.254) 1.254 ======================= Grid point 806 (290/294) ======================= q-point: ( 0.50 0.42 0.42) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.741 ( -4.320 -5.895 13.144) 15.039 1.888 ( -2.535 1.652 -0.398) 3.051 2.360 ( -9.589 -1.014 -0.767) 9.673 2.579 ( 5.075 -3.011 -0.099) 5.901 2.897 ( 14.693 9.791 0.800) 17.675 3.598 ( -6.581 -2.699 -4.739) 8.547 3.852 ( -0.948 -2.307 -1.017) 2.694 3.939 ( 3.548 3.073 -4.182) 6.286 5.615 ( -3.357 -2.042 -2.508) 4.661 6.577 ( 0.834 -0.713 2.970) 3.166 6.617 ( 1.625 2.140 -0.454) 2.725 7.748 ( -6.149 -4.042 5.688) 9.300 7.827 ( -3.865 -1.684 0.795) 4.290 7.998 ( -0.259 -0.983 3.968) 4.096 8.068 ( 1.119 1.409 -0.593) 1.894 8.950 ( -1.137 -1.086 -1.645) 2.276 9.203 ( -1.156 0.496 -0.250) 1.283 9.365 ( 8.426 4.198 -7.649) 12.130 16.376 ( -2.957 -2.755 5.920) 7.168 16.462 ( -1.415 0.340 -1.127) 1.840 16.834 ( -2.318 0.349 -2.153) 3.183 16.890 ( 2.436 0.249 2.053) 3.196 17.042 ( 8.854 4.606 -5.565) 11.427 19.123 ( -7.582 -4.509 0.884) 8.866 ======================= Grid point 807 (291/294) ======================= q-point: ( 0.58 0.42 0.42) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.683 ( -3.992 -8.009 8.561) 12.384 1.813 ( -4.917 2.895 -2.573) 6.259 2.197 ( -5.658 -3.138 -5.645) 8.586 2.675 ( 4.317 1.498 3.032) 5.483 3.210 ( 10.966 6.579 0.211) 12.790 3.426 ( -6.842 -2.587 0.205) 7.317 3.822 ( -0.192 -1.670 1.496) 2.251 4.021 ( 5.569 3.900 -4.587) 8.201 5.503 ( -5.688 -3.489 -1.225) 6.784 6.611 ( 1.544 -0.429 2.644) 3.092 6.662 ( 1.843 2.384 -1.315) 3.288 7.543 ( -13.317 -8.049 4.901) 16.314 7.806 ( 0.321 0.396 -1.698) 1.773 7.999 ( -0.141 -1.484 1.556) 2.155 8.047 ( -1.699 0.693 -6.430) 6.687 8.921 ( -1.167 -0.886 1.366) 2.003 9.242 ( 2.144 1.609 6.692) 7.209 9.513 ( 9.046 5.077 -6.766) 12.385 16.349 ( -1.134 -3.339 6.658) 7.534 16.391 ( -4.395 0.421 -4.666) 6.424 16.779 ( -1.832 -1.253 -3.140) 3.845 17.006 ( 4.933 3.616 6.840) 9.176 17.215 ( 10.555 5.450 -6.428) 13.506 18.892 ( -13.481 -8.008 0.092) 15.680 ======================= Grid point 819 (292/294) ======================= q-point: ( 0.50 0.50 0.42) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.786 ( -1.460 -7.229 9.762) 12.235 1.913 ( 1.181 0.017 -4.436) 4.590 2.302 ( 1.520 -12.617 3.893) 13.291 2.631 ( -2.134 5.188 -5.525) 7.873 2.886 ( 0.731 17.568 3.036) 17.844 3.581 ( 0.505 -6.300 -2.735) 6.887 3.863 ( -1.634 -0.773 -2.135) 2.798 3.903 ( 1.279 3.134 -0.398) 3.408 5.603 ( -0.045 -3.907 -1.291) 4.115 6.589 ( -0.717 0.501 2.207) 2.374 6.617 ( 0.721 2.379 -0.950) 2.661 7.782 ( -0.226 0.281 0.747) 0.829 7.839 ( 0.333 -10.753 1.303) 10.837 8.003 ( -1.320 -2.614 6.268) 6.919 8.048 ( 1.227 -0.750 -2.100) 2.545 8.949 ( -0.255 -0.267 -1.171) 1.228 9.260 ( 3.985 3.793 -4.287) 6.974 9.279 ( -3.722 6.635 -0.488) 7.623 16.403 ( -0.893 -3.904 4.953) 6.370 16.460 ( 0.983 -1.238 -2.930) 3.329 16.802 ( 0.330 -3.213 0.962) 3.370 16.966 ( 3.228 5.902 -3.328) 7.505 16.969 ( -3.592 7.694 -0.095) 8.492 19.127 ( -0.055 -8.913 0.515) 8.928 ======================= Grid point 820 (293/294) ======================= q-point: ( 0.58 0.50 0.42) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 864 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.734 ( -5.393 -5.023 5.307) 9.082 1.855 ( 1.431 -3.098 -4.486) 5.636 2.166 ( -6.172 -9.047 -1.851) 11.107 2.703 ( 3.926 6.439 2.369) 7.905 3.123 ( 7.409 12.814 -0.570) 14.812 3.461 ( -4.588 -7.974 -1.830) 9.380 3.851 ( 0.324 0.985 2.648) 2.844 3.961 ( 2.413 3.870 -1.550) 4.817 5.531 ( -3.014 -5.237 0.265) 6.048 6.614 ( 0.570 1.263 2.803) 3.127 6.644 ( 1.347 2.095 -2.844) 3.781 7.649 ( -8.094 -13.426 0.088) 15.678 7.788 ( 0.355 -0.135 0.243) 0.451 7.987 ( -0.647 -2.630 3.655) 4.549 8.048 ( -0.581 0.735 -4.205) 4.308 8.931 ( -0.480 -1.272 0.869) 1.613 9.271 ( 1.443 3.307 -1.958) 4.106 9.423 ( 5.337 8.773 1.181) 10.336 16.367 ( -1.874 -4.331 4.637) 6.616 16.416 ( -1.345 -1.089 -5.203) 5.484 16.772 ( -1.332 -2.445 0.222) 2.793 17.022 ( 3.549 6.150 -1.818) 7.330 17.117 ( 5.209 9.011 1.894) 10.579 18.968 ( -7.129 -12.348 0.283) 14.261 ======================= Grid point 976 (294/294) ======================= q-point: (-0.50 -0.50 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 0.00e+00 3.09e-04 2.72e-04 Number of triplets: 148 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.900 ( -0.000 0.000 0.000) 0.000 1.900 ( -0.000 0.000 0.000) 0.000 2.549 ( -0.000 0.000 0.000) 0.000 2.549 ( -0.000 0.000 0.000) 0.000 2.611 ( -0.000 0.000 0.000) 0.000 3.640 ( -0.000 0.000 0.000) 0.000 3.866 ( -0.000 0.000 0.000) 0.000 3.866 ( -0.000 0.000 0.000) 0.000 5.638 ( -0.000 0.000 0.000) 0.000 6.590 ( -0.000 0.000 0.000) 0.000 6.590 ( -0.000 0.000 0.000) 0.000 7.778 ( -0.000 0.000 0.000) 0.000 7.955 ( -0.000 0.000 0.000) 0.000 8.049 ( -0.000 0.000 0.000) 0.000 8.049 ( -0.000 0.000 0.000) 0.000 8.947 ( -0.000 0.000 0.000) 0.000 9.209 ( -0.000 0.000 0.000) 0.000 9.209 ( -0.000 0.000 0.000) 0.000 16.465 ( -0.000 0.000 0.000) 0.000 16.465 ( -0.000 0.000 0.000) 0.000 16.864 ( -0.000 0.000 0.000) 0.000 16.877 ( -0.000 0.000 0.000) 0.000 16.877 ( -0.000 0.000 0.000) 0.000 19.213 ( -0.000 0.000 0.000) 0.000 =================== 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 3/41472 10.0 188.201 188.201 256.110 0.000 -0.000 0.000 3/41472 20.0 83.756 83.756 111.338 0.000 -0.000 -0.000 3/41472 30.0 45.433 45.433 59.517 0.000 -0.000 -0.000 3/41472 40.0 29.412 29.412 38.163 0.000 -0.000 -0.000 3/41472 50.0 21.350 21.350 27.550 0.000 -0.000 -0.000 3/41472 60.0 16.575 16.575 21.331 0.000 -0.000 -0.000 3/41472 70.0 13.436 13.436 17.275 0.000 -0.000 -0.000 3/41472 80.0 11.234 11.234 14.442 0.000 -0.000 -0.000 3/41472 90.0 9.618 9.618 12.369 0.000 -0.000 -0.000 3/41472 100.0 8.392 8.392 10.797 0.000 -0.000 -0.000 3/41472 110.0 7.436 7.436 9.573 0.000 -0.000 -0.000 3/41472 120.0 6.674 6.674 8.596 0.000 -0.000 -0.000 3/41472 130.0 6.054 6.054 7.801 0.000 -0.000 -0.000 3/41472 140.0 5.541 5.541 7.143 0.000 -0.000 -0.000 3/41472 150.0 5.111 5.111 6.590 0.000 -0.000 -0.000 3/41472 160.0 4.745 4.745 6.119 0.000 -0.000 -0.000 3/41472 170.0 4.430 4.430 5.714 0.000 -0.000 -0.000 3/41472 180.0 4.157 4.157 5.362 0.000 -0.000 -0.000 3/41472 190.0 3.917 3.917 5.053 0.000 -0.000 -0.000 3/41472 200.0 3.704 3.704 4.779 0.000 -0.000 -0.000 3/41472 210.0 3.515 3.515 4.535 0.000 -0.000 -0.000 3/41472 220.0 3.345 3.345 4.316 0.000 -0.000 -0.000 3/41472 230.0 3.192 3.192 4.118 0.000 -0.000 -0.000 3/41472 240.0 3.053 3.053 3.939 0.000 -0.000 -0.000 3/41472 250.0 2.926 2.926 3.775 0.000 -0.000 -0.000 3/41472 260.0 2.810 2.810 3.625 0.000 -0.000 -0.000 3/41472 270.0 2.703 2.703 3.487 0.000 -0.000 -0.000 3/41472 280.0 2.605 2.605 3.359 0.000 -0.000 -0.000 3/41472 290.0 2.513 2.513 3.241 0.000 -0.000 -0.000 3/41472 300.0 2.428 2.428 3.131 0.000 -0.000 -0.000 3/41472 310.0 2.349 2.349 3.029 0.000 -0.000 -0.000 3/41472 320.0 2.275 2.275 2.933 0.000 -0.000 -0.000 3/41472 330.0 2.206 2.206 2.843 0.000 -0.000 -0.000 3/41472 340.0 2.141 2.141 2.759 0.000 -0.000 -0.000 3/41472 350.0 2.079 2.079 2.680 0.000 -0.000 -0.000 3/41472 360.0 2.021 2.021 2.605 0.000 -0.000 -0.000 3/41472 370.0 1.967 1.967 2.534 0.000 -0.000 -0.000 3/41472 380.0 1.915 1.915 2.468 0.000 -0.000 -0.000 3/41472 390.0 1.866 1.866 2.404 0.000 -0.000 -0.000 3/41472 400.0 1.820 1.820 2.344 0.000 -0.000 -0.000 3/41472 410.0 1.775 1.775 2.287 0.000 -0.000 -0.000 3/41472 420.0 1.733 1.733 2.233 0.000 -0.000 -0.000 3/41472 430.0 1.693 1.693 2.181 0.000 -0.000 -0.000 3/41472 440.0 1.655 1.655 2.131 0.000 -0.000 -0.000 3/41472 450.0 1.618 1.618 2.084 0.000 -0.000 -0.000 3/41472 460.0 1.583 1.583 2.039 0.000 -0.000 -0.000 3/41472 470.0 1.550 1.550 1.996 0.000 -0.000 -0.000 3/41472 480.0 1.518 1.518 1.954 0.000 -0.000 -0.000 3/41472 490.0 1.487 1.487 1.915 0.000 -0.000 -0.000 3/41472 500.0 1.458 1.458 1.877 0.000 -0.000 -0.000 3/41472 510.0 1.429 1.429 1.840 0.000 -0.000 -0.000 3/41472 520.0 1.402 1.402 1.805 0.000 -0.000 -0.000 3/41472 530.0 1.376 1.376 1.771 0.000 -0.000 -0.000 3/41472 540.0 1.350 1.350 1.738 0.000 -0.000 -0.000 3/41472 550.0 1.326 1.326 1.707 0.000 -0.000 -0.000 3/41472 560.0 1.302 1.302 1.676 0.000 -0.000 -0.000 3/41472 570.0 1.280 1.280 1.647 0.000 -0.000 -0.000 3/41472 580.0 1.258 1.258 1.619 0.000 -0.000 -0.000 3/41472 590.0 1.237 1.237 1.592 0.000 -0.000 -0.000 3/41472 600.0 1.216 1.216 1.565 0.000 -0.000 -0.000 3/41472 610.0 1.196 1.196 1.540 0.000 -0.000 -0.000 3/41472 620.0 1.177 1.177 1.515 0.000 -0.000 -0.000 3/41472 630.0 1.159 1.159 1.491 0.000 -0.000 -0.000 3/41472 640.0 1.141 1.141 1.468 0.000 -0.000 -0.000 3/41472 650.0 1.123 1.123 1.445 0.000 -0.000 -0.000 3/41472 660.0 1.106 1.106 1.424 0.000 -0.000 -0.000 3/41472 670.0 1.090 1.090 1.403 0.000 -0.000 -0.000 3/41472 680.0 1.074 1.074 1.382 0.000 -0.000 -0.000 3/41472 690.0 1.059 1.059 1.362 0.000 -0.000 -0.000 3/41472 700.0 1.044 1.044 1.343 0.000 -0.000 -0.000 3/41472 710.0 1.029 1.029 1.324 0.000 -0.000 -0.000 3/41472 720.0 1.015 1.015 1.306 0.000 -0.000 -0.000 3/41472 730.0 1.001 1.001 1.288 0.000 -0.000 -0.000 3/41472 740.0 0.988 0.988 1.270 0.000 -0.000 -0.000 3/41472 750.0 0.974 0.974 1.254 0.000 -0.000 -0.000 3/41472 760.0 0.962 0.962 1.237 0.000 -0.000 -0.000 3/41472 770.0 0.949 0.949 1.221 0.000 -0.000 -0.000 3/41472 780.0 0.937 0.937 1.206 0.000 -0.000 -0.000 3/41472 790.0 0.925 0.925 1.190 0.000 -0.000 -0.000 3/41472 800.0 0.914 0.914 1.176 0.000 -0.000 -0.000 3/41472 810.0 0.903 0.903 1.161 0.000 -0.000 -0.000 3/41472 820.0 0.892 0.892 1.147 0.000 -0.000 -0.000 3/41472 830.0 0.881 0.881 1.133 0.000 -0.000 -0.000 3/41472 840.0 0.871 0.871 1.120 0.000 -0.000 -0.000 3/41472 850.0 0.860 0.860 1.107 0.000 -0.000 -0.000 3/41472 860.0 0.850 0.850 1.094 0.000 -0.000 -0.000 3/41472 870.0 0.841 0.841 1.081 0.000 -0.000 -0.000 3/41472 880.0 0.831 0.831 1.069 0.000 -0.000 -0.000 3/41472 890.0 0.822 0.822 1.057 0.000 -0.000 -0.000 3/41472 900.0 0.813 0.813 1.046 0.000 -0.000 -0.000 3/41472 910.0 0.804 0.804 1.034 0.000 -0.000 -0.000 3/41472 920.0 0.795 0.795 1.023 0.000 -0.000 -0.000 3/41472 930.0 0.787 0.787 1.012 0.000 -0.000 -0.000 3/41472 940.0 0.778 0.778 1.001 0.000 -0.000 -0.000 3/41472 950.0 0.770 0.770 0.991 0.000 -0.000 -0.000 3/41472 960.0 0.762 0.762 0.980 0.000 -0.000 -0.000 3/41472 970.0 0.754 0.754 0.970 0.000 -0.000 -0.000 3/41472 980.0 0.747 0.747 0.960 0.000 -0.000 -0.000 3/41472 990.0 0.739 0.739 0.951 0.000 -0.000 -0.000 3/41472 1000.0 0.732 0.732 0.941 0.000 -0.000 -0.000 3/41472 Thermal conductivity related properties were written into "kappa-m121212.hdf5". Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-08 00:25:07]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|