----------------------------- ------- calculate fc2 ------- ----------------------------- _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1 -------------------------[time 2026-01-07 22:23:48]------------------------- Compiled with OpenMP support (max 128 threads). Running in phonopy.load mode. Python version 3.14.2 Spglib version 2.6.1 Crystal structure was read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". Unit of length: angstrom Settings: Supercell: [3 2 2] Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: P2_1/m (11) Number of symmetry operations in supercell: 48 ------------------------------ primitive cell ------------------------------ Lattice vectors: a 4.153494270170733 0.000000000000000 0.000000000000000 b 0.000000000000000 5.062589450000000 0.000000000000000 c -1.910093024867118 0.000000000000000 5.979356609182240 Atomic positions (fractional): *1 B 0.49774115824359 0.25000000000000 0.25309209259004 10.811 2 B 0.50225884175641 0.75000000000000 0.74690790740996 10.811 *3 O 0.34049374549972 0.01516947069283 0.17100375762909 15.999 4 O 0.65950625450028 0.51516947069283 0.82899624237091 15.999 *5 O 0.16934216597152 0.75000000000000 0.61546151358587 15.999 6 O 0.83065783402848 0.25000000000000 0.38453848641413 15.999 7 O 0.65950625450028 0.98483052930717 0.82899624237091 15.999 8 O 0.34049374549972 0.48483052930717 0.17100375762909 15.999 *9 La 0.12096289522401 0.25000000000000 0.77641305915222 138.905 10 La 0.87903710477599 0.75000000000000 0.22358694084778 138.905 -------------------------------- unit cell --------------------------------- Lattice vectors: a 4.153494270170733 0.000000000000000 0.000000000000000 b 0.000000000000000 5.062589450000000 0.000000000000000 c -1.910093024867118 0.000000000000000 5.979356609182240 Atomic positions (fractional): *1 B 0.49774115824359 0.25000000000000 0.25309209259004 10.811 > 1 2 B 0.50225884175641 0.75000000000000 0.74690790740996 10.811 > 2 *3 O 0.34049374549972 0.01516947069283 0.17100375762909 15.999 > 3 4 O 0.65950625450028 0.51516947069283 0.82899624237091 15.999 > 4 *5 O 0.16934216597152 0.75000000000000 0.61546151358587 15.999 > 5 6 O 0.83065783402848 0.25000000000000 0.38453848641413 15.999 > 6 7 O 0.65950625450028 0.98483052930717 0.82899624237091 15.999 > 7 8 O 0.34049374549972 0.48483052930717 0.17100375762909 15.999 > 8 *9 La 0.12096289522401 0.25000000000000 0.77641305915222 138.905 > 9 10 La 0.87903710477599 0.75000000000000 0.22358694084778 138.905 > 10 -------------------------------- super cell -------------------------------- Lattice vectors: a 12.460482810512200 0.000000000000000 0.000000000000000 b 0.000000000000000 10.125178900000000 0.000000000000000 c -3.820186049734236 0.000000000000000 11.958713218364480 Atomic positions (fractional): *1 B 0.16591371941453 0.12500000000000 0.12654604629502 10.811 > 1 2 B 0.49924705274786 0.12500000000000 0.12654604629502 10.811 > 1 3 B 0.83258038608120 0.12500000000000 0.12654604629502 10.811 > 1 4 B 0.16591371941453 0.62500000000000 0.12654604629502 10.811 > 1 5 B 0.49924705274786 0.62500000000000 0.12654604629502 10.811 > 1 6 B 0.83258038608120 0.62500000000000 0.12654604629502 10.811 > 1 7 B 0.16591371941453 0.12500000000000 0.62654604629502 10.811 > 1 8 B 0.49924705274786 0.12500000000000 0.62654604629502 10.811 > 1 9 B 0.83258038608120 0.12500000000000 0.62654604629502 10.811 > 1 10 B 0.16591371941453 0.62500000000000 0.62654604629502 10.811 > 1 11 B 0.49924705274786 0.62500000000000 0.62654604629502 10.811 > 1 12 B 0.83258038608120 0.62500000000000 0.62654604629502 10.811 > 1 13 B 0.16741961391880 0.37500000000000 0.37345395370498 10.811 > 2 14 B 0.50075294725214 0.37500000000000 0.37345395370498 10.811 > 2 15 B 0.83408628058547 0.37500000000000 0.37345395370498 10.811 > 2 16 B 0.16741961391880 0.87500000000000 0.37345395370498 10.811 > 2 17 B 0.50075294725214 0.87500000000000 0.37345395370498 10.811 > 2 18 B 0.83408628058547 0.87500000000000 0.37345395370498 10.811 > 2 19 B 0.16741961391880 0.37500000000000 0.87345395370498 10.811 > 2 20 B 0.50075294725214 0.37500000000000 0.87345395370498 10.811 > 2 21 B 0.83408628058547 0.37500000000000 0.87345395370498 10.811 > 2 22 B 0.16741961391880 0.87500000000000 0.87345395370498 10.811 > 2 23 B 0.50075294725214 0.87500000000000 0.87345395370498 10.811 > 2 24 B 0.83408628058547 0.87500000000000 0.87345395370498 10.811 > 2 *25 O 0.11349791516657 0.00758473534641 0.08550187881454 15.999 > 3 26 O 0.44683124849991 0.00758473534641 0.08550187881454 15.999 > 3 27 O 0.78016458183324 0.00758473534641 0.08550187881454 15.999 > 3 28 O 0.11349791516657 0.50758473534641 0.08550187881454 15.999 > 3 29 O 0.44683124849991 0.50758473534641 0.08550187881454 15.999 > 3 30 O 0.78016458183324 0.50758473534641 0.08550187881454 15.999 > 3 31 O 0.11349791516657 0.00758473534641 0.58550187881454 15.999 > 3 32 O 0.44683124849991 0.00758473534641 0.58550187881454 15.999 > 3 33 O 0.78016458183324 0.00758473534641 0.58550187881454 15.999 > 3 34 O 0.11349791516657 0.50758473534641 0.58550187881454 15.999 > 3 35 O 0.44683124849991 0.50758473534641 0.58550187881454 15.999 > 3 36 O 0.78016458183324 0.50758473534641 0.58550187881454 15.999 > 3 37 O 0.21983541816676 0.25758473534641 0.41449812118546 15.999 > 4 38 O 0.55316875150009 0.25758473534641 0.41449812118546 15.999 > 4 39 O 0.88650208483343 0.25758473534641 0.41449812118546 15.999 > 4 40 O 0.21983541816676 0.75758473534641 0.41449812118546 15.999 > 4 41 O 0.55316875150009 0.75758473534641 0.41449812118546 15.999 > 4 42 O 0.88650208483343 0.75758473534641 0.41449812118546 15.999 > 4 43 O 0.21983541816676 0.25758473534641 0.91449812118546 15.999 > 4 44 O 0.55316875150009 0.25758473534641 0.91449812118546 15.999 > 4 45 O 0.88650208483343 0.25758473534641 0.91449812118546 15.999 > 4 46 O 0.21983541816676 0.75758473534641 0.91449812118546 15.999 > 4 47 O 0.55316875150009 0.75758473534641 0.91449812118546 15.999 > 4 48 O 0.88650208483343 0.75758473534641 0.91449812118546 15.999 > 4 *49 O 0.05644738865717 0.37500000000000 0.30773075679294 15.999 > 5 50 O 0.38978072199051 0.37500000000000 0.30773075679294 15.999 > 5 51 O 0.72311405532384 0.37500000000000 0.30773075679294 15.999 > 5 52 O 0.05644738865717 0.87500000000000 0.30773075679294 15.999 > 5 53 O 0.38978072199051 0.87500000000000 0.30773075679294 15.999 > 5 54 O 0.72311405532384 0.87500000000000 0.30773075679294 15.999 > 5 55 O 0.05644738865717 0.37500000000000 0.80773075679294 15.999 > 5 56 O 0.38978072199051 0.37500000000000 0.80773075679294 15.999 > 5 57 O 0.72311405532384 0.37500000000000 0.80773075679294 15.999 > 5 58 O 0.05644738865717 0.87500000000000 0.80773075679294 15.999 > 5 59 O 0.38978072199051 0.87500000000000 0.80773075679294 15.999 > 5 60 O 0.72311405532384 0.87500000000000 0.80773075679294 15.999 > 5 61 O 0.27688594467616 0.12500000000000 0.19226924320706 15.999 > 6 62 O 0.61021927800949 0.12500000000000 0.19226924320706 15.999 > 6 63 O 0.94355261134283 0.12500000000000 0.19226924320706 15.999 > 6 64 O 0.27688594467616 0.62500000000000 0.19226924320706 15.999 > 6 65 O 0.61021927800949 0.62500000000000 0.19226924320706 15.999 > 6 66 O 0.94355261134283 0.62500000000000 0.19226924320706 15.999 > 6 67 O 0.27688594467616 0.12500000000000 0.69226924320706 15.999 > 6 68 O 0.61021927800949 0.12500000000000 0.69226924320706 15.999 > 6 69 O 0.94355261134283 0.12500000000000 0.69226924320706 15.999 > 6 70 O 0.27688594467616 0.62500000000000 0.69226924320706 15.999 > 6 71 O 0.61021927800949 0.62500000000000 0.69226924320706 15.999 > 6 72 O 0.94355261134283 0.62500000000000 0.69226924320706 15.999 > 6 73 O 0.21983541816676 0.49241526465359 0.41449812118546 15.999 > 7 74 O 0.55316875150009 0.49241526465359 0.41449812118546 15.999 > 7 75 O 0.88650208483343 0.49241526465359 0.41449812118546 15.999 > 7 76 O 0.21983541816676 0.99241526465359 0.41449812118546 15.999 > 7 77 O 0.55316875150009 0.99241526465359 0.41449812118546 15.999 > 7 78 O 0.88650208483343 0.99241526465359 0.41449812118546 15.999 > 7 79 O 0.21983541816676 0.49241526465359 0.91449812118546 15.999 > 7 80 O 0.55316875150009 0.49241526465359 0.91449812118546 15.999 > 7 81 O 0.88650208483343 0.49241526465359 0.91449812118546 15.999 > 7 82 O 0.21983541816676 0.99241526465359 0.91449812118546 15.999 > 7 83 O 0.55316875150009 0.99241526465359 0.91449812118546 15.999 > 7 84 O 0.88650208483343 0.99241526465359 0.91449812118546 15.999 > 7 85 O 0.11349791516657 0.24241526465359 0.08550187881454 15.999 > 8 86 O 0.44683124849991 0.24241526465359 0.08550187881454 15.999 > 8 87 O 0.78016458183324 0.24241526465359 0.08550187881454 15.999 > 8 88 O 0.11349791516657 0.74241526465359 0.08550187881454 15.999 > 8 89 O 0.44683124849991 0.74241526465359 0.08550187881454 15.999 > 8 90 O 0.78016458183324 0.74241526465359 0.08550187881454 15.999 > 8 91 O 0.11349791516657 0.24241526465359 0.58550187881454 15.999 > 8 92 O 0.44683124849991 0.24241526465359 0.58550187881454 15.999 > 8 93 O 0.78016458183324 0.24241526465359 0.58550187881454 15.999 > 8 94 O 0.11349791516657 0.74241526465359 0.58550187881454 15.999 > 8 95 O 0.44683124849991 0.74241526465359 0.58550187881454 15.999 > 8 96 O 0.78016458183324 0.74241526465359 0.58550187881454 15.999 > 8 *97 La 0.04032096507467 0.12500000000000 0.38820652957611 138.905 > 9 98 La 0.37365429840800 0.12500000000000 0.38820652957611 138.905 > 9 99 La 0.70698763174134 0.12500000000000 0.38820652957611 138.905 > 9 100 La 0.04032096507467 0.62500000000000 0.38820652957611 138.905 > 9 101 La 0.37365429840800 0.62500000000000 0.38820652957611 138.905 > 9 102 La 0.70698763174134 0.62500000000000 0.38820652957611 138.905 > 9 103 La 0.04032096507467 0.12500000000000 0.88820652957611 138.905 > 9 104 La 0.37365429840800 0.12500000000000 0.88820652957611 138.905 > 9 105 La 0.70698763174134 0.12500000000000 0.88820652957611 138.905 > 9 106 La 0.04032096507467 0.62500000000000 0.88820652957611 138.905 > 9 107 La 0.37365429840800 0.62500000000000 0.88820652957611 138.905 > 9 108 La 0.70698763174134 0.62500000000000 0.88820652957611 138.905 > 9 109 La 0.29301236825866 0.37500000000000 0.11179347042389 138.905 > 10 110 La 0.62634570159200 0.37500000000000 0.11179347042389 138.905 > 10 111 La 0.95967903492533 0.37500000000000 0.11179347042389 138.905 > 10 112 La 0.29301236825866 0.87500000000000 0.11179347042389 138.905 > 10 113 La 0.62634570159200 0.87500000000000 0.11179347042389 138.905 > 10 114 La 0.95967903492533 0.87500000000000 0.11179347042389 138.905 > 10 115 La 0.29301236825866 0.37500000000000 0.61179347042389 138.905 > 10 116 La 0.62634570159200 0.37500000000000 0.61179347042389 138.905 > 10 117 La 0.95967903492533 0.37500000000000 0.61179347042389 138.905 > 10 118 La 0.29301236825866 0.87500000000000 0.61179347042389 138.905 > 10 119 La 0.62634570159200 0.87500000000000 0.61179347042389 138.905 > 10 120 La 0.95967903492533 0.87500000000000 0.61179347042389 138.905 > 10 ---------------------------------------------------------------------------- NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". --------------------------- Dielectric constant ---------------------------- 3.7594156 0.0000000 0.3206861 0.0000000 3.9093049 0.0000000 0.3206843 0.0000000 3.6492729 -------------------------- Born effective charges -------------------------- 1 B 1.8549495 0.0000000 1.1246945 0.0000000 2.8398055 0.0000000 1.2909281 0.0000000 1.4755943 2 B 1.8549495 0.0000000 1.1246945 0.0000000 2.8398055 0.0000000 1.2909281 0.0000000 1.4755943 3 O -2.1959648 -0.3894727 -0.2737351 -0.4445023 -2.5231393 -0.0171609 -0.3110100 -0.0901912 -1.5534693 4 O -2.1959648 0.3894727 -0.2737351 0.4445023 -2.5231393 0.0171609 -0.3110100 0.0901912 -1.5534693 5 O -1.8083090 0.0000000 -0.8166703 0.0000000 -1.8869023 0.0000000 -0.8465236 0.0000000 -2.5174603 6 O -1.8083090 0.0000000 -0.8166703 0.0000000 -1.8869023 0.0000000 -0.8465236 0.0000000 -2.5174603 7 O -2.1959648 -0.3894727 -0.2737351 -0.4445023 -2.5231393 -0.0171609 -0.3110100 -0.0901912 -1.5534693 8 O -2.1959648 0.3894727 -0.2737351 0.4445023 -2.5231393 0.0171609 -0.3110100 0.0901912 -1.5534693 9 La 4.3452891 0.0000000 0.2394459 0.0000000 4.0933753 0.0000000 0.1776154 0.0000000 4.1488047 10 La 4.3452891 0.0000000 0.2394459 0.0000000 4.0933753 0.0000000 0.1776154 0.0000000 4.1488047 ---------------------------------------------------------------------------- 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: 360/360 Permutation basis: 5880/5880 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 1452 Number of blocks in projector: 1452 Finding block diagonal structure in projector. Using scipy connected_components. Number of blocks in projector (Sum rule): 6 --- Eigsh_solver_block: 1 / 6 --- Block_size: 354 Use standard eigh solver. --- Eigsh_solver_block: 2 / 6 --- Block_size: 246 Use standard eigh solver. --- Eigsh_solver_block: 3 / 6 --- Block_size: 246 Use standard eigh solver. --- Eigsh_solver_block: 4 / 6 --- Block_size: 202 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 202 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 202 Use standard eigh solver. Tree of FC basis block matrices: - (1452, 1429), data: False |-- (202, 198), data: True |-- (202, 198), data: True |-- (202, 198), data: True |-- (246, 244), data: True |-- (246, 244), data: True |-- (354, 347), data: True ----- Solver_atoms: 1 -- 120 / 120 Time (Solver_compr_matrix_reshape): 0.003 Solver_block: 100 / 320 - Time: 2.111 Solver_block: 200 / 320 - Time: 2.122 Solver_block: 300 / 320 - Time: 2.126 Solver_block: 320 / 320 - Time: 0.504 Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 6.894 --------------------------------- Symfc end -------------------------------- Max drift of force constants: -0.00000000 (xz) -0.00000000 (xz) Permutation basis: 360/360 Permutation basis: 5880/5880 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 1452 Number of blocks in projector: 1452 Finding block diagonal structure in projector. Using scipy connected_components. Number of blocks in projector (Sum rule): 6 --- Eigsh_solver_block: 1 / 6 --- Block_size: 354 Use standard eigh solver. --- Eigsh_solver_block: 2 / 6 --- Block_size: 246 Use standard eigh solver. --- Eigsh_solver_block: 3 / 6 --- Block_size: 246 Use standard eigh solver. --- Eigsh_solver_block: 4 / 6 --- Block_size: 202 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 202 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 202 Use standard eigh solver. Tree of FC basis block matrices: - (1452, 1429), data: False |-- (202, 198), data: True |-- (202, 198), data: True |-- (202, 198), data: True |-- (246, 244), data: True |-- (246, 244), data: True |-- (354, 347), data: True Max drift after symmetrization by symfc projector: -0.00000000 (xz) -0.00000000 (xz) Force constants are written into "force_constants.hdf5". ---------------------------------------------------------------------------- One of the following run modes may be specified for phonon calculations. - Mesh sampling (MESH, --mesh) - Q-points (QPOINTS, --qpoints) - Band structure (BAND, --band) - Animation (ANIME, --anime) - Modulation (MODULATION, --modulation) - Characters of Irreps (IRREPS, --irreps) - Create displacements (CREATE_DISPLACEMENTS, -d) ---------------------------------------------------------------------------- Summary of calculation was written in "phonopy.yaml". -------------------------[time 2026-01-07 22:24:10]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate fc3 ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-07 22:24:11]------------------------- Compiled with OpenMP support (max 128 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: force constants HDF5 data compression filter: gzip Crystal structure was read from "phono3py_mlp_eval_fc3_disp.yaml.xz". Supercell (dim): [3 2 2] Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: P2_1/m (11) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 4.153494270170733 0.000000000000000 0.000000000000000 b 0.000000000000000 5.062589450000000 0.000000000000000 c -1.910093024867118 0.000000000000000 5.979356609182240 Atomic positions (fractional): 1 B 0.49774115824359 0.25000000000000 0.25309209259004 10.811 2 B 0.50225884175641 0.75000000000000 0.74690790740996 10.811 3 O 0.34049374549972 0.01516947069283 0.17100375762909 15.999 4 O 0.65950625450028 0.51516947069283 0.82899624237091 15.999 5 O 0.16934216597152 0.75000000000000 0.61546151358587 15.999 6 O 0.83065783402848 0.25000000000000 0.38453848641413 15.999 7 O 0.65950625450028 0.98483052930717 0.82899624237091 15.999 8 O 0.34049374549972 0.48483052930717 0.17100375762909 15.999 9 La 0.12096289522401 0.25000000000000 0.77641305915222 138.905 10 La 0.87903710477599 0.75000000000000 0.22358694084778 138.905 -------------------------------- supercell --------------------------------- Lattice vectors: a 12.460482810512200 0.000000000000000 0.000000000000000 b 0.000000000000000 10.125178900000000 0.000000000000000 c -3.820186049734236 0.000000000000000 11.958713218364480 Atomic positions (fractional): 1 B 0.16591371941453 0.12500000000000 0.12654604629502 10.811 > 1 2 B 0.49924705274786 0.12500000000000 0.12654604629502 10.811 > 1 3 B 0.83258038608120 0.12500000000000 0.12654604629502 10.811 > 1 4 B 0.16591371941453 0.62500000000000 0.12654604629502 10.811 > 1 5 B 0.49924705274786 0.62500000000000 0.12654604629502 10.811 > 1 6 B 0.83258038608120 0.62500000000000 0.12654604629502 10.811 > 1 7 B 0.16591371941453 0.12500000000000 0.62654604629502 10.811 > 1 8 B 0.49924705274786 0.12500000000000 0.62654604629502 10.811 > 1 9 B 0.83258038608120 0.12500000000000 0.62654604629502 10.811 > 1 10 B 0.16591371941453 0.62500000000000 0.62654604629502 10.811 > 1 11 B 0.49924705274786 0.62500000000000 0.62654604629502 10.811 > 1 12 B 0.83258038608120 0.62500000000000 0.62654604629502 10.811 > 1 13 B 0.16741961391880 0.37500000000000 0.37345395370498 10.811 > 13 14 B 0.50075294725214 0.37500000000000 0.37345395370498 10.811 > 13 15 B 0.83408628058547 0.37500000000000 0.37345395370498 10.811 > 13 16 B 0.16741961391880 0.87500000000000 0.37345395370498 10.811 > 13 17 B 0.50075294725214 0.87500000000000 0.37345395370498 10.811 > 13 18 B 0.83408628058547 0.87500000000000 0.37345395370498 10.811 > 13 19 B 0.16741961391880 0.37500000000000 0.87345395370498 10.811 > 13 20 B 0.50075294725214 0.37500000000000 0.87345395370498 10.811 > 13 21 B 0.83408628058547 0.37500000000000 0.87345395370498 10.811 > 13 22 B 0.16741961391880 0.87500000000000 0.87345395370498 10.811 > 13 23 B 0.50075294725214 0.87500000000000 0.87345395370498 10.811 > 13 24 B 0.83408628058547 0.87500000000000 0.87345395370498 10.811 > 13 25 O 0.11349791516657 0.00758473534641 0.08550187881454 15.999 > 25 26 O 0.44683124849991 0.00758473534641 0.08550187881454 15.999 > 25 27 O 0.78016458183324 0.00758473534641 0.08550187881454 15.999 > 25 28 O 0.11349791516657 0.50758473534641 0.08550187881454 15.999 > 25 29 O 0.44683124849991 0.50758473534641 0.08550187881454 15.999 > 25 30 O 0.78016458183324 0.50758473534641 0.08550187881454 15.999 > 25 31 O 0.11349791516657 0.00758473534641 0.58550187881454 15.999 > 25 32 O 0.44683124849991 0.00758473534641 0.58550187881454 15.999 > 25 33 O 0.78016458183324 0.00758473534641 0.58550187881454 15.999 > 25 34 O 0.11349791516657 0.50758473534641 0.58550187881454 15.999 > 25 35 O 0.44683124849991 0.50758473534641 0.58550187881454 15.999 > 25 36 O 0.78016458183324 0.50758473534641 0.58550187881454 15.999 > 25 37 O 0.21983541816676 0.25758473534641 0.41449812118546 15.999 > 37 38 O 0.55316875150009 0.25758473534641 0.41449812118546 15.999 > 37 39 O 0.88650208483343 0.25758473534641 0.41449812118546 15.999 > 37 40 O 0.21983541816676 0.75758473534641 0.41449812118546 15.999 > 37 41 O 0.55316875150009 0.75758473534641 0.41449812118546 15.999 > 37 42 O 0.88650208483343 0.75758473534641 0.41449812118546 15.999 > 37 43 O 0.21983541816676 0.25758473534641 0.91449812118546 15.999 > 37 44 O 0.55316875150009 0.25758473534641 0.91449812118546 15.999 > 37 45 O 0.88650208483343 0.25758473534641 0.91449812118546 15.999 > 37 46 O 0.21983541816676 0.75758473534641 0.91449812118546 15.999 > 37 47 O 0.55316875150009 0.75758473534641 0.91449812118546 15.999 > 37 48 O 0.88650208483343 0.75758473534641 0.91449812118546 15.999 > 37 49 O 0.05644738865717 0.37500000000000 0.30773075679294 15.999 > 49 50 O 0.38978072199051 0.37500000000000 0.30773075679294 15.999 > 49 51 O 0.72311405532384 0.37500000000000 0.30773075679294 15.999 > 49 52 O 0.05644738865717 0.87500000000000 0.30773075679294 15.999 > 49 53 O 0.38978072199051 0.87500000000000 0.30773075679294 15.999 > 49 54 O 0.72311405532384 0.87500000000000 0.30773075679294 15.999 > 49 55 O 0.05644738865717 0.37500000000000 0.80773075679294 15.999 > 49 56 O 0.38978072199051 0.37500000000000 0.80773075679294 15.999 > 49 57 O 0.72311405532384 0.37500000000000 0.80773075679294 15.999 > 49 58 O 0.05644738865717 0.87500000000000 0.80773075679294 15.999 > 49 59 O 0.38978072199051 0.87500000000000 0.80773075679294 15.999 > 49 60 O 0.72311405532384 0.87500000000000 0.80773075679294 15.999 > 49 61 O 0.27688594467616 0.12500000000000 0.19226924320706 15.999 > 61 62 O 0.61021927800949 0.12500000000000 0.19226924320706 15.999 > 61 63 O 0.94355261134283 0.12500000000000 0.19226924320706 15.999 > 61 64 O 0.27688594467616 0.62500000000000 0.19226924320706 15.999 > 61 65 O 0.61021927800949 0.62500000000000 0.19226924320706 15.999 > 61 66 O 0.94355261134283 0.62500000000000 0.19226924320706 15.999 > 61 67 O 0.27688594467616 0.12500000000000 0.69226924320706 15.999 > 61 68 O 0.61021927800949 0.12500000000000 0.69226924320706 15.999 > 61 69 O 0.94355261134283 0.12500000000000 0.69226924320706 15.999 > 61 70 O 0.27688594467616 0.62500000000000 0.69226924320706 15.999 > 61 71 O 0.61021927800949 0.62500000000000 0.69226924320706 15.999 > 61 72 O 0.94355261134283 0.62500000000000 0.69226924320706 15.999 > 61 73 O 0.21983541816676 0.49241526465359 0.41449812118546 15.999 > 73 74 O 0.55316875150009 0.49241526465359 0.41449812118546 15.999 > 73 75 O 0.88650208483343 0.49241526465359 0.41449812118546 15.999 > 73 76 O 0.21983541816676 0.99241526465359 0.41449812118546 15.999 > 73 77 O 0.55316875150009 0.99241526465359 0.41449812118546 15.999 > 73 78 O 0.88650208483343 0.99241526465359 0.41449812118546 15.999 > 73 79 O 0.21983541816676 0.49241526465359 0.91449812118546 15.999 > 73 80 O 0.55316875150009 0.49241526465359 0.91449812118546 15.999 > 73 81 O 0.88650208483343 0.49241526465359 0.91449812118546 15.999 > 73 82 O 0.21983541816676 0.99241526465359 0.91449812118546 15.999 > 73 83 O 0.55316875150009 0.99241526465359 0.91449812118546 15.999 > 73 84 O 0.88650208483343 0.99241526465359 0.91449812118546 15.999 > 73 85 O 0.11349791516657 0.24241526465359 0.08550187881454 15.999 > 85 86 O 0.44683124849991 0.24241526465359 0.08550187881454 15.999 > 85 87 O 0.78016458183324 0.24241526465359 0.08550187881454 15.999 > 85 88 O 0.11349791516657 0.74241526465359 0.08550187881454 15.999 > 85 89 O 0.44683124849991 0.74241526465359 0.08550187881454 15.999 > 85 90 O 0.78016458183324 0.74241526465359 0.08550187881454 15.999 > 85 91 O 0.11349791516657 0.24241526465359 0.58550187881454 15.999 > 85 92 O 0.44683124849991 0.24241526465359 0.58550187881454 15.999 > 85 93 O 0.78016458183324 0.24241526465359 0.58550187881454 15.999 > 85 94 O 0.11349791516657 0.74241526465359 0.58550187881454 15.999 > 85 95 O 0.44683124849991 0.74241526465359 0.58550187881454 15.999 > 85 96 O 0.78016458183324 0.74241526465359 0.58550187881454 15.999 > 85 97 La 0.04032096507467 0.12500000000000 0.38820652957611 138.905 > 97 98 La 0.37365429840800 0.12500000000000 0.38820652957611 138.905 > 97 99 La 0.70698763174134 0.12500000000000 0.38820652957611 138.905 > 97 100 La 0.04032096507467 0.62500000000000 0.38820652957611 138.905 > 97 101 La 0.37365429840800 0.62500000000000 0.38820652957611 138.905 > 97 102 La 0.70698763174134 0.62500000000000 0.38820652957611 138.905 > 97 103 La 0.04032096507467 0.12500000000000 0.88820652957611 138.905 > 97 104 La 0.37365429840800 0.12500000000000 0.88820652957611 138.905 > 97 105 La 0.70698763174134 0.12500000000000 0.88820652957611 138.905 > 97 106 La 0.04032096507467 0.62500000000000 0.88820652957611 138.905 > 97 107 La 0.37365429840800 0.62500000000000 0.88820652957611 138.905 > 97 108 La 0.70698763174134 0.62500000000000 0.88820652957611 138.905 > 97 109 La 0.29301236825866 0.37500000000000 0.11179347042389 138.905 > 109 110 La 0.62634570159200 0.37500000000000 0.11179347042389 138.905 > 109 111 La 0.95967903492533 0.37500000000000 0.11179347042389 138.905 > 109 112 La 0.29301236825866 0.87500000000000 0.11179347042389 138.905 > 109 113 La 0.62634570159200 0.87500000000000 0.11179347042389 138.905 > 109 114 La 0.95967903492533 0.87500000000000 0.11179347042389 138.905 > 109 115 La 0.29301236825866 0.37500000000000 0.61179347042389 138.905 > 109 116 La 0.62634570159200 0.37500000000000 0.61179347042389 138.905 > 109 117 La 0.95967903492533 0.37500000000000 0.61179347042389 138.905 > 109 118 La 0.29301236825866 0.87500000000000 0.61179347042389 138.905 > 109 119 La 0.62634570159200 0.87500000000000 0.61179347042389 138.905 > 109 120 La 0.95967903492533 0.87500000000000 0.61179347042389 138.905 > 109 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz". --------------------------- Dielectric constant ---------------------------- 3.7594156 0.0000000 0.3206861 0.0000000 3.9093049 0.0000000 0.3206843 0.0000000 3.6492729 -------------------------- Born effective charges -------------------------- 1 B 1.8549495 0.0000000 1.1246945 0.0000000 2.8398055 0.0000000 1.2909281 0.0000000 1.4755943 2 B 1.8549495 0.0000000 1.1246945 0.0000000 2.8398055 0.0000000 1.2909281 0.0000000 1.4755943 3 O -2.1959648 -0.3894727 -0.2737351 -0.4445023 -2.5231393 -0.0171609 -0.3110100 -0.0901912 -1.5534693 4 O -2.1959648 0.3894727 -0.2737351 0.4445023 -2.5231393 0.0171609 -0.3110100 0.0901912 -1.5534693 5 O -1.8083090 0.0000000 -0.8166703 0.0000000 -1.8869023 0.0000000 -0.8465236 0.0000000 -2.5174603 6 O -1.8083090 0.0000000 -0.8166703 0.0000000 -1.8869023 0.0000000 -0.8465236 0.0000000 -2.5174603 7 O -2.1959648 -0.3894727 -0.2737351 -0.4445023 -2.5231393 -0.0171609 -0.3110100 -0.0901912 -1.5534693 8 O -2.1959648 0.3894727 -0.2737351 0.4445023 -2.5231393 0.0171609 -0.3110100 0.0901912 -1.5534693 9 La 4.3452891 0.0000000 0.2394459 0.0000000 4.0933753 0.0000000 0.1776154 0.0000000 4.1488047 10 La 4.3452891 0.0000000 0.2394459 0.0000000 4.0933753 0.0000000 0.1776154 0.0000000 4.1488047 ---------------------------------------------------------------------------- Sets of supercell forces were read from "FORCES_FC3.xz". Displacement dataset for fc3 was read from "phono3py_mlp_eval_fc3_disp.yaml.xz". ----------------------------- Force constants ------------------------------ Computing fc3[ 1, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0030 0.0000 0.0095] [ 0.0030 0.0000 -0.0095] Computing fc3[ 25, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0030 0.0000 0.0095] [ 0.0030 0.0000 -0.0095] Computing fc3[ 49, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0030 0.0000 0.0095] [ 0.0030 0.0000 -0.0095] Computing fc3[ 97, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0030 0.0000 0.0095] [ 0.0030 0.0000 -0.0095] Expanding fc3. Symmetrizing fc3 by traditional approach (N=3). Symmetrizing fc2 by traditional approach (N=3). Max drift of fc3: 0.00000004 (xxx) 0.00000004 (xxx) 0.00000004 (xxx) fc3 was written into "fc3.hdf5". Max drift of fc2: 0.00000000 (xz) 0.00000000 (xz) fc2 was written into "fc2.hdf5". --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperatures: 0.0 300.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 ----------- None of ph-ph interaction calculation was performed. ----------- Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-07 22:24:26]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate LTC ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-07 22:24:27]------------------------- Compiled with OpenMP support (max 128 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: conductivity-RTA HDF5 data compression filter: gzip Crystal structure was read from "phono3py.yaml". Supercell (dim): [3 2 2] Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: P2_1/m (11) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 4.153494270170733 0.000000000000000 0.000000000000000 b 0.000000000000000 5.062589450000000 0.000000000000000 c -1.910093024867118 0.000000000000000 5.979356609182240 Atomic positions (fractional): 1 B 0.49774115824359 0.25000000000000 0.25309209259004 10.811 2 B 0.50225884175641 0.75000000000000 0.74690790740996 10.811 3 O 0.34049374549972 0.01516947069283 0.17100375762909 15.999 4 O 0.65950625450028 0.51516947069283 0.82899624237091 15.999 5 O 0.16934216597152 0.75000000000000 0.61546151358587 15.999 6 O 0.83065783402848 0.25000000000000 0.38453848641413 15.999 7 O 0.65950625450028 0.98483052930717 0.82899624237091 15.999 8 O 0.34049374549972 0.48483052930717 0.17100375762909 15.999 9 La 0.12096289522401 0.25000000000000 0.77641305915222 138.905 10 La 0.87903710477599 0.75000000000000 0.22358694084778 138.905 -------------------------------- supercell --------------------------------- Lattice vectors: a 12.460482810512200 0.000000000000000 0.000000000000000 b 0.000000000000000 10.125178900000000 0.000000000000000 c -3.820186049734236 0.000000000000000 11.958713218364480 Atomic positions (fractional): 1 B 0.16591371941453 0.12500000000000 0.12654604629502 10.811 > 1 2 B 0.49924705274786 0.12500000000000 0.12654604629502 10.811 > 1 3 B 0.83258038608120 0.12500000000000 0.12654604629502 10.811 > 1 4 B 0.16591371941453 0.62500000000000 0.12654604629502 10.811 > 1 5 B 0.49924705274786 0.62500000000000 0.12654604629502 10.811 > 1 6 B 0.83258038608120 0.62500000000000 0.12654604629502 10.811 > 1 7 B 0.16591371941453 0.12500000000000 0.62654604629502 10.811 > 1 8 B 0.49924705274786 0.12500000000000 0.62654604629502 10.811 > 1 9 B 0.83258038608120 0.12500000000000 0.62654604629502 10.811 > 1 10 B 0.16591371941453 0.62500000000000 0.62654604629502 10.811 > 1 11 B 0.49924705274786 0.62500000000000 0.62654604629502 10.811 > 1 12 B 0.83258038608120 0.62500000000000 0.62654604629502 10.811 > 1 13 B 0.16741961391880 0.37500000000000 0.37345395370498 10.811 > 13 14 B 0.50075294725214 0.37500000000000 0.37345395370498 10.811 > 13 15 B 0.83408628058547 0.37500000000000 0.37345395370498 10.811 > 13 16 B 0.16741961391880 0.87500000000000 0.37345395370498 10.811 > 13 17 B 0.50075294725214 0.87500000000000 0.37345395370498 10.811 > 13 18 B 0.83408628058547 0.87500000000000 0.37345395370498 10.811 > 13 19 B 0.16741961391880 0.37500000000000 0.87345395370498 10.811 > 13 20 B 0.50075294725214 0.37500000000000 0.87345395370498 10.811 > 13 21 B 0.83408628058547 0.37500000000000 0.87345395370498 10.811 > 13 22 B 0.16741961391880 0.87500000000000 0.87345395370498 10.811 > 13 23 B 0.50075294725214 0.87500000000000 0.87345395370498 10.811 > 13 24 B 0.83408628058547 0.87500000000000 0.87345395370498 10.811 > 13 25 O 0.11349791516657 0.00758473534641 0.08550187881454 15.999 > 25 26 O 0.44683124849991 0.00758473534641 0.08550187881454 15.999 > 25 27 O 0.78016458183324 0.00758473534641 0.08550187881454 15.999 > 25 28 O 0.11349791516657 0.50758473534641 0.08550187881454 15.999 > 25 29 O 0.44683124849991 0.50758473534641 0.08550187881454 15.999 > 25 30 O 0.78016458183324 0.50758473534641 0.08550187881454 15.999 > 25 31 O 0.11349791516657 0.00758473534641 0.58550187881454 15.999 > 25 32 O 0.44683124849991 0.00758473534641 0.58550187881454 15.999 > 25 33 O 0.78016458183324 0.00758473534641 0.58550187881454 15.999 > 25 34 O 0.11349791516657 0.50758473534641 0.58550187881454 15.999 > 25 35 O 0.44683124849991 0.50758473534641 0.58550187881454 15.999 > 25 36 O 0.78016458183324 0.50758473534641 0.58550187881454 15.999 > 25 37 O 0.21983541816676 0.25758473534641 0.41449812118546 15.999 > 37 38 O 0.55316875150009 0.25758473534641 0.41449812118546 15.999 > 37 39 O 0.88650208483343 0.25758473534641 0.41449812118546 15.999 > 37 40 O 0.21983541816676 0.75758473534641 0.41449812118546 15.999 > 37 41 O 0.55316875150009 0.75758473534641 0.41449812118546 15.999 > 37 42 O 0.88650208483343 0.75758473534641 0.41449812118546 15.999 > 37 43 O 0.21983541816676 0.25758473534641 0.91449812118546 15.999 > 37 44 O 0.55316875150009 0.25758473534641 0.91449812118546 15.999 > 37 45 O 0.88650208483343 0.25758473534641 0.91449812118546 15.999 > 37 46 O 0.21983541816676 0.75758473534641 0.91449812118546 15.999 > 37 47 O 0.55316875150009 0.75758473534641 0.91449812118546 15.999 > 37 48 O 0.88650208483343 0.75758473534641 0.91449812118546 15.999 > 37 49 O 0.05644738865717 0.37500000000000 0.30773075679294 15.999 > 49 50 O 0.38978072199051 0.37500000000000 0.30773075679294 15.999 > 49 51 O 0.72311405532384 0.37500000000000 0.30773075679294 15.999 > 49 52 O 0.05644738865717 0.87500000000000 0.30773075679294 15.999 > 49 53 O 0.38978072199051 0.87500000000000 0.30773075679294 15.999 > 49 54 O 0.72311405532384 0.87500000000000 0.30773075679294 15.999 > 49 55 O 0.05644738865717 0.37500000000000 0.80773075679294 15.999 > 49 56 O 0.38978072199051 0.37500000000000 0.80773075679294 15.999 > 49 57 O 0.72311405532384 0.37500000000000 0.80773075679294 15.999 > 49 58 O 0.05644738865717 0.87500000000000 0.80773075679294 15.999 > 49 59 O 0.38978072199051 0.87500000000000 0.80773075679294 15.999 > 49 60 O 0.72311405532384 0.87500000000000 0.80773075679294 15.999 > 49 61 O 0.27688594467616 0.12500000000000 0.19226924320706 15.999 > 61 62 O 0.61021927800949 0.12500000000000 0.19226924320706 15.999 > 61 63 O 0.94355261134283 0.12500000000000 0.19226924320706 15.999 > 61 64 O 0.27688594467616 0.62500000000000 0.19226924320706 15.999 > 61 65 O 0.61021927800949 0.62500000000000 0.19226924320706 15.999 > 61 66 O 0.94355261134283 0.62500000000000 0.19226924320706 15.999 > 61 67 O 0.27688594467616 0.12500000000000 0.69226924320706 15.999 > 61 68 O 0.61021927800949 0.12500000000000 0.69226924320706 15.999 > 61 69 O 0.94355261134283 0.12500000000000 0.69226924320706 15.999 > 61 70 O 0.27688594467616 0.62500000000000 0.69226924320706 15.999 > 61 71 O 0.61021927800949 0.62500000000000 0.69226924320706 15.999 > 61 72 O 0.94355261134283 0.62500000000000 0.69226924320706 15.999 > 61 73 O 0.21983541816676 0.49241526465359 0.41449812118546 15.999 > 73 74 O 0.55316875150009 0.49241526465359 0.41449812118546 15.999 > 73 75 O 0.88650208483343 0.49241526465359 0.41449812118546 15.999 > 73 76 O 0.21983541816676 0.99241526465359 0.41449812118546 15.999 > 73 77 O 0.55316875150009 0.99241526465359 0.41449812118546 15.999 > 73 78 O 0.88650208483343 0.99241526465359 0.41449812118546 15.999 > 73 79 O 0.21983541816676 0.49241526465359 0.91449812118546 15.999 > 73 80 O 0.55316875150009 0.49241526465359 0.91449812118546 15.999 > 73 81 O 0.88650208483343 0.49241526465359 0.91449812118546 15.999 > 73 82 O 0.21983541816676 0.99241526465359 0.91449812118546 15.999 > 73 83 O 0.55316875150009 0.99241526465359 0.91449812118546 15.999 > 73 84 O 0.88650208483343 0.99241526465359 0.91449812118546 15.999 > 73 85 O 0.11349791516657 0.24241526465359 0.08550187881454 15.999 > 85 86 O 0.44683124849991 0.24241526465359 0.08550187881454 15.999 > 85 87 O 0.78016458183324 0.24241526465359 0.08550187881454 15.999 > 85 88 O 0.11349791516657 0.74241526465359 0.08550187881454 15.999 > 85 89 O 0.44683124849991 0.74241526465359 0.08550187881454 15.999 > 85 90 O 0.78016458183324 0.74241526465359 0.08550187881454 15.999 > 85 91 O 0.11349791516657 0.24241526465359 0.58550187881454 15.999 > 85 92 O 0.44683124849991 0.24241526465359 0.58550187881454 15.999 > 85 93 O 0.78016458183324 0.24241526465359 0.58550187881454 15.999 > 85 94 O 0.11349791516657 0.74241526465359 0.58550187881454 15.999 > 85 95 O 0.44683124849991 0.74241526465359 0.58550187881454 15.999 > 85 96 O 0.78016458183324 0.74241526465359 0.58550187881454 15.999 > 85 97 La 0.04032096507467 0.12500000000000 0.38820652957611 138.905 > 97 98 La 0.37365429840800 0.12500000000000 0.38820652957611 138.905 > 97 99 La 0.70698763174134 0.12500000000000 0.38820652957611 138.905 > 97 100 La 0.04032096507467 0.62500000000000 0.38820652957611 138.905 > 97 101 La 0.37365429840800 0.62500000000000 0.38820652957611 138.905 > 97 102 La 0.70698763174134 0.62500000000000 0.38820652957611 138.905 > 97 103 La 0.04032096507467 0.12500000000000 0.88820652957611 138.905 > 97 104 La 0.37365429840800 0.12500000000000 0.88820652957611 138.905 > 97 105 La 0.70698763174134 0.12500000000000 0.88820652957611 138.905 > 97 106 La 0.04032096507467 0.62500000000000 0.88820652957611 138.905 > 97 107 La 0.37365429840800 0.62500000000000 0.88820652957611 138.905 > 97 108 La 0.70698763174134 0.62500000000000 0.88820652957611 138.905 > 97 109 La 0.29301236825866 0.37500000000000 0.11179347042389 138.905 > 109 110 La 0.62634570159200 0.37500000000000 0.11179347042389 138.905 > 109 111 La 0.95967903492533 0.37500000000000 0.11179347042389 138.905 > 109 112 La 0.29301236825866 0.87500000000000 0.11179347042389 138.905 > 109 113 La 0.62634570159200 0.87500000000000 0.11179347042389 138.905 > 109 114 La 0.95967903492533 0.87500000000000 0.11179347042389 138.905 > 109 115 La 0.29301236825866 0.37500000000000 0.61179347042389 138.905 > 109 116 La 0.62634570159200 0.37500000000000 0.61179347042389 138.905 > 109 117 La 0.95967903492533 0.37500000000000 0.61179347042389 138.905 > 109 118 La 0.29301236825866 0.87500000000000 0.61179347042389 138.905 > 109 119 La 0.62634570159200 0.87500000000000 0.61179347042389 138.905 > 109 120 La 0.95967903492533 0.87500000000000 0.61179347042389 138.905 > 109 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py.yaml". --------------------------- Dielectric constant ---------------------------- 3.7594156 0.0000000 0.3206861 0.0000000 3.9093049 0.0000000 0.3206843 0.0000000 3.6492729 -------------------------- Born effective charges -------------------------- 1 B 1.8549495 0.0000000 1.1246945 0.0000000 2.8398055 0.0000000 1.2909281 0.0000000 1.4755943 2 B 1.8549495 0.0000000 1.1246945 0.0000000 2.8398055 0.0000000 1.2909281 0.0000000 1.4755943 3 O -2.1959648 -0.3894727 -0.2737351 -0.4445023 -2.5231393 -0.0171609 -0.3110100 -0.0901912 -1.5534693 4 O -2.1959648 0.3894727 -0.2737351 0.4445023 -2.5231393 0.0171609 -0.3110100 0.0901912 -1.5534693 5 O -1.8083090 0.0000000 -0.8166703 0.0000000 -1.8869023 0.0000000 -0.8465236 0.0000000 -2.5174603 6 O -1.8083090 0.0000000 -0.8166703 0.0000000 -1.8869023 0.0000000 -0.8465236 0.0000000 -2.5174603 7 O -2.1959648 -0.3894727 -0.2737351 -0.4445023 -2.5231393 -0.0171609 -0.3110100 -0.0901912 -1.5534693 8 O -2.1959648 0.3894727 -0.2737351 0.4445023 -2.5231393 0.0171609 -0.3110100 0.0901912 -1.5534693 9 La 4.3452891 0.0000000 0.2394459 0.0000000 4.0933753 0.0000000 0.1776154 0.0000000 4.1488047 10 La 4.3452891 0.0000000 0.2394459 0.0000000 4.0933753 0.0000000 0.1776154 0.0000000 4.1488047 ---------------------------------------------------------------------------- fc3 was read from "fc3.hdf5". fc2 was read from "fc2.hdf5". ----------------------------- Force constants ------------------------------ Max drift of fc3: 0.00000004 (xxx) 0.00000004 (xxx) 0.00000004 (xxx) Max drift of fc2: -0.00000000 (xz) -0.00000000 (xz) --------------------------- 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 ... [ 13 10 8 ] 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: 0.83, Number of G-points: 299, Lambda: 0.17 Running harmonic phonon calculations... -------------------- Lattice thermal conductivity (RTA) -------------------- ======================= Grid point 0 (1/318) ======================= q-point: ( 0.00 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 318 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.000 ( 0.000 0.000 0.000) 0.000 0.000 ( 0.000 0.000 0.000) 0.000 0.000 ( 0.000 0.000 0.000) 0.000 2.500 ( 0.000 0.000 0.000) 0.000 2.585 ( 0.000 0.000 0.000) 0.000 2.815 ( 0.000 0.000 0.000) 0.000 4.087 ( 0.000 0.000 0.000) 0.000 5.300 ( 0.000 0.000 0.000) 0.000 5.681 ( 0.000 0.000 0.000) 0.000 5.686 ( 0.000 0.000 0.000) 0.000 5.759 ( 0.000 0.000 0.000) 0.000 6.087 ( 0.000 0.000 0.000) 0.000 6.634 ( 0.000 0.000 0.000) 0.000 6.808 ( 0.000 0.000 0.000) 0.000 7.606 ( 0.000 0.000 0.000) 0.000 9.387 ( 0.000 0.000 0.000) 0.000 9.511 ( 0.000 0.000 0.000) 0.000 9.748 ( 0.000 0.000 0.000) 0.000 16.618 ( 0.000 0.000 0.000) 0.000 17.106 ( 0.000 0.000 0.000) 0.000 17.357 ( 0.000 0.000 0.000) 0.000 18.030 ( 0.000 0.000 0.000) 0.000 21.209 ( 0.000 0.000 0.000) 0.000 21.446 ( 0.000 0.000 0.000) 0.000 28.030 ( 0.000 0.000 0.000) 0.000 28.052 ( 0.000 0.000 0.000) 0.000 36.687 ( 0.000 0.000 0.000) 0.000 37.433 ( 0.000 0.000 0.000) 0.000 37.663 ( 0.000 0.000 0.000) 0.000 37.752 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 1 (2/318) ======================= q-point: ( 0.08 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 318 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.412 ( 15.559 0.000 28.940) 32.858 0.707 ( 34.463 0.000 9.031) 35.626 1.241 ( 57.243 0.000 29.607) 64.447 2.435 ( 3.816 0.000 -8.504) 9.322 2.876 ( 16.059 0.000 17.920) 24.063 2.979 ( 17.472 0.000 -3.191) 17.761 4.121 ( 2.937 0.000 3.468) 4.544 5.189 ( -6.946 0.000 -12.103) 13.954 5.523 ( -14.828 0.000 3.158) 15.160 5.793 ( -0.373 0.000 7.106) 7.115 5.888 ( 16.980 0.000 -35.885) 39.699 6.044 ( -3.234 0.000 0.486) 3.270 6.796 ( -1.337 0.000 -1.063) 1.708 7.523 ( -9.659 0.000 2.076) 9.880 8.483 ( -3.366 0.000 6.890) 7.668 9.417 ( 3.569 0.000 -1.594) 3.909 9.461 ( -4.724 0.000 -1.525) 4.964 12.066 ( -15.523 0.000 20.391) 25.627 16.628 ( 0.389 0.000 1.880) 1.920 17.074 ( -2.888 0.000 -1.536) 3.271 17.385 ( 1.990 0.000 2.318) 3.055 18.243 ( -2.283 0.000 -4.875) 5.383 21.333 ( 8.084 0.000 -27.516) 28.679 21.459 ( 0.993 0.000 1.050) 1.445 28.020 ( -0.341 0.000 0.675) 0.756 28.092 ( 2.838 0.000 1.405) 3.167 36.703 ( 1.643 0.000 0.417) 1.695 37.657 ( -0.537 0.000 -0.648) 0.842 37.746 ( 0.053 0.000 -1.926) 1.926 40.439 ( -36.345 0.000 102.243) 108.511 ======================= Grid point 2 (3/318) ======================= q-point: ( 0.15 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 318 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.924 ( 23.282 0.000 20.645) 31.117 1.369 ( 31.283 0.000 7.506) 32.171 2.459 ( 55.218 0.000 28.039) 61.929 2.548 ( 11.767 0.000 -5.211) 12.869 3.281 ( 13.048 0.000 17.753) 22.032 3.359 ( 24.368 0.000 -5.096) 24.895 4.259 ( 9.241 0.000 7.248) 11.745 4.955 ( -6.994 0.000 -16.749) 18.150 5.220 ( -18.966 0.000 2.840) 19.178 5.758 ( -7.162 0.000 5.237) 8.873 5.999 ( 13.707 0.000 -21.803) 25.753 6.049 ( 2.815 0.000 3.516) 4.504 6.731 ( -5.345 0.000 -0.695) 5.390 7.273 ( -19.435 0.000 4.983) 20.063 8.441 ( -6.270 0.000 7.418) 9.713 9.330 ( -7.842 0.000 -2.363) 8.190 9.494 ( 5.557 0.000 -1.203) 5.686 11.836 ( -14.892 0.000 -0.921) 14.920 16.652 ( 0.471 0.000 3.249) 3.283 16.985 ( -5.161 0.000 -2.827) 5.885 17.439 ( 1.725 0.000 2.715) 3.216 18.137 ( -5.045 0.000 -7.707) 9.211 21.316 ( 2.903 0.000 -12.286) 12.624 21.492 ( 1.512 0.000 2.020) 2.523 28.031 ( 0.995 0.000 0.691) 1.211 28.163 ( 3.252 0.000 2.823) 4.306 36.752 ( 3.171 0.000 0.878) 3.290 37.635 ( -1.191 0.000 -1.272) 1.742 37.734 ( 0.489 0.000 -3.467) 3.501 40.345 ( -20.557 0.000 44.955) 49.432 ======================= Grid point 3 (4/318) ======================= q-point: ( 0.23 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 318 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.492 ( 26.567 0.000 13.117) 29.629 1.943 ( 26.220 0.000 5.822) 26.859 2.767 ( 13.260 0.000 -2.908) 13.575 3.415 ( -8.514 0.000 3.416) 9.174 3.522 ( 37.442 0.000 10.740) 38.952 3.832 ( 33.617 0.000 8.913) 34.779 4.562 ( 18.081 0.000 7.345) 19.516 4.845 ( 6.234 0.000 -10.866) 12.527 4.890 ( -16.887 0.000 2.144) 17.023 5.648 ( -6.533 0.000 4.343) 7.845 6.146 ( 13.556 0.000 -13.591) 19.196 6.147 ( 4.584 0.000 3.726) 5.907 6.600 ( -8.371 0.000 1.982) 8.603 6.875 ( -27.304 0.000 8.579) 28.620 8.321 ( -10.982 0.000 5.180) 12.142 9.157 ( -8.959 0.000 -2.445) 9.287 9.608 ( 6.411 0.000 2.255) 6.796 11.525 ( -14.404 0.000 -11.171) 18.228 16.680 ( 0.096 0.000 3.841) 3.842 16.858 ( -6.183 0.000 -3.639) 7.174 17.463 ( -0.709 0.000 1.032) 1.252 17.971 ( -7.168 0.000 -9.313) 11.752 21.298 ( 1.197 0.000 -6.601) 6.709 21.534 ( 1.483 0.000 2.597) 2.991 28.063 ( 2.008 0.000 0.586) 2.092 28.238 ( 2.704 0.000 3.540) 4.455 36.830 ( 4.434 0.000 1.384) 4.645 37.597 ( -2.010 0.000 -1.834) 2.721 37.727 ( 1.295 0.000 -4.255) 4.448 40.221 ( -14.602 0.000 24.251) 28.307 ======================= Grid point 4 (5/318) ======================= q-point: ( 0.31 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 318 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.034 ( 24.674 0.000 7.257) 25.719 2.401 ( 19.685 0.000 4.385) 20.168 2.896 ( -9.279 0.000 -4.589) 10.351 3.119 ( -5.642 0.000 -10.800) 12.185 3.918 ( 15.161 0.000 -6.950) 16.678 4.597 ( -6.555 0.000 -0.236) 6.559 4.740 ( 37.510 0.000 19.349) 42.206 4.975 ( 8.125 0.000 -5.119) 9.603 5.003 ( 20.289 0.000 8.055) 21.830 5.609 ( -0.213 0.000 6.649) 6.652 6.231 ( 2.310 0.000 -0.992) 2.514 6.329 ( 7.806 0.000 -1.483) 7.946 6.402 ( -24.513 0.000 7.130) 25.529 6.496 ( -4.252 0.000 8.385) 9.402 8.100 ( -14.616 0.000 1.630) 14.707 8.979 ( -8.574 0.000 -2.153) 8.840 9.758 ( 6.534 0.000 7.726) 10.119 11.183 ( -13.135 0.000 -17.262) 21.692 16.683 ( -3.403 0.000 1.506) 3.721 16.740 ( -2.746 0.000 -1.615) 3.186 17.424 ( -3.215 0.000 -1.252) 3.450 17.776 ( -7.726 0.000 -8.822) 11.727 21.284 ( 0.570 0.000 -3.458) 3.505 21.574 ( 1.043 0.000 2.556) 2.761 28.108 ( 2.347 0.000 0.513) 2.402 28.299 ( 1.598 0.000 3.251) 3.622 36.930 ( 5.224 0.000 1.859) 5.545 37.539 ( -2.907 0.000 -2.257) 3.680 37.733 ( 1.964 0.000 -4.049) 4.500 40.102 ( -10.066 0.000 13.462) 16.810 ======================= Grid point 5 (6/318) ======================= q-point: ( 0.38 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 318 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.353 ( -26.914 0.000 -15.412) 31.015 2.463 ( 17.390 0.000 3.428) 17.725 2.746 ( 13.204 0.000 1.752) 13.320 3.175 ( 5.235 0.000 -3.024) 6.046 4.118 ( 12.380 0.000 -9.196) 15.422 4.457 ( -4.631 0.000 -1.269) 4.802 5.007 ( -0.712 0.000 -3.903) 3.967 5.366 ( 11.858 0.000 9.021) 14.899 5.407 ( 14.440 0.000 7.977) 16.497 5.708 ( 4.945 0.000 6.417) 8.102 6.047 ( -8.806 0.000 16.937) 19.089 6.211 ( -1.788 0.000 -3.017) 3.507 6.531 ( 10.191 0.000 -3.488) 10.771 6.563 ( 3.820 0.000 9.542) 10.278 7.828 ( -13.897 0.000 -0.803) 13.920 8.823 ( -6.693 0.000 -1.648) 6.893 9.945 ( 7.026 0.000 13.533) 15.248 10.839 ( -11.900 0.000 -20.415) 23.630 16.586 ( -4.550 0.000 -1.857) 4.914 16.733 ( -0.052 0.000 1.605) 1.606 17.345 ( -3.648 0.000 -2.242) 4.282 17.599 ( -6.061 0.000 -6.216) 8.682 21.278 ( 0.320 0.000 -1.572) 1.604 21.601 ( 0.516 0.000 1.855) 1.926 28.151 ( 1.908 0.000 0.410) 1.951 28.335 ( 0.549 0.000 2.169) 2.238 37.040 ( 5.174 0.000 2.087) 5.579 37.464 ( -3.512 0.000 -2.356) 4.229 37.749 ( 1.852 0.000 -2.876) 3.421 40.014 ( -5.839 0.000 6.870) 9.016 ======================= Grid point 6 (7/318) ======================= q-point: ( 0.46 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 318 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.872 ( -13.059 0.000 -8.650) 15.664 2.697 ( 6.120 0.000 1.040) 6.208 2.938 ( 5.610 0.000 1.030) 5.704 3.213 ( 0.710 0.000 -1.163) 1.363 4.269 ( 7.700 0.000 -5.720) 9.592 4.401 ( -1.403 0.000 -0.816) 1.623 4.961 ( -1.394 0.000 -1.319) 1.919 5.309 ( -10.669 0.000 6.701) 12.599 5.608 ( 5.588 0.000 1.587) 5.809 5.812 ( 2.511 0.000 2.574) 3.596 6.167 ( -1.084 0.000 -1.340) 1.723 6.249 ( 9.646 0.000 7.042) 11.943 6.641 ( 2.763 0.000 -1.234) 3.026 6.675 ( 2.627 0.000 3.750) 4.579 7.624 ( -6.235 0.000 -0.807) 6.287 8.726 ( -2.672 0.000 -0.673) 2.756 10.179 ( 8.016 0.000 16.951) 18.751 10.512 ( -9.908 0.000 -19.424) 21.805 16.518 ( -1.690 0.000 -0.775) 1.859 16.740 ( -0.020 0.000 0.649) 0.649 17.282 ( -1.571 0.000 -1.094) 1.915 17.493 ( -2.318 0.000 -2.225) 3.213 21.276 ( 0.115 0.000 -0.435) 0.450 21.615 ( 0.139 0.000 0.675) 0.689 28.179 ( 0.758 0.000 0.168) 0.776 28.348 ( 0.051 0.000 0.741) 0.743 37.131 ( 2.914 0.000 1.297) 3.189 37.393 ( -2.310 0.000 -1.391) 2.697 37.763 ( 0.765 0.000 -1.036) 1.287 39.969 ( -1.896 0.000 2.119) 2.843 ======================= Grid point 13 (8/318) ======================= q-point: ( 0.00 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 265 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.434 ( 0.000 23.139 0.000) 23.139 0.761 ( 0.000 38.793 0.000) 38.793 1.313 ( 0.000 61.126 0.000) 61.126 2.795 ( 0.000 3.099 0.000) 3.099 2.946 ( 0.000 31.137 0.000) 31.137 3.069 ( 0.000 16.089 0.000) 16.089 4.049 ( 0.000 -3.103 0.000) 3.103 5.308 ( 0.000 0.535 0.000) 0.535 5.675 ( 0.000 -1.121 0.000) 1.121 5.708 ( 0.000 2.881 0.000) 2.881 6.227 ( 0.000 11.726 0.000) 11.726 6.659 ( 0.000 4.887 0.000) 4.887 6.715 ( 0.000 -2.726 0.000) 2.726 7.642 ( 0.000 3.565 0.000) 3.565 9.389 ( 0.000 0.110 0.000) 0.110 9.466 ( 0.000 -4.443 0.000) 4.443 9.744 ( 0.000 -0.350 0.000) 0.350 10.273 ( 0.000 -0.927 0.000) 0.927 16.728 ( 0.000 0.285 0.000) 0.285 17.106 ( 0.000 0.035 0.000) 0.035 17.360 ( 0.000 0.233 0.000) 0.233 17.972 ( 0.000 -5.785 0.000) 5.785 21.216 ( 0.000 0.628 0.000) 0.628 21.440 ( 0.000 -0.592 0.000) 0.592 27.999 ( 0.000 -2.970 0.000) 2.970 28.025 ( 0.000 -2.689 0.000) 2.689 37.317 ( 0.000 -7.118 0.000) 7.118 37.706 ( 0.000 -4.437 0.000) 4.437 37.886 ( 0.000 17.615 0.000) 17.615 40.155 ( 0.000 -0.127 0.000) 0.127 ======================= Grid point 14 (9/318) ======================= q-point: ( 0.08 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.605 ( 10.327 16.773 23.875) 30.952 0.940 ( 20.683 22.731 9.056) 32.039 1.834 ( 38.230 46.490 17.864) 62.785 2.800 ( -0.229 27.499 -10.483) 29.430 2.972 ( 14.758 4.140 0.262) 15.330 3.182 ( 8.488 20.783 10.494) 24.781 4.078 ( 2.446 -3.690 3.784) 5.823 5.231 ( -6.725 0.321 -11.896) 13.669 5.532 ( -14.380 1.828 7.132) 16.155 5.790 ( 10.317 -0.145 -11.848) 15.711 6.087 ( -10.434 10.509 -3.554) 15.230 6.377 ( -4.481 21.011 -10.351) 23.847 6.852 ( 1.026 5.505 1.147) 5.716 7.577 ( -8.634 5.463 1.369) 10.309 8.735 ( -25.636 18.950 -4.779) 32.236 9.407 ( 1.317 -0.935 -2.445) 2.930 9.445 ( -2.661 -1.427 -2.360) 3.832 11.364 ( 21.494 -42.690 26.321) 54.564 16.700 ( -1.232 3.916 0.892) 4.200 17.142 ( -0.182 3.386 0.945) 3.521 17.292 ( -1.313 -4.602 -0.364) 4.799 18.075 ( 4.600 -10.943 -3.795) 12.463 21.272 ( 6.513 -2.493 -11.083) 13.094 21.451 ( 0.874 -0.695 1.066) 1.544 27.990 ( -0.350 -2.927 0.543) 2.998 28.060 ( 2.427 -2.997 1.866) 4.284 37.065 ( -9.905 14.435 -10.858) 20.600 37.709 ( 0.667 -2.550 -5.451) 6.055 37.824 ( -2.633 16.257 1.500) 16.537 40.237 ( -15.940 -11.220 56.594) 59.857 ======================= Grid point 15 (10/318) ======================= q-point: ( 0.15 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.036 ( 20.573 10.837 19.926) 30.623 1.492 ( 28.231 10.391 11.237) 32.112 2.721 ( 42.715 25.505 20.358) 53.754 2.826 ( 7.055 23.585 -5.154) 25.151 3.366 ( 25.233 1.407 -1.484) 25.315 3.441 ( 9.699 13.874 13.592) 21.709 4.209 ( 8.771 -4.496 7.751) 12.539 4.958 ( -10.008 -1.615 -18.687) 21.260 5.259 ( -17.645 4.065 3.977) 18.539 5.895 ( -3.618 9.689 3.156) 10.813 5.961 ( 8.663 -0.145 -13.727) 16.232 6.319 ( 0.383 19.761 -0.976) 19.788 6.813 ( -4.897 9.853 -0.149) 11.004 7.335 ( -18.115 7.390 2.737) 19.755 8.481 ( -9.541 4.257 6.613) 12.364 9.318 ( -6.630 -0.995 -2.927) 7.315 9.468 ( 3.962 -2.473 -0.701) 4.723 11.515 ( -6.287 -27.339 2.124) 28.133 16.705 ( 0.259 4.375 2.631) 5.112 17.076 ( -4.579 8.267 -3.106) 9.948 17.333 ( 2.569 -9.387 2.907) 10.157 18.051 ( -2.436 -7.674 -7.892) 11.274 21.298 ( 3.018 -1.317 -8.814) 9.409 21.482 ( 1.398 -0.948 1.909) 2.549 27.998 ( 0.789 -3.176 0.616) 3.330 28.127 ( 3.001 -3.439 3.068) 5.500 36.939 ( -0.719 13.698 -3.480) 14.151 37.674 ( -0.181 0.431 -6.458) 6.475 37.803 ( -1.567 10.662 1.882) 10.940 40.205 ( -16.484 -11.816 37.434) 42.575 ======================= Grid point 16 (11/318) ======================= q-point: ( 0.23 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.559 ( 24.539 6.911 12.752) 28.505 2.041 ( 24.240 8.149 7.624) 26.686 2.941 ( 6.687 14.477 -2.564) 16.152 3.489 ( 0.986 8.834 6.602) 11.072 3.573 ( 23.994 3.930 1.689) 24.373 3.918 ( 31.183 8.382 11.804) 34.380 4.505 ( 17.430 -5.509 8.173) 20.023 4.740 ( -4.562 -5.951 -8.742) 11.517 4.998 ( -7.480 5.792 -0.868) 9.500 5.802 ( -5.809 12.839 5.096) 14.985 6.117 ( 13.084 -1.663 -10.689) 16.977 6.355 ( 2.100 15.464 3.836) 16.070 6.679 ( -10.826 9.876 3.482) 15.062 6.970 ( -21.713 11.491 2.726) 24.717 8.333 ( -11.675 1.425 5.838) 13.131 9.161 ( -8.345 0.419 -2.667) 8.771 9.564 ( 5.711 -4.203 2.880) 7.653 11.308 ( -11.612 -19.785 -9.767) 24.933 16.731 ( 0.426 4.738 3.350) 5.819 16.963 ( -4.970 9.697 -4.296) 11.713 17.377 ( 0.231 -7.970 1.700) 8.153 17.918 ( -5.806 -5.016 -9.603) 12.292 21.293 ( 1.263 -0.365 -5.485) 5.640 21.522 ( 1.399 -1.232 2.410) 3.047 28.025 ( 1.744 -3.660 0.491) 4.083 28.200 ( 2.570 -3.738 3.653) 5.825 36.953 ( 2.843 10.470 -0.638) 10.867 37.632 ( -0.628 1.911 -5.086) 5.469 37.780 ( -1.301 7.158 -0.383) 7.285 40.099 ( -13.477 -11.350 22.376) 28.481 ======================= Grid point 17 (12/318) ======================= q-point: ( 0.31 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.063 ( 22.641 3.302 7.150) 23.972 2.472 ( 18.452 6.076 4.338) 19.905 2.947 ( -10.648 4.474 -3.635) 12.108 3.257 ( -7.514 12.772 -10.145) 17.958 3.955 ( 15.491 3.877 -6.275) 17.157 4.536 ( -1.122 -5.282 1.211) 5.535 4.671 ( 22.650 -5.592 11.335) 25.938 4.911 ( 20.222 -6.938 5.773) 22.145 5.076 ( 11.262 6.157 3.935) 13.425 5.785 ( 1.057 14.938 7.894) 16.929 6.303 ( 10.938 -1.948 -4.220) 11.884 6.370 ( -19.352 -1.318 12.800) 23.240 6.453 ( -2.095 18.268 1.967) 18.493 6.675 ( -8.484 19.301 -0.840) 21.100 8.109 ( -14.827 1.015 2.298) 15.038 8.988 ( -8.469 0.806 -2.003) 8.740 9.710 ( 6.345 -4.515 8.176) 11.292 11.010 ( -11.583 -16.110 -16.573) 25.853 16.750 ( -0.796 6.158 2.712) 6.776 16.855 ( -3.392 11.044 -3.883) 12.188 17.358 ( -2.434 -6.121 -0.363) 6.597 17.741 ( -6.883 -3.297 -9.135) 11.903 21.285 ( 0.587 0.047 -3.020) 3.077 21.559 ( 1.016 -1.453 2.367) 2.958 28.065 ( 2.145 -4.139 0.454) 4.684 28.260 ( 1.537 -3.905 3.283) 5.328 37.023 ( 4.476 8.479 0.774) 9.619 37.584 ( -2.148 3.732 -3.230) 5.383 37.757 ( -0.080 3.318 -2.384) 4.086 39.986 ( -9.759 -11.218 12.940) 19.711 ======================= Grid point 18 (13/318) ======================= q-point: ( 0.38 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.416 ( 0.163 2.210 -0.691) 2.321 2.537 ( -8.047 11.138 -7.766) 15.784 2.785 ( 12.533 3.354 1.197) 13.029 3.211 ( 1.628 3.457 -3.779) 5.374 4.153 ( 12.045 3.347 -10.247) 16.164 4.422 ( -5.009 -2.712 1.079) 5.797 4.976 ( 4.816 -4.530 -2.036) 6.918 5.307 ( 15.233 -7.937 4.522) 17.762 5.368 ( 8.490 0.988 11.788) 14.560 5.942 ( 9.345 15.765 7.952) 19.978 6.025 ( -16.227 1.596 16.201) 22.985 6.467 ( -0.872 21.716 -3.137) 21.958 6.480 ( 8.858 -2.375 -1.690) 9.325 6.631 ( 1.831 7.711 4.201) 8.970 7.838 ( -13.996 1.000 -0.464) 14.039 8.838 ( -6.403 1.193 -1.162) 6.616 9.893 ( 6.550 -4.968 13.666) 15.948 10.696 ( -10.471 -13.236 -20.105) 26.250 16.713 ( -3.006 11.529 -0.924) 11.950 16.818 ( 0.013 8.477 -0.103) 8.477 17.297 ( -3.100 -4.374 -1.354) 5.529 17.574 ( -5.608 -2.340 -6.557) 8.940 21.280 ( 0.319 0.208 -1.395) 1.446 21.586 ( 0.531 -1.563 1.721) 2.384 28.105 ( 1.801 -4.447 0.394) 4.814 28.295 ( 0.537 -3.975 2.169) 4.560 37.120 ( 4.970 7.512 1.521) 9.135 37.512 ( -3.716 4.611 -2.212) 6.322 37.751 ( 0.916 0.499 -2.499) 2.708 39.899 ( -5.789 -11.273 6.729) 14.348 ======================= Grid point 19 (14/318) ======================= q-point: ( 0.46 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.077 ( -10.914 19.210 -6.325) 22.981 2.682 ( 5.479 -1.066 0.839) 5.644 2.959 ( 4.987 1.779 0.441) 5.313 3.210 ( -0.092 -0.300 -1.116) 1.159 4.291 ( 8.949 0.914 -9.650) 13.192 4.364 ( -3.977 -1.493 4.424) 6.133 5.022 ( 3.787 4.778 -2.984) 6.788 5.303 ( -12.375 0.194 7.401) 14.421 5.519 ( 5.120 -8.806 1.698) 10.327 6.047 ( 3.539 17.192 6.668) 18.777 6.139 ( 5.288 -4.622 3.285) 7.753 6.429 ( -0.448 22.429 -1.491) 22.483 6.604 ( 4.767 -2.583 -0.580) 5.452 6.688 ( 0.392 1.280 2.358) 2.712 7.633 ( -6.260 0.935 -0.727) 6.371 8.749 ( -2.419 1.974 -0.381) 3.146 10.118 ( 7.582 -6.532 18.242) 20.806 10.391 ( -9.134 -10.417 -20.639) 24.858 16.665 ( -1.231 13.852 -0.678) 13.924 16.823 ( 0.142 7.888 0.258) 7.893 17.246 ( -1.363 -3.179 -0.687) 3.526 17.472 ( -2.185 -2.028 -2.398) 3.826 21.279 ( 0.112 0.260 -0.388) 0.480 21.599 ( 0.151 -1.591 0.627) 1.717 28.132 ( 0.723 -4.584 0.168) 4.644 28.308 ( 0.057 -3.980 0.738) 4.048 37.210 ( 3.195 7.633 1.175) 8.358 37.434 ( -2.822 4.026 -1.301) 5.086 37.755 ( 0.516 -0.620 -0.991) 1.277 39.853 ( -1.899 -11.352 2.090) 11.698 ======================= Grid point 26 (15/318) ======================= q-point: ( 0.00 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 318 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.906 ( 0.000 24.428 0.000) 24.428 1.511 ( 0.000 36.351 0.000) 36.351 2.297 ( 0.000 35.683 0.000) 35.683 2.964 ( 0.000 14.871 0.000) 14.871 3.375 ( 0.000 8.609 0.000) 8.609 3.586 ( 0.000 29.633 0.000) 29.633 4.071 ( 0.000 11.113 0.000) 11.113 5.309 ( 0.000 -0.478 0.000) 0.478 5.645 ( 0.000 -1.706 0.000) 1.706 5.802 ( 0.000 6.689 0.000) 6.689 6.331 ( 0.000 -2.852 0.000) 2.852 6.645 ( 0.000 -4.081 0.000) 4.081 7.010 ( 0.000 30.339 0.000) 30.339 7.740 ( 0.000 6.177 0.000) 6.177 9.348 ( 0.000 -6.977 0.000) 6.977 9.391 ( 0.000 0.031 0.000) 0.031 9.739 ( 0.000 0.063 0.000) 0.063 10.245 ( 0.000 -1.864 0.000) 1.864 16.742 ( 0.000 1.257 0.000) 1.257 17.107 ( 0.000 -0.011 0.000) 0.011 17.362 ( 0.000 -0.081 0.000) 0.081 17.813 ( 0.000 -9.904 0.000) 9.904 21.234 ( 0.000 1.171 0.000) 1.171 21.423 ( 0.000 -1.104 0.000) 1.104 27.922 ( 0.000 -4.581 0.000) 4.581 27.953 ( 0.000 -4.425 0.000) 4.425 37.199 ( 0.000 -4.737 0.000) 4.737 37.586 ( 0.000 -7.421 0.000) 7.421 38.295 ( 0.000 23.131 0.000) 23.131 40.140 ( 0.000 -1.725 0.000) 1.725 ======================= Grid point 27 (16/318) ======================= q-point: ( 0.08 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 522 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.003 ( 6.296 22.374 13.523) 26.890 1.481 ( 4.136 29.507 0.989) 29.812 2.692 ( 28.670 33.144 17.760) 47.286 3.081 ( 12.647 12.889 -2.522) 18.232 3.316 ( -0.621 14.721 -10.137) 17.885 3.636 ( 1.806 23.168 8.245) 24.657 4.068 ( -0.575 7.945 4.143) 8.979 5.212 ( -7.613 -1.478 -13.247) 15.350 5.577 ( -9.855 2.086 5.933) 11.691 5.805 ( 5.371 2.241 -9.245) 10.925 6.175 ( -8.678 -1.669 -4.072) 9.730 6.697 ( -0.141 5.624 2.842) 6.303 7.077 ( 4.082 24.555 3.731) 25.170 7.728 ( -2.756 9.286 2.163) 9.925 9.033 ( -29.613 9.083 -0.714) 30.983 9.399 ( -0.438 0.337 -6.126) 6.150 9.422 ( -3.306 0.407 -6.090) 6.941 10.739 ( 18.807 -22.308 16.943) 33.740 16.756 ( 1.085 2.010 1.218) 2.589 17.110 ( 0.427 -3.460 0.998) 3.627 17.318 ( -2.822 4.008 -2.115) 5.339 17.859 ( 4.266 -11.252 -4.266) 12.767 21.255 ( 2.908 0.239 -3.582) 4.620 21.432 ( 0.680 -1.247 0.841) 1.651 27.914 ( -0.438 -4.532 0.418) 4.573 27.981 ( 1.855 -4.814 1.937) 5.511 37.166 ( -1.329 0.034 -3.871) 4.092 37.609 ( 3.067 -6.899 -4.159) 8.620 38.246 ( -4.702 23.808 0.363) 24.271 40.089 ( -11.737 -5.032 21.012) 24.589 ======================= Grid point 28 (17/318) ======================= q-point: ( 0.15 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 522 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.311 ( 15.711 16.181 19.400) 29.750 1.753 ( 19.926 16.237 8.490) 27.069 3.237 ( 4.439 13.848 -7.367) 16.302 3.338 ( 16.989 30.653 9.774) 36.384 3.407 ( 24.664 2.816 2.477) 24.948 3.776 ( 8.808 19.033 11.748) 24.039 4.140 ( 5.019 0.571 9.511) 10.769 4.906 ( -11.915 -2.549 -20.686) 24.007 5.350 ( -16.597 4.794 3.949) 17.721 5.911 ( 11.354 -1.933 -10.636) 15.677 6.040 ( -5.544 0.909 2.164) 6.020 6.667 ( -4.646 9.246 4.278) 11.197 7.119 ( -2.743 23.665 3.589) 24.092 7.625 ( -8.975 20.695 -1.135) 22.586 8.614 ( -16.827 8.864 5.840) 19.895 9.306 ( -4.017 0.371 -5.077) 6.485 9.408 ( 0.514 -3.321 0.409) 3.385 10.958 ( 0.109 -26.141 2.885) 26.300 16.793 ( 1.783 3.869 2.027) 4.717 17.137 ( 1.288 -8.796 0.974) 8.943 17.260 ( -1.464 9.181 -2.721) 9.687 17.871 ( 0.645 -9.949 -7.914) 12.729 21.281 ( 2.286 -0.255 -4.398) 4.963 21.456 ( 1.105 -1.633 1.527) 2.494 27.915 ( 0.316 -4.848 0.506) 4.885 28.036 ( 2.321 -5.526 3.189) 6.789 37.134 ( 0.679 5.476 -3.816) 6.709 37.632 ( 2.891 -4.059 -6.869) 8.487 38.147 ( -6.514 21.807 2.290) 22.874 39.972 ( -14.765 -10.566 23.269) 29.514 ======================= Grid point 29 (18/318) ======================= q-point: ( 0.23 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 522 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.754 ( 20.178 12.150 13.369) 27.083 2.208 ( 20.905 8.594 9.568) 24.544 3.178 ( -4.621 6.140 -3.636) 8.501 3.673 ( 11.413 7.810 -2.959) 14.142 3.762 ( 12.136 15.470 6.028) 20.566 4.115 ( 16.460 9.328 8.347) 20.679 4.386 ( 13.453 -3.801 10.462) 17.460 4.643 ( -3.670 -3.337 -9.453) 10.675 5.095 ( -8.314 4.292 0.879) 9.397 5.980 ( -2.438 3.366 5.407) 6.820 6.079 ( 11.258 -2.472 -6.561) 13.263 6.570 ( -10.653 2.818 7.702) 13.444 7.028 ( -8.240 26.984 3.319) 28.409 7.427 ( -8.862 31.786 -4.804) 33.346 8.389 ( -14.049 4.602 7.758) 16.695 9.174 ( -7.707 0.785 -3.149) 8.363 9.466 ( 4.608 -4.680 4.038) 7.710 10.856 ( -7.483 -23.409 -8.342) 25.954 16.843 ( 2.177 5.866 2.470) 6.727 17.134 ( -0.744 -2.303 -4.313) 4.946 17.247 ( 0.252 4.691 0.927) 4.788 17.795 ( -2.890 -6.794 -9.685) 12.179 21.289 ( 1.143 0.003 -3.399) 3.586 21.488 ( 1.150 -2.118 1.921) 3.082 27.931 ( 1.066 -5.491 0.387) 5.607 28.099 ( 2.099 -6.258 3.703) 7.568 37.149 ( 2.835 7.843 -2.469) 8.697 37.638 ( 2.297 -1.022 -6.935) 7.377 38.034 ( -7.256 17.361 2.537) 18.987 39.830 ( -13.346 -14.540 17.620) 26.457 ======================= Grid point 30 (19/318) ======================= q-point: ( 0.31 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 522 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.174 ( 17.530 7.899 7.386) 20.598 2.591 ( 15.805 5.269 4.450) 17.244 3.034 ( -9.478 3.478 -0.556) 10.111 3.562 ( -11.542 16.440 -9.125) 22.063 4.078 ( 15.240 8.532 -6.227) 18.543 4.412 ( 10.781 -7.572 3.481) 13.626 4.570 ( -0.286 -2.966 3.180) 4.358 4.726 ( 16.872 -10.966 8.871) 21.992 5.184 ( 10.829 4.164 7.676) 13.911 6.025 ( 2.686 6.749 9.428) 11.902 6.250 ( 7.555 -4.107 0.707) 8.628 6.341 ( -16.547 -1.776 7.472) 18.242 6.909 ( -4.827 29.242 0.035) 29.638 7.263 ( -6.081 35.260 -4.611) 36.076 8.149 ( -15.745 3.545 4.344) 16.714 8.998 ( -9.115 -0.353 -1.251) 9.207 9.609 ( 6.112 -4.447 8.474) 11.355 10.633 ( -8.119 -19.767 -15.329) 26.298 16.899 ( 2.059 7.953 2.660) 8.635 17.082 ( -0.886 4.932 -6.635) 8.315 17.251 ( -0.956 1.607 1.678) 2.513 17.664 ( -4.695 -3.681 -9.407) 11.140 21.287 ( 0.542 0.276 -2.046) 2.134 21.519 ( 0.898 -2.533 1.891) 3.286 27.958 ( 1.564 -6.218 0.414) 6.425 28.152 ( 1.301 -6.753 3.267) 7.614 37.207 ( 4.432 8.734 -0.947) 9.840 37.637 ( 1.428 1.322 -5.322) 5.667 37.911 ( -7.116 12.230 1.245) 14.204 39.696 ( -10.138 -17.000 11.427) 22.855 ======================= Grid point 31 (20/318) ======================= q-point: ( 0.38 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 522 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.457 ( 8.335 2.999 4.961) 10.152 2.828 ( -8.080 14.075 -4.176) 16.758 2.858 ( 8.952 4.559 1.232) 10.121 3.311 ( -7.736 7.122 -7.469) 12.898 4.230 ( 8.112 3.504 -13.417) 16.065 4.410 ( -3.544 3.637 7.648) 9.180 4.822 ( 14.658 -10.502 1.505) 18.095 5.083 ( 14.635 -14.143 5.601) 21.109 5.405 ( 5.963 0.825 9.542) 11.282 5.931 ( -19.418 -3.529 11.199) 22.692 6.291 ( 8.346 6.659 14.258) 17.813 6.422 ( 8.526 -3.362 -3.039) 9.656 6.837 ( -2.776 24.887 -3.384) 25.270 7.142 ( -4.496 34.514 -2.885) 34.925 7.875 ( -14.614 3.271 0.698) 14.991 8.848 ( -6.315 -1.024 0.265) 6.403 9.774 ( 4.801 -5.915 12.217) 14.398 10.396 ( -6.397 -14.993 -18.213) 24.442 16.946 ( 1.151 9.806 3.011) 10.322 17.031 ( -0.185 7.920 -6.786) 10.431 17.235 ( -1.491 3.214 1.596) 3.886 17.526 ( -4.428 -1.443 -7.188) 8.565 21.286 ( 0.284 0.412 -0.969) 1.090 21.542 ( 0.527 -2.778 1.383) 3.148 27.990 ( 1.452 -6.767 0.410) 6.933 28.184 ( 0.475 -6.976 2.145) 7.314 37.297 ( 5.436 9.342 0.298) 10.813 37.618 ( -1.374 4.735 -2.779) 5.660 37.798 ( -4.629 5.662 -0.589) 7.336 39.596 ( -6.176 -18.469 6.281) 20.462 ======================= Grid point 32 (21/318) ======================= q-point: ( 0.46 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 522 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.531 ( -1.828 21.130 3.011) 21.421 2.691 ( -1.066 5.901 -4.005) 7.210 2.992 ( 3.458 1.256 -0.602) 3.728 3.209 ( -1.257 0.627 -1.326) 1.932 4.254 ( 1.954 -2.213 -5.528) 6.267 4.433 ( 0.791 6.772 2.466) 7.250 5.071 ( 14.187 -2.064 -2.708) 14.590 5.273 ( 3.325 -12.535 -0.095) 12.969 5.361 ( -15.098 3.877 8.159) 17.594 5.833 ( 1.840 -17.645 6.753) 18.982 6.514 ( 2.492 3.874 4.014) 6.110 6.540 ( 8.547 -0.127 4.293) 9.566 6.743 ( -4.400 22.151 -5.908) 23.344 7.071 ( -1.719 33.161 -0.839) 33.216 7.665 ( -6.614 2.775 -0.415) 7.185 8.773 ( -2.070 -0.768 0.370) 2.238 9.921 ( 2.826 -11.464 11.332) 16.365 10.199 ( -3.559 -7.684 -13.730) 16.131 16.975 ( -0.215 7.880 3.645) 8.685 16.998 ( 0.547 12.366 -5.270) 13.454 17.224 ( -0.523 5.029 0.960) 5.147 17.433 ( -1.940 -0.546 -2.935) 3.560 21.286 ( 0.098 0.456 -0.268) 0.538 21.554 ( 0.167 -2.870 0.506) 2.919 28.012 ( 0.606 -7.047 0.183) 7.075 28.197 ( 0.062 -7.020 0.731) 7.059 37.404 ( 5.173 10.835 0.813) 12.034 37.545 ( -4.520 7.096 -1.064) 8.480 37.747 ( -0.798 0.110 -0.782) 1.123 39.544 ( -2.053 -19.175 1.994) 19.387 ======================= Grid point 39 (22/318) ======================= q-point: ( 0.00 0.30 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 265 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.394 ( 0.000 24.819 0.000) 24.819 2.171 ( 0.000 29.848 0.000) 29.848 2.719 ( 0.000 9.961 0.000) 9.961 3.302 ( 0.000 -11.228 0.000) 11.228 3.369 ( 0.000 22.981 0.000) 22.981 4.036 ( 0.000 15.277 0.000) 15.277 4.519 ( 0.000 27.490 0.000) 27.490 5.293 ( 0.000 -1.118 0.000) 1.118 5.617 ( 0.000 -0.757 0.000) 0.757 5.967 ( 0.000 9.475 0.000) 9.475 6.196 ( 0.000 -9.323 0.000) 9.323 6.561 ( 0.000 -4.314 0.000) 4.314 7.668 ( 0.000 31.843 0.000) 31.843 7.880 ( 0.000 7.834 0.000) 7.834 9.217 ( 0.000 -5.292 0.000) 5.292 9.386 ( 0.000 -0.589 0.000) 0.589 9.757 ( 0.000 2.103 0.000) 2.103 10.197 ( 0.000 -3.203 0.000) 3.203 16.783 ( 0.000 3.090 0.000) 3.090 17.104 ( 0.000 -0.466 0.000) 0.466 17.353 ( 0.000 -0.799 0.000) 0.799 17.601 ( 0.000 -10.962 0.000) 10.962 21.261 ( 0.000 1.564 0.000) 1.564 21.397 ( 0.000 -1.485 0.000) 1.485 27.831 ( 0.000 -4.269 0.000) 4.269 27.861 ( 0.000 -4.589 0.000) 4.589 37.131 ( 0.000 -2.141 0.000) 2.141 37.428 ( 0.000 -8.197 0.000) 8.197 38.773 ( 0.000 24.644 0.000) 24.644 40.073 ( 0.000 -5.459 0.000) 5.459 ======================= Grid point 40 (23/318) ======================= q-point: ( 0.08 0.30 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.463 ( 4.860 23.877 7.053) 25.367 2.050 ( -3.670 27.210 -3.899) 27.732 2.995 ( 19.246 3.315 8.574) 21.328 3.294 ( 0.868 -9.794 -7.057) 12.103 3.538 ( 15.330 24.918 8.891) 30.577 4.013 ( -3.585 14.108 5.860) 15.692 4.460 ( -4.637 25.422 -2.942) 26.008 5.188 ( -7.505 -0.951 -14.491) 16.347 5.602 ( -2.778 0.782 2.243) 3.655 5.894 ( -5.394 6.430 -1.095) 8.464 6.090 ( -5.182 -5.634 -4.921) 9.100 6.635 ( -0.389 -7.825 11.247) 13.707 7.700 ( 2.334 31.010 -0.347) 31.100 7.928 ( 3.899 10.993 4.023) 12.338 9.096 ( -15.789 -0.146 8.094) 17.743 9.380 ( -0.849 -1.499 -0.778) 1.890 9.532 ( -8.875 8.857 -13.516) 18.436 10.403 ( 9.733 -13.106 7.732) 18.063 16.789 ( 0.719 1.692 0.596) 1.933 17.065 ( -2.409 -1.380 -1.639) 3.224 17.381 ( 2.289 2.103 -0.716) 3.189 17.636 ( 4.355 -10.797 -4.034) 12.321 21.271 ( 1.340 1.210 -1.382) 2.274 21.403 ( 0.474 -1.616 0.553) 1.773 27.824 ( -0.515 -4.174 0.428) 4.228 27.881 ( 1.217 -5.052 1.719) 5.473 37.149 ( 2.130 -0.950 -1.079) 2.570 37.456 ( 3.887 -8.069 -3.142) 9.492 38.726 ( -5.471 24.253 1.503) 24.908 39.989 ( -11.155 -5.994 8.519) 15.262 ======================= Grid point 41 (24/318) ======================= q-point: ( 0.15 0.30 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.661 ( 10.142 19.054 15.106) 26.346 2.119 ( 10.796 19.886 2.758) 22.795 3.245 ( -0.893 -9.675 -9.032) 13.266 3.413 ( 21.399 -3.896 3.384) 22.012 3.866 ( 4.058 21.199 8.381) 23.154 4.114 ( 16.138 14.760 15.682) 26.911 4.351 ( -5.039 18.140 -0.631) 18.837 4.875 ( -12.158 -0.700 -22.816) 25.862 5.456 ( -15.986 6.192 5.943) 18.144 5.876 ( 6.049 -1.296 -5.390) 8.205 6.008 ( -2.554 -2.685 1.375) 3.953 6.619 ( -8.180 -10.185 11.229) 17.226 7.704 ( -1.993 28.802 -0.327) 28.872 8.034 ( 3.291 19.270 2.299) 19.684 8.796 ( -19.517 8.624 9.638) 23.414 9.326 ( -6.046 -2.236 -0.052) 6.447 9.392 ( 0.803 6.728 -7.024) 9.760 10.522 ( 0.496 -18.169 -0.145) 18.176 16.827 ( 2.918 -0.545 1.193) 3.199 17.025 ( -0.853 -2.703 -1.263) 3.103 17.414 ( 2.528 6.094 -3.002) 7.249 17.683 ( 3.698 -8.280 -6.987) 11.448 21.287 ( 1.338 0.766 -1.978) 2.508 21.420 ( 0.752 -1.990 1.023) 2.360 27.821 ( -0.164 -4.325 0.594) 4.369 27.920 ( 1.442 -5.935 2.916) 6.768 37.192 ( 3.526 1.426 -2.130) 4.359 37.523 ( 5.629 -6.600 -5.138) 10.082 38.596 ( -9.690 22.637 2.787) 24.781 39.790 ( -16.260 -8.398 12.597) 22.217 ======================= Grid point 42 (25/318) ======================= q-point: ( 0.23 0.30 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.010 ( 16.154 13.119 15.506) 25.952 2.400 ( 14.181 11.073 6.579) 19.157 3.154 ( -4.219 -6.788 -3.802) 8.851 3.821 ( 20.642 -5.028 0.325) 21.248 3.937 ( 3.409 10.894 4.162) 12.150 4.269 ( -4.163 8.604 -2.346) 9.842 4.468 ( -0.808 7.209 -3.025) 7.860 4.646 ( 7.937 5.945 3.748) 10.602 5.183 ( -12.670 5.139 4.982) 14.552 5.992 ( 6.763 -2.165 -2.471) 7.519 6.011 ( 1.906 -2.663 5.277) 6.211 6.481 ( -13.009 -10.095 9.211) 18.867 7.631 ( -5.242 29.161 -0.416) 29.631 8.021 ( -4.178 24.638 -3.448) 25.227 8.526 ( -16.541 9.526 10.686) 21.875 9.165 ( -10.669 -2.637 -0.407) 10.998 9.448 ( 6.091 4.758 1.251) 7.830 10.449 ( -4.446 -17.102 -8.404) 19.567 16.906 ( 4.557 -1.465 1.274) 4.953 17.012 ( -0.054 -3.491 -1.105) 3.662 17.441 ( 2.704 9.409 -4.291) 10.689 17.682 ( 1.231 -3.715 -8.493) 9.351 21.295 ( 0.760 0.664 -1.709) 1.984 21.441 ( 0.785 -2.512 1.313) 2.941 27.826 ( 0.300 -4.742 0.569) 4.785 27.965 ( 1.333 -6.933 3.422) 7.845 37.255 ( 4.815 3.575 -2.396) 6.458 37.593 ( 5.143 -3.639 -5.595) 8.425 38.410 ( -12.006 19.568 3.213) 23.181 39.560 ( -15.985 -12.437 12.115) 23.600 ======================= Grid point 43 (26/318) ======================= q-point: ( 0.31 0.30 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.362 ( 12.031 10.553 8.832) 18.278 2.672 ( 11.819 2.926 5.279) 13.271 3.076 ( -3.312 1.554 2.965) 4.709 3.840 ( -14.916 9.695 -6.423) 18.914 4.200 ( 19.573 -9.542 2.821) 21.957 4.263 ( 10.442 4.793 -13.890) 18.026 4.502 ( 8.809 -8.041 4.961) 12.918 4.680 ( -11.264 13.519 11.468) 21.004 5.215 ( 7.196 -1.787 8.601) 11.356 6.086 ( 2.938 0.651 5.477) 6.250 6.121 ( 0.469 -8.688 10.356) 13.526 6.278 ( -7.416 -4.710 -0.306) 8.790 7.520 ( -5.822 28.964 -1.725) 29.593 7.876 ( -8.018 22.488 -4.271) 24.254 8.285 ( -15.350 11.751 6.566) 20.417 8.949 ( -11.963 -4.765 1.105) 12.925 9.594 ( 6.368 3.934 5.689) 9.402 10.297 ( -4.223 -13.435 -13.339) 19.398 16.990 ( 1.906 -6.475 -1.687) 6.957 17.012 ( 2.449 1.934 1.163) 3.331 17.462 ( 2.255 12.013 -4.301) 12.958 17.637 ( -0.482 1.926 -7.981) 8.224 21.297 ( 0.356 0.707 -1.061) 1.324 21.463 ( 0.650 -3.025 1.321) 3.364 27.839 ( 0.790 -5.314 0.628) 5.409 28.006 ( 0.862 -7.701 3.058) 8.331 37.343 ( 5.993 5.218 -1.732) 8.133 37.645 ( 3.714 -0.642 -4.746) 6.060 38.199 ( -12.444 15.829 2.558) 20.296 39.355 ( -12.682 -16.675 9.200) 22.881 ======================= Grid point 44 (27/318) ======================= q-point: ( 0.38 0.30 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.548 ( 4.904 6.232 6.425) 10.206 2.907 ( 9.652 1.762 1.171) 9.881 3.067 ( 0.086 8.858 4.836) 10.093 3.491 ( -14.861 9.332 -9.601) 20.002 4.306 ( 1.077 5.945 -9.266) 11.062 4.543 ( 5.210 -5.344 2.544) 7.885 4.625 ( 10.117 4.667 8.074) 13.759 4.782 ( 15.045 -14.779 5.593) 21.818 5.355 ( 2.648 -6.296 7.136) 9.878 5.867 ( -21.673 -3.593 8.589) 23.588 6.297 ( 7.978 -4.206 10.723) 14.011 6.338 ( 8.380 -3.584 -3.862) 9.899 7.403 ( -5.006 27.410 -3.286) 28.056 7.702 ( -8.089 16.407 -2.387) 18.448 8.039 ( -13.027 16.622 1.406) 21.165 8.768 ( -7.992 -6.860 1.990) 10.719 9.722 ( 3.038 1.779 7.022) 7.855 10.158 ( -1.809 -8.636 -13.178) 15.859 16.976 ( -0.565 -4.160 -2.022) 4.660 17.090 ( 3.398 0.081 1.145) 3.587 17.470 ( 1.011 13.570 -3.660) 14.091 17.585 ( -0.577 8.402 -5.196) 9.896 21.297 ( 0.176 0.738 -0.480) 0.898 21.480 ( 0.423 -3.391 0.986) 3.556 27.860 ( 0.909 -5.851 0.584) 5.950 28.032 ( 0.334 -8.083 2.045) 8.345 37.456 ( 6.930 6.450 -0.719) 9.495 37.675 ( 2.099 1.548 -3.083) 4.038 37.988 ( -11.315 12.330 1.334) 16.788 39.207 ( -7.911 -20.011 5.525) 22.216 ======================= Grid point 45 (28/318) ======================= q-point: ( 0.46 0.30 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.662 ( 3.434 2.805 4.105) 6.042 2.991 ( 0.968 -0.491 -0.278) 1.121 3.105 ( -1.653 21.920 1.379) 22.026 3.260 ( -2.901 5.936 -4.289) 7.877 4.257 ( -0.800 2.985 -3.277) 4.505 4.579 ( 0.520 6.112 1.728) 6.373 4.869 ( 6.671 -15.340 2.187) 16.870 5.089 ( 15.718 -5.470 -0.286) 16.645 5.424 ( 1.449 -11.324 3.148) 11.842 5.509 ( -19.393 -2.261 5.100) 20.180 6.445 ( 3.759 -4.826 -0.024) 6.117 6.471 ( 4.309 -6.016 3.799) 8.318 7.310 ( -2.491 26.693 -2.275) 26.905 7.572 ( -4.113 10.281 -0.631) 11.091 7.863 ( -5.238 21.987 -0.339) 22.605 8.681 ( -2.555 -8.158 0.995) 8.606 9.784 ( 0.360 -0.956 3.505) 3.650 10.084 ( -0.055 -4.260 -5.891) 7.271 16.958 ( -0.309 -3.204 -0.847) 3.329 17.138 ( 1.230 -1.485 0.442) 1.978 17.461 ( 0.112 14.643 -1.681) 14.739 17.560 ( -0.069 13.180 -1.567) 13.273 21.297 ( 0.060 0.742 -0.123) 0.754 21.489 ( 0.147 -3.566 0.365) 3.587 27.876 ( 0.411 -6.175 0.249) 6.194 28.043 ( 0.052 -8.183 0.708) 8.213 37.586 ( 6.818 6.902 -0.080) 9.702 37.683 ( -0.225 4.320 -1.018) 4.444 37.809 ( -7.482 8.762 0.267) 11.524 39.131 ( -2.657 -21.814 1.820) 22.050 ======================= Grid point 52 (29/318) ======================= q-point: ( 0.00 0.40 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 318 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.883 ( 0.000 24.507 0.000) 24.507 2.669 ( 0.000 20.181 0.000) 20.181 2.715 ( 0.000 -11.616 0.000) 11.616 3.093 ( 0.000 -6.777 0.000) 6.777 3.799 ( 0.000 19.238 0.000) 19.238 4.194 ( 0.000 1.157 0.000) 1.157 4.975 ( 0.000 17.005 0.000) 17.005 5.264 ( 0.000 -1.988 0.000) 1.988 5.637 ( 0.000 3.374 0.000) 3.374 5.967 ( 0.000 -10.943 0.000) 10.943 6.182 ( 0.000 9.502 0.000) 9.502 6.472 ( 0.000 -4.931 0.000) 4.931 8.041 ( 0.000 8.113 0.000) 8.113 8.123 ( 0.000 12.052 0.000) 12.052 9.186 ( 0.000 2.814 0.000) 2.814 9.360 ( 0.000 -2.359 0.000) 2.359 9.834 ( 0.000 5.795 0.000) 5.795 10.111 ( 0.000 -5.613 0.000) 5.613 16.866 ( 0.000 5.288 0.000) 5.288 17.076 ( 0.000 -2.808 0.000) 2.808 17.334 ( 0.000 -0.985 0.000) 0.985 17.411 ( 0.000 -7.379 0.000) 7.379 21.294 ( 0.000 1.777 0.000) 1.777 21.365 ( 0.000 -1.724 0.000) 1.724 27.764 ( 0.000 -2.310 0.000) 2.310 27.782 ( 0.000 -3.106 0.000) 3.106 37.117 ( 0.000 0.861 0.000) 0.861 37.276 ( 0.000 -6.858 0.000) 6.858 39.242 ( 0.000 22.262 0.000) 22.262 39.912 ( 0.000 -10.983 0.000) 10.983 ======================= Grid point 53 (30/318) ======================= q-point: ( 0.08 0.40 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 522 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.937 ( 4.239 23.929 3.323) 24.528 2.516 ( -4.978 17.517 -6.059) 19.192 2.874 ( 7.939 -13.160 3.495) 15.762 3.116 ( 3.543 -6.684 -3.210) 8.218 3.964 ( 13.274 17.057 10.043) 23.833 4.194 ( -1.091 4.500 4.993) 6.809 4.885 ( -6.391 15.994 -9.467) 19.654 5.166 ( -6.699 -1.710 -14.534) 16.094 5.636 ( -0.554 3.376 2.292) 4.117 5.913 ( -4.366 -7.349 2.264) 8.843 6.093 ( -8.412 8.265 -0.194) 11.795 6.457 ( -6.502 -9.410 11.715) 16.372 8.086 ( 2.778 10.199 1.786) 10.720 8.192 ( 6.360 10.877 1.883) 12.740 9.130 ( -8.497 4.839 7.599) 12.384 9.339 ( -2.988 -2.909 1.828) 4.553 9.730 ( -5.160 11.071 -8.316) 14.777 10.178 ( 3.934 -10.585 0.949) 11.333 16.838 ( -1.783 3.594 -1.163) 4.178 17.026 ( -3.055 -3.311 -2.418) 5.113 17.402 ( 5.604 0.206 -0.632) 5.643 17.464 ( 6.124 -5.819 -2.750) 8.884 21.299 ( 0.651 1.633 -0.502) 1.828 21.369 ( 0.342 -1.795 0.263) 1.846 27.760 ( -0.435 -2.088 0.618) 2.221 27.793 ( 0.519 -3.575 1.361) 3.861 37.147 ( 3.266 1.079 -0.738) 3.518 37.306 ( 3.899 -6.792 -2.192) 8.132 39.183 ( -6.981 21.553 2.241) 22.766 39.829 ( -10.081 -10.631 4.334) 15.278 ======================= Grid point 54 (31/318) ======================= q-point: ( 0.15 0.40 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 522 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.056 ( 5.169 20.643 8.250) 22.823 2.493 ( 4.574 15.646 -0.365) 16.305 2.972 ( 2.321 -14.407 -3.245) 14.949 3.255 ( 12.733 -11.637 2.211) 17.390 4.200 ( 1.195 13.592 5.336) 14.650 4.366 ( 17.095 8.613 14.905) 24.261 4.660 ( -9.276 11.402 -12.234) 19.124 4.862 ( -12.600 -1.219 -22.687) 25.980 5.600 ( -10.464 8.357 9.543) 16.444 5.866 ( -2.258 -1.008 4.755) 5.360 5.971 ( -1.384 0.658 -0.890) 1.772 6.359 ( -11.321 -14.707 12.611) 22.439 8.121 ( -0.318 14.184 0.938) 14.218 8.322 ( 4.364 7.167 1.442) 8.514 8.970 ( -14.262 9.772 11.350) 20.681 9.258 ( -8.012 -4.240 3.822) 9.838 9.625 ( 0.320 15.135 -8.447) 17.336 10.215 ( 0.713 -13.822 -3.502) 14.277 16.818 ( 0.776 0.843 -1.137) 1.615 16.970 ( -1.216 -4.059 -2.368) 4.854 17.499 ( 6.120 2.654 -3.694) 7.626 17.572 ( 7.117 -2.924 -4.743) 9.039 21.309 ( 0.697 1.415 -0.731) 1.738 21.380 ( 0.477 -2.032 0.519) 2.151 27.757 ( -0.383 -1.871 1.001) 2.156 27.814 ( 0.540 -4.462 2.355) 5.074 37.220 ( 5.243 1.958 -1.751) 5.864 37.390 ( 6.654 -6.473 -3.453) 9.904 39.018 ( -12.507 19.680 3.767) 23.620 39.611 ( -16.472 -10.419 7.203) 20.779 ======================= Grid point 55 (32/318) ======================= q-point: ( 0.23 0.40 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 522 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.265 ( 10.598 12.747 13.923) 21.648 2.600 ( 4.055 5.382 2.751) 7.279 3.024 ( 5.703 -1.626 1.311) 6.073 3.550 ( 15.346 -17.347 4.168) 23.533 4.229 ( -0.167 14.722 -2.401) 14.918 4.396 ( -11.508 3.874 -9.653) 15.512 4.534 ( -5.177 2.429 -13.926) 15.054 4.790 ( 16.413 1.335 10.870) 19.731 5.357 ( -19.689 14.404 11.852) 27.121 5.907 ( 0.792 -5.157 5.730) 7.750 6.001 ( 2.667 0.089 3.572) 4.458 6.222 ( -8.336 -14.451 6.731) 17.990 8.079 ( -4.408 16.037 -0.170) 16.633 8.313 ( -5.765 5.208 -1.153) 7.854 8.763 ( -14.109 12.721 9.439) 21.213 9.081 ( -13.127 -5.173 3.395) 14.512 9.651 ( 5.383 14.149 -2.919) 15.417 10.173 ( -1.170 -11.765 -7.694) 14.106 16.852 ( 3.037 -1.465 -0.853) 3.478 16.955 ( 0.892 -4.009 -1.638) 4.422 17.583 ( 6.013 5.133 -5.721) 9.759 17.659 ( 5.730 0.455 -6.057) 8.350 21.315 ( 0.387 1.345 -0.598) 1.522 21.392 ( 0.428 -2.426 0.726) 2.569 27.758 ( -0.172 -1.776 1.147) 2.121 27.839 ( 0.496 -5.455 2.812) 6.157 37.317 ( 6.489 3.250 -2.334) 7.624 37.500 ( 7.248 -5.421 -3.804) 9.818 38.778 ( -15.557 17.241 4.193) 23.597 39.329 ( -18.174 -11.522 7.945) 22.939 ======================= Grid point 56 (33/318) ======================= q-point: ( 0.31 0.40 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 522 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.557 ( 9.022 8.154 11.604) 16.809 2.703 ( 7.141 0.024 7.063) 10.044 3.153 ( 4.123 7.900 4.552) 10.006 3.759 ( -1.431 -16.592 1.660) 16.736 4.123 ( 2.686 3.649 -8.122) 9.300 4.295 ( 7.443 -4.326 -6.614) 10.856 4.508 ( 2.301 11.161 -1.262) 11.465 5.069 ( -7.176 21.063 12.560) 25.552 5.089 ( -1.253 -9.312 6.449) 11.396 5.880 ( -9.848 -15.240 13.451) 22.587 6.102 ( 4.936 0.644 3.659) 6.178 6.182 ( 3.346 -4.170 -2.296) 5.818 7.963 ( -7.300 15.253 -1.474) 16.974 8.122 ( -13.016 5.495 -0.547) 14.139 8.568 ( -11.161 12.754 3.426) 17.291 8.838 ( -13.934 -5.523 2.439) 15.186 9.751 ( 4.997 10.572 1.161) 11.751 10.100 ( -0.936 -7.429 -9.202) 11.864 16.898 ( 2.209 -2.230 -1.341) 3.414 16.981 ( 2.508 -3.986 -0.622) 4.750 17.652 ( 5.114 7.280 -6.189) 10.838 17.719 ( 4.628 4.215 -5.538) 8.358 21.317 ( 0.143 1.383 -0.286) 1.419 21.404 ( 0.328 -2.880 0.792) 3.004 27.765 ( 0.188 -1.852 1.181) 2.205 27.864 ( 0.354 -6.248 2.599) 6.777 37.432 ( 7.294 4.279 -2.080) 8.709 37.604 ( 6.198 -3.410 -3.442) 7.867 38.506 ( -15.844 14.929 3.570) 22.060 39.052 ( -15.984 -14.092 6.831) 22.377 ======================= Grid point 57 (34/318) ======================= q-point: ( 0.38 0.40 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 522 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.694 ( 2.152 8.048 7.076) 10.930 2.911 ( 6.278 -1.629 3.595) 7.415 3.237 ( 3.999 9.432 5.194) 11.486 3.588 ( -8.369 -1.146 -3.016) 8.969 4.317 ( 12.171 -8.128 1.061) 14.674 4.481 ( 10.867 -8.437 0.970) 13.792 4.506 ( -0.945 8.814 -0.923) 8.912 4.922 ( -4.510 11.881 6.075) 14.085 5.191 ( 0.751 -5.560 4.488) 7.185 5.729 ( -13.286 -11.748 9.478) 20.108 6.216 ( 5.825 -1.728 2.742) 6.666 6.283 ( 6.709 -2.773 -1.139) 7.349 7.805 ( -7.865 11.949 -2.596) 14.539 7.869 ( -13.038 5.176 0.029) 14.028 8.391 ( -8.451 13.873 -0.261) 16.247 8.631 ( -9.060 -5.430 1.745) 10.706 9.827 ( 1.945 7.364 2.049) 7.887 10.042 ( 0.230 -3.938 -7.316) 8.312 16.916 ( 0.815 -1.147 -1.386) 1.976 17.026 ( 2.142 -4.971 -0.273) 5.420 17.699 ( 3.524 9.508 -4.706) 11.179 17.767 ( 3.429 7.116 -3.621) 8.690 21.318 ( 0.051 1.431 -0.047) 1.432 21.413 ( 0.221 -3.256 0.629) 3.323 27.778 ( 0.395 -2.078 0.957) 2.322 27.882 ( 0.170 -6.650 1.811) 6.894 37.561 ( 7.604 4.545 -1.368) 8.964 37.684 ( 4.198 -0.822 -2.416) 4.913 38.247 ( -13.626 13.495 2.335) 19.319 38.833 ( -10.931 -17.432 4.528) 21.068 ======================= Grid point 58 (35/318) ======================= q-point: ( 0.46 0.40 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 522 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.741 ( 0.204 5.135 2.290) 5.626 2.945 ( -0.963 -3.764 -0.199) 3.890 3.355 ( 3.550 8.905 2.734) 9.969 3.510 ( -0.171 10.869 -0.017) 10.870 4.370 ( -3.128 7.091 -0.665) 7.778 4.537 ( 4.747 -5.054 -1.160) 7.030 4.670 ( 3.557 -7.470 5.331) 9.843 4.964 ( 4.485 -12.444 0.319) 13.231 5.209 ( 0.443 2.537 0.751) 2.683 5.537 ( -9.398 -1.831 3.512) 10.199 6.334 ( 3.987 -4.811 3.091) 6.971 6.368 ( 2.535 -4.393 -1.863) 5.403 7.669 ( -4.785 4.993 -1.036) 6.993 7.686 ( -5.055 8.508 -0.592) 9.915 8.276 ( -3.194 15.582 -0.418) 15.912 8.529 ( -2.902 -5.258 0.634) 6.039 9.851 ( 0.157 5.923 0.730) 5.970 10.021 ( 0.440 -2.510 -2.588) 3.633 16.919 ( 0.186 -0.239 -0.574) 0.649 17.051 ( 0.698 -5.572 -0.144) 5.618 17.726 ( 1.334 11.051 -1.704) 11.261 17.797 ( 1.272 8.547 -1.251) 8.732 21.318 ( 0.016 1.454 0.014) 1.454 21.418 ( 0.081 -3.462 0.241) 3.471 27.788 ( 0.205 -2.282 0.377) 2.322 27.891 ( 0.040 -6.751 0.646) 6.782 37.685 ( 5.467 3.445 -0.623) 6.492 37.727 ( 1.262 1.161 -0.842) 1.910 38.051 ( -7.378 13.990 0.923) 15.843 38.712 ( -3.908 -20.039 1.584) 20.478 ======================= Grid point 65 (36/318) ======================= q-point: ( 0.00 -0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 159 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.351 ( 0.000 -22.376 0.000) 22.376 2.351 ( 0.000 22.376 0.000) 22.376 2.960 ( 0.000 -9.545 0.000) 9.545 2.960 ( 0.000 9.545 0.000) 9.545 4.098 ( 0.000 -10.451 0.000) 10.451 4.098 ( 0.000 10.451 0.000) 10.451 5.193 ( 0.000 -6.146 0.000) 6.146 5.193 ( 0.000 6.147 0.000) 6.147 5.761 ( 0.000 -8.952 0.000) 8.952 5.761 ( 0.000 8.952 0.000) 8.952 6.354 ( 0.000 -7.348 0.000) 7.348 6.354 ( 0.000 7.348 0.000) 7.348 8.174 ( 0.000 -4.179 0.000) 4.179 8.174 ( 0.000 4.179 0.000) 4.179 9.285 ( 0.000 -5.249 0.000) 5.249 9.285 ( 0.000 5.249 0.000) 5.249 9.975 ( 0.000 -7.774 0.000) 7.774 9.975 ( 0.000 7.774 0.000) 7.774 16.984 ( 0.000 -6.074 0.000) 6.074 16.984 ( 0.000 6.074 0.000) 6.074 17.330 ( 0.000 -1.188 0.000) 1.188 17.330 ( 0.000 1.188 0.000) 1.188 21.330 ( 0.000 -1.823 0.000) 1.823 21.330 ( 0.000 1.823 0.000) 1.823 27.746 ( 0.000 -0.493 0.000) 0.493 27.746 ( 0.000 0.493 0.000) 0.493 37.166 ( 0.000 -4.102 0.000) 4.102 37.166 ( 0.000 4.102 0.000) 4.102 39.635 ( 0.000 -17.136 0.000) 17.136 39.635 ( 0.000 17.136 0.000) 17.136 ======================= Grid point 67 (37/318) ======================= q-point: ( 0.08 -0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 312 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.394 ( 3.743 -21.447 0.455) 21.776 2.394 ( 3.743 21.447 0.455) 21.776 2.935 ( -0.471 -12.176 -2.787) 12.499 2.935 ( -0.471 12.176 -2.787) 12.499 4.189 ( 6.865 -5.502 6.991) 11.237 4.189 ( 6.865 5.502 6.991) 11.237 5.095 ( -6.656 -6.221 -13.193) 16.033 5.095 ( -6.656 6.221 -13.193) 16.033 5.749 ( -0.958 -7.810 2.362) 8.216 5.749 ( -0.958 7.810 2.362) 8.216 6.274 ( -10.520 -9.249 7.637) 15.954 6.274 ( -10.520 9.249 7.637) 15.954 8.235 ( 4.649 -4.405 2.197) 6.770 8.235 ( 4.649 4.405 2.197) 6.770 9.253 ( -4.986 -5.956 4.593) 9.024 9.253 ( -4.986 5.956 4.593) 9.024 9.960 ( -0.259 -11.666 -3.691) 12.238 9.960 ( -0.259 11.666 -3.691) 12.238 16.932 ( -3.290 -5.491 -2.421) 6.844 16.932 ( -3.290 5.491 -2.421) 6.844 17.406 ( 7.121 -0.848 -1.279) 7.284 17.406 ( 7.121 0.848 -1.279) 7.284 21.334 ( 0.371 -1.803 -0.050) 1.841 21.334 ( 0.371 1.803 -0.050) 1.841 27.748 ( -0.083 -0.869 0.959) 1.297 27.748 ( -0.083 0.869 0.959) 1.297 37.198 ( 3.681 -4.070 -1.313) 5.643 37.198 ( 3.681 4.070 -1.313) 5.643 39.562 ( -8.626 -16.472 2.904) 18.819 39.562 ( -8.626 16.472 2.904) 18.819 ======================= Grid point 69 (38/318) ======================= q-point: ( 0.15 -0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 312 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.452 ( 1.495 -17.830 1.402) 17.948 2.452 ( 1.495 17.830 1.402) 17.948 2.985 ( 7.751 -13.916 0.883) 15.954 2.985 ( 7.751 13.916 0.883) 15.954 4.397 ( 9.423 -5.280 8.073) 13.485 4.397 ( 9.423 5.280 8.073) 13.485 4.810 ( -12.202 -4.500 -18.808) 22.866 4.810 ( -12.202 4.500 -18.808) 22.866 5.770 ( -1.424 -7.929 8.652) 11.822 5.770 ( -1.424 7.929 8.652) 11.822 6.093 ( -11.944 -10.853 7.416) 17.761 6.093 ( -11.944 10.853 7.416) 17.761 8.317 ( 1.643 -5.938 1.883) 6.443 8.317 ( 1.643 5.938 1.883) 6.443 9.148 ( -10.207 -7.300 7.114) 14.425 9.148 ( -10.207 7.300 7.114) 14.425 9.935 ( 1.032 -15.175 -5.868) 16.303 9.935 ( 1.032 15.175 -5.868) 16.303 16.875 ( -0.820 -4.576 -2.557) 5.305 16.875 ( -0.820 4.576 -2.557) 5.305 17.536 ( 8.061 -1.500 -3.775) 9.027 17.536 ( 8.061 1.500 -3.775) 9.027 21.341 ( 0.424 -1.825 -0.010) 1.873 21.341 ( 0.424 1.825 -0.010) 1.873 27.753 ( -0.142 -1.503 1.652) 2.238 27.753 ( -0.142 1.503 1.652) 2.238 37.281 ( 6.297 -4.321 -2.305) 7.977 37.281 ( 6.297 4.321 -2.305) 7.977 39.362 ( -14.983 -14.998 4.922) 21.764 39.362 ( -14.983 14.998 4.922) 21.764 ======================= Grid point 71 (39/318) ======================= q-point: ( 0.23 -0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 312 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.508 ( 3.244 -11.129 7.185) 13.639 2.508 ( 3.244 11.129 7.185) 13.639 3.205 ( 12.493 -16.243 3.904) 20.861 3.205 ( 12.493 16.243 3.904) 20.861 4.411 ( -10.506 -2.997 -15.065) 18.609 4.411 ( -10.506 2.997 -15.065) 18.609 4.667 ( 7.176 -10.352 4.149) 13.262 4.667 ( 7.176 10.352 4.149) 13.262 5.700 ( -14.425 -16.869 15.623) 27.142 5.700 ( -14.425 16.869 15.623) 27.142 6.027 ( 2.788 -3.853 0.927) 4.846 6.027 ( 2.788 3.853 0.927) 4.846 8.293 ( -5.139 -6.131 0.565) 8.020 8.293 ( -5.139 6.131 0.565) 8.020 8.962 ( -13.538 -7.414 5.541) 16.399 8.962 ( -13.538 7.414 5.541) 16.399 9.935 ( 2.395 -13.327 -5.343) 14.557 9.935 ( 2.395 13.327 -5.343) 14.557 16.873 ( 1.775 -3.324 -1.867) 4.206 16.873 ( 1.775 3.324 -1.867) 4.206 17.652 ( 7.405 -1.801 -5.594) 9.454 17.652 ( 7.405 1.801 -5.594) 9.454 21.348 ( 0.256 -1.979 0.139) 2.000 21.348 ( 0.256 1.979 0.139) 2.000 27.762 ( -0.096 -2.158 1.982) 2.932 27.762 ( -0.096 2.158 1.982) 2.932 37.396 ( 7.500 -4.770 -2.724) 9.296 37.396 ( 7.500 4.770 -2.724) 9.296 39.084 ( -17.880 -13.739 5.573) 23.227 39.084 ( -17.880 13.739 5.573) 23.227 ======================= Grid point 73 (40/318) ======================= q-point: ( 0.31 -0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 312 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.669 ( 7.432 -3.489 10.959) 13.694 2.669 ( 7.432 3.489 10.959) 13.694 3.407 ( 4.686 -16.835 3.558) 17.833 3.407 ( 4.686 16.835 3.558) 17.833 4.203 ( -0.355 -4.291 -9.379) 10.320 4.203 ( -0.355 4.291 -9.379) 10.320 4.802 ( 3.098 -16.348 2.949) 16.899 4.802 ( 3.098 16.348 2.949) 16.899 5.517 ( -12.732 -21.193 13.326) 28.086 5.517 ( -12.732 21.193 13.326) 28.086 6.125 ( 5.886 -1.840 0.475) 6.185 6.125 ( 5.886 1.840 0.475) 6.185 8.142 ( -10.847 -3.625 -0.151) 11.437 8.142 ( -10.847 3.625 -0.151) 11.437 8.738 ( -12.316 -5.492 2.087) 13.646 8.738 ( -12.316 5.492 2.087) 13.646 9.951 ( 1.999 -8.721 -3.766) 9.707 9.951 ( 1.999 8.721 -3.766) 9.707 16.906 ( 2.437 -2.707 -1.300) 3.868 16.906 ( 2.437 2.707 -1.300) 3.868 17.746 ( 6.372 -1.848 -5.722) 8.761 17.746 ( 6.372 1.848 -5.722) 8.761 21.353 ( 0.110 -2.221 0.294) 2.243 21.353 ( 0.110 2.221 0.294) 2.243 27.773 ( 0.045 -2.636 1.920) 3.262 27.773 ( 0.045 2.636 1.920) 3.262 37.521 ( 7.555 -4.645 -2.518) 9.220 37.521 ( 7.555 4.645 -2.518) 9.220 38.785 ( -17.257 -13.443 4.924) 22.422 38.785 ( -17.257 13.443 4.924) 22.422 ======================= Grid point 75 (41/318) ======================= q-point: ( 0.38 -0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 312 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.837 ( 2.967 -5.827 6.047) 8.907 2.837 ( 2.967 5.827 6.047) 8.907 3.447 ( 1.391 -10.946 2.930) 11.417 3.447 ( 1.391 10.946 2.930) 11.417 4.296 ( 9.739 -5.532 1.798) 11.344 4.296 ( 9.739 5.532 1.798) 11.344 4.793 ( -4.251 -15.131 -1.033) 15.750 4.793 ( -4.251 15.131 -1.033) 15.750 5.417 ( -5.275 -18.328 8.793) 21.002 5.417 ( -5.275 18.328 8.793) 21.002 6.230 ( 5.125 -2.297 -0.096) 5.617 6.230 ( 5.125 2.297 -0.096) 5.617 7.917 ( -12.061 -1.468 -0.743) 12.173 7.917 ( -12.061 1.468 -0.743) 12.173 8.555 ( -7.742 -4.054 0.168) 8.741 8.555 ( -7.742 4.054 0.168) 8.741 9.960 ( 0.884 -5.324 -2.288) 5.861 9.960 ( 0.884 5.324 -2.288) 5.861 16.938 ( 1.639 -3.195 -0.919) 3.707 16.938 ( 1.639 3.195 -0.919) 3.707 17.819 ( 4.595 -2.008 -4.123) 6.492 17.819 ( 4.595 2.008 -4.123) 6.492 21.356 ( 0.051 -2.447 0.308) 2.466 21.356 ( 0.051 2.447 0.308) 2.466 27.785 ( 0.139 -2.811 1.421) 3.153 27.785 ( 0.139 2.811 1.421) 3.153 37.641 ( 6.587 -3.390 -1.848) 7.635 37.641 ( 6.587 3.390 -1.848) 7.635 38.521 ( -13.432 -14.467 3.405) 20.033 38.521 ( -13.432 14.467 3.405) 20.033 ======================= Grid point 77 (42/318) ======================= q-point: ( 0.46 -0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 312 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.850 ( -1.441 -5.529 0.732) 5.761 2.850 ( -1.441 5.529 0.732) 5.761 3.531 ( 3.541 -7.043 2.199) 8.184 3.531 ( 3.541 7.043 2.199) 8.184 4.485 ( 6.455 -8.409 6.584) 12.479 4.485 ( 6.455 8.409 6.584) 12.479 4.673 ( -5.300 -13.944 -5.163) 15.786 4.673 ( -5.300 13.944 -5.163) 15.786 5.399 ( -1.097 -11.075 3.035) 11.536 5.399 ( -1.097 11.075 3.035) 11.536 6.303 ( 2.401 -1.559 -0.163) 2.867 6.303 ( 2.401 1.559 -0.163) 2.867 7.736 ( -5.641 -2.134 -0.555) 6.057 7.736 ( -5.641 2.134 -0.555) 6.057 8.459 ( -2.560 -4.181 -0.086) 4.903 8.459 ( -2.560 4.181 -0.086) 4.903 9.960 ( 0.188 -4.299 -0.787) 4.374 9.960 ( 0.188 4.299 -0.787) 4.374 16.954 ( 0.524 -3.688 -0.362) 3.743 16.954 ( 0.524 3.688 -0.362) 3.743 17.862 ( 1.710 -2.102 -1.478) 3.087 17.862 ( 1.710 2.102 -1.478) 3.087 21.358 ( 0.019 -2.577 0.132) 2.580 21.358 ( 0.019 2.577 0.132) 2.580 27.793 ( 0.075 -2.798 0.528) 2.848 27.793 ( 0.075 2.798 0.528) 2.848 37.729 ( 3.186 -1.070 -0.758) 3.446 37.729 ( 3.186 1.070 -0.758) 3.446 38.350 ( -5.650 -16.523 1.291) 17.510 38.350 ( -5.650 16.523 1.291) 17.510 ======================= Grid point 143 (43/318) ======================= q-point: ( 0.00 0.00 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 312 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.454 ( 8.890 0.000 21.076) 22.874 0.496 ( 7.239 0.000 23.008) 24.120 1.216 ( 19.662 0.000 56.220) 59.559 2.273 ( -3.390 0.000 -11.603) 12.088 2.803 ( -3.185 0.000 -1.195) 3.402 2.857 ( 13.281 0.000 15.765) 20.614 4.089 ( 2.892 0.000 0.128) 2.894 5.094 ( -6.245 0.000 -15.448) 16.663 5.696 ( -9.064 0.000 1.025) 9.122 5.895 ( 2.702 0.000 8.734) 9.142 6.082 ( 0.422 0.000 -0.371) 0.561 6.219 ( -32.266 0.000 7.123) 33.043 6.896 ( -3.801 0.000 8.356) 9.179 7.645 ( 3.070 0.000 3.865) 4.936 9.002 ( -20.138 0.000 -7.811) 21.600 9.397 ( -31.690 0.000 -0.654) 31.696 9.445 ( 0.224 0.000 -6.200) 6.204 11.409 ( 81.825 0.000 -3.890) 81.917 16.639 ( 1.518 0.000 1.964) 2.483 17.090 ( -1.255 0.000 -1.525) 1.975 17.338 ( 1.679 0.000 -1.686) 2.379 17.995 ( 3.034 0.000 -4.899) 5.762 21.436 ( -1.603 0.000 -0.790) 1.787 21.626 ( -38.460 0.000 0.836) 38.469 28.053 ( 3.396 0.000 0.080) 3.397 28.124 ( -6.979 0.000 1.246) 7.090 36.703 ( -0.039 0.000 1.487) 1.488 37.641 ( -0.022 0.000 -2.072) 2.072 37.782 ( -0.136 0.000 2.798) 2.802 39.184 ( 161.442 0.000 -1.299) 161.447 ======================= Grid point 144 (44/318) ======================= q-point: ( 0.08 0.00 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 312 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.936 ( 17.083 0.000 21.543) 27.494 0.960 ( 27.639 0.000 13.711) 30.853 2.070 ( 38.313 0.000 42.458) 57.189 2.255 ( 7.640 0.000 -8.643) 11.536 2.922 ( 16.249 0.000 -1.361) 16.306 3.273 ( 18.145 0.000 19.516) 26.647 4.172 ( 6.324 0.000 1.196) 6.436 4.828 ( -10.285 0.000 -20.350) 22.802 5.624 ( 3.655 0.000 -0.862) 3.755 5.807 ( -26.357 0.000 18.088) 31.967 5.962 ( -3.252 0.000 6.130) 6.939 6.061 ( 0.108 0.000 1.670) 1.673 6.870 ( -4.400 0.000 8.373) 9.458 7.623 ( -8.840 0.000 6.639) 11.055 8.697 ( -9.983 0.000 8.916) 13.385 9.285 ( 6.589 0.000 -9.853) 11.853 9.369 ( -3.915 0.000 -7.097) 8.105 11.888 ( -0.194 0.000 -19.725) 19.726 16.684 ( 1.498 0.000 3.415) 3.729 17.028 ( -3.953 0.000 -2.855) 4.876 17.390 ( 4.128 0.000 -1.376) 4.351 18.028 ( 2.129 0.000 -11.260) 11.459 21.242 ( -6.235 0.000 4.585) 7.740 21.494 ( 1.418 0.000 2.515) 2.887 28.053 ( -1.978 0.000 1.592) 2.539 28.132 ( 4.259 0.000 1.978) 4.696 36.728 ( 1.663 0.000 1.850) 2.488 37.622 ( -0.563 0.000 -2.550) 2.611 37.741 ( -3.555 0.000 1.103) 3.722 40.633 ( 26.370 0.000 -29.369) 39.471 ======================= Grid point 145 (45/318) ======================= q-point: ( 0.15 0.00 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 312 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.359 ( 16.180 0.000 20.226) 25.901 1.548 ( 27.708 0.000 9.265) 29.216 2.429 ( 14.876 0.000 -6.183) 16.110 2.972 ( 35.557 0.000 9.818) 36.888 3.399 ( 33.161 0.000 16.775) 37.162 3.615 ( 1.726 0.000 12.444) 12.563 4.353 ( 12.358 0.000 1.506) 12.449 4.562 ( -0.663 0.000 -18.114) 18.126 5.398 ( -26.749 0.000 12.607) 29.571 5.766 ( 11.460 0.000 -2.055) 11.643 5.853 ( -8.436 0.000 3.049) 8.970 6.125 ( 3.129 0.000 2.802) 4.200 6.825 ( -6.369 0.000 9.945) 11.810 7.414 ( -17.709 0.000 7.358) 19.177 8.589 ( -8.767 0.000 5.360) 10.276 9.229 ( -6.318 0.000 -7.035) 9.455 9.419 ( 11.911 0.000 -4.287) 12.659 11.592 ( -15.421 0.000 -18.665) 24.212 16.730 ( 0.931 0.000 4.087) 4.192 16.916 ( -5.843 0.000 -3.727) 6.931 17.442 ( 2.012 0.000 -2.431) 3.155 17.946 ( -3.633 0.000 -9.123) 9.820 21.219 ( 0.356 0.000 0.562) 0.665 21.545 ( 2.014 0.000 3.168) 3.755 28.049 ( 0.448 0.000 0.875) 0.983 28.226 ( 4.046 0.000 2.769) 4.903 36.786 ( 3.265 0.000 2.261) 3.971 37.589 ( -1.214 0.000 -2.950) 3.190 37.683 ( -2.220 0.000 -1.798) 2.857 40.614 ( -6.904 0.000 -10.321) 12.418 ======================= Grid point 146 (46/318) ======================= q-point: ( 0.23 0.00 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 312 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.784 ( 18.353 0.000 14.719) 23.527 2.075 ( 23.753 0.000 6.540) 24.637 2.697 ( 16.363 0.000 -4.019) 16.850 3.340 ( -26.967 0.000 -10.666) 29.000 3.462 ( 20.977 0.000 -8.719) 22.717 4.267 ( 41.407 0.000 21.992) 46.885 4.626 ( 14.128 0.000 0.339) 14.132 4.694 ( 15.661 0.000 -2.024) 15.792 5.025 ( -17.106 0.000 8.452) 19.080 5.740 ( -5.124 0.000 3.700) 6.320 6.003 ( 14.409 0.000 0.017) 14.409 6.180 ( 1.790 0.000 -0.618) 1.894 6.763 ( -7.057 0.000 12.682) 14.513 7.070 ( -23.930 0.000 8.472) 25.385 8.401 ( -13.768 0.000 1.966) 13.907 9.063 ( -7.127 0.000 -6.332) 9.534 9.656 ( 13.302 0.000 3.625) 13.787 11.169 ( -16.549 0.000 -21.141) 26.847 16.764 ( -0.037 0.000 4.053) 4.053 16.777 ( -6.364 0.000 -4.031) 7.533 17.426 ( -1.381 0.000 -4.597) 4.800 17.809 ( -6.157 0.000 -5.043) 7.958 21.236 ( 1.081 0.000 -0.075) 1.084 21.599 ( 1.385 0.000 3.585) 3.844 28.075 ( 1.810 0.000 0.458) 1.867 28.306 ( 2.696 0.000 2.614) 3.755 36.874 ( 4.556 0.000 2.693) 5.293 37.541 ( -1.996 0.000 -3.258) 3.821 37.646 ( 0.240 0.000 -3.813) 3.820 40.391 ( -10.786 0.000 -5.580) 12.144 ======================= Grid point 147 (47/318) ======================= q-point: ( 0.31 0.00 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 312 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.195 ( 17.994 0.000 8.342) 19.834 2.498 ( 18.150 0.000 4.692) 18.747 2.682 ( -31.932 0.000 -16.476) 35.932 2.955 ( 12.921 0.000 -2.977) 13.260 3.706 ( 13.011 0.000 -12.489) 18.035 4.617 ( -9.884 0.000 2.953) 10.316 4.923 ( 7.571 0.000 0.301) 7.577 5.042 ( 25.324 0.000 2.013) 25.404 5.144 ( 24.400 0.000 9.438) 26.162 5.731 ( 1.459 0.000 4.785) 5.003 6.181 ( -0.296 0.000 -3.055) 3.069 6.276 ( 13.100 0.000 1.864) 13.232 6.663 ( -24.324 0.000 10.681) 26.566 6.732 ( -4.250 0.000 12.477) 13.181 8.120 ( -16.583 0.000 0.326) 16.587 8.897 ( -6.746 0.000 -5.393) 8.637 9.937 ( 12.440 0.000 9.431) 15.611 10.754 ( -13.937 0.000 -22.017) 26.057 16.641 ( -5.539 0.000 -3.276) 6.436 16.778 ( -0.784 0.000 3.096) 3.194 17.352 ( -2.868 0.000 -5.214) 5.951 17.672 ( -6.571 0.000 -0.631) 6.601 21.256 ( 0.913 0.000 0.389) 0.993 21.634 ( 0.194 0.000 3.213) 3.219 28.116 ( 2.256 0.000 0.174) 2.262 28.352 ( 0.912 0.000 1.665) 1.898 36.983 ( 5.247 0.000 3.075) 6.082 37.477 ( -2.757 0.000 -3.449) 4.416 37.649 ( 2.629 0.000 -4.121) 4.888 40.174 ( -8.740 0.000 -5.648) 10.406 ======================= Grid point 148 (48/318) ======================= q-point: ( 0.38 0.00 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 312 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.066 ( -22.331 0.000 -10.281) 24.584 2.524 ( 13.279 0.000 2.691) 13.549 2.807 ( 12.269 0.000 3.589) 12.783 3.123 ( 6.553 0.000 -1.825) 6.802 3.844 ( 12.364 0.000 -15.252) 19.634 4.479 ( -6.023 0.000 1.868) 6.306 4.985 ( 0.051 0.000 1.332) 1.333 5.376 ( 15.281 0.000 -5.371) 16.198 5.557 ( 6.386 0.000 3.564) 7.314 5.811 ( 2.859 0.000 3.740) 4.708 6.151 ( -0.502 0.000 -2.613) 2.661 6.296 ( -8.734 0.000 4.766) 9.950 6.568 ( 6.919 0.000 7.105) 9.918 6.736 ( -2.124 0.000 6.490) 6.829 7.828 ( -14.217 0.000 0.925) 14.247 8.759 ( -4.709 0.000 -4.219) 6.322 10.183 ( 5.933 0.000 -0.504) 5.954 10.439 ( -5.256 0.000 -7.111) 8.843 16.543 ( -3.206 0.000 -1.997) 3.777 16.772 ( -1.327 0.000 1.892) 2.311 17.281 ( -1.595 0.000 -2.957) 3.359 17.572 ( -4.680 0.000 3.260) 5.704 21.274 ( 0.591 0.000 1.005) 1.166 21.643 ( -0.871 0.000 2.106) 2.279 28.155 ( 1.789 0.000 -0.124) 1.793 28.361 ( -0.467 0.000 0.301) 0.555 37.097 ( 4.682 0.000 3.261) 5.706 37.403 ( -2.840 0.000 -3.428) 4.452 37.689 ( 3.695 0.000 -2.815) 4.645 40.004 ( -5.459 0.000 -7.315) 9.127 ======================= Grid point 149 (49/318) ======================= q-point: ( 0.46 0.00 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 312 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.854 ( 2.028 0.000 7.224) 7.504 2.693 ( 4.017 0.000 -1.243) 4.205 2.978 ( 3.121 0.000 2.775) 4.176 3.191 ( 2.813 0.000 -0.981) 2.979 4.026 ( 16.536 0.000 -14.550) 22.026 4.414 ( -0.998 0.000 -0.411) 1.079 4.991 ( -0.031 0.000 3.629) 3.629 5.408 ( -15.877 0.000 2.251) 16.036 5.547 ( 4.923 0.000 -6.571) 8.211 5.832 ( -2.292 0.000 -0.482) 2.342 6.151 ( 1.634 0.000 -0.126) 1.639 6.253 ( -1.867 0.000 -6.955) 7.201 6.697 ( -4.336 0.000 -1.683) 4.651 6.699 ( 2.323 0.000 6.652) 7.046 7.649 ( -5.353 0.000 3.132) 6.202 8.688 ( -0.444 0.000 -2.804) 2.839 10.019 ( -6.581 0.000 -21.585) 22.565 10.610 ( 10.181 0.000 18.230) 20.881 16.505 ( -0.049 0.000 -0.450) 0.452 16.753 ( -1.458 0.000 0.597) 1.575 17.268 ( 0.959 0.000 0.447) 1.058 17.550 ( -0.669 0.000 6.736) 6.769 21.290 ( 0.357 0.000 1.663) 1.701 21.629 ( -1.424 0.000 0.669) 1.573 28.176 ( 0.581 0.000 -0.449) 0.734 28.344 ( -0.984 0.000 -1.068) 1.452 37.166 ( -0.095 0.000 1.978) 1.980 37.357 ( 0.870 0.000 -1.962) 2.147 37.744 ( 3.055 0.000 -0.629) 3.119 39.882 ( -2.310 0.000 -10.027) 10.289 ======================= Grid point 150 (50/318) ======================= q-point: (-0.46 0.00 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 312 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.171 ( 20.109 0.000 18.457) 27.296 2.650 ( -7.333 0.000 -3.334) 8.055 2.938 ( -7.796 0.000 1.143) 7.880 3.238 ( 1.528 0.000 1.146) 1.910 4.173 ( 4.511 0.000 -10.613) 11.532 4.504 ( 9.223 0.000 3.825) 9.984 5.047 ( 2.838 0.000 6.220) 6.837 5.157 ( -5.738 0.000 -7.077) 9.111 5.497 ( -6.199 0.000 -7.717) 9.899 5.723 ( -6.947 0.000 -5.832) 9.070 6.003 ( -17.275 0.000 -15.107) 22.948 6.202 ( 2.968 0.000 1.941) 3.546 6.554 ( -7.662 0.000 -7.218) 10.527 6.738 ( -2.816 0.000 7.735) 8.232 7.676 ( 5.430 0.000 3.900) 6.686 8.714 ( 4.540 0.000 -1.812) 4.888 9.804 ( -3.707 0.000 -17.853) 18.234 10.913 ( 10.619 0.000 17.223) 20.233 16.534 ( 2.918 0.000 0.598) 2.979 16.729 ( -1.097 0.000 -0.277) 1.132 17.315 ( 2.793 0.000 2.545) 3.779 17.628 ( 3.827 0.000 9.429) 10.176 21.309 ( 0.444 0.000 2.688) 2.724 21.601 ( -1.554 0.000 -0.660) 1.688 28.170 ( -0.855 0.000 -0.669) 1.086 28.316 ( -1.049 0.000 -2.222) 2.457 37.114 ( -4.838 0.000 -0.330) 4.849 37.413 ( 4.388 0.000 0.478) 4.414 37.789 ( 1.400 0.000 1.688) 2.193 39.794 ( 0.356 0.000 -14.109) 14.113 ======================= Grid point 151 (51/318) ======================= q-point: (-0.38 0.00 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 312 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.378 ( -19.473 0.000 -4.515) 19.990 2.598 ( 2.744 0.000 4.417) 5.200 2.805 ( 2.325 0.000 10.000) 10.267 3.241 ( -2.218 0.000 3.088) 3.802 4.116 ( -3.535 0.000 -8.374) 9.089 4.614 ( -2.092 0.000 12.051) 12.231 5.042 ( -15.752 0.000 -18.692) 24.444 5.134 ( 0.181 0.000 6.246) 6.249 5.240 ( -14.910 0.000 -8.837) 17.332 5.547 ( -5.419 0.000 -7.520) 9.269 5.679 ( 8.104 0.000 -16.411) 18.303 6.276 ( 2.093 0.000 3.054) 3.702 6.371 ( -4.704 0.000 -7.868) 9.167 6.699 ( -6.771 0.000 11.933) 13.720 7.854 ( 10.811 0.000 1.612) 10.930 8.824 ( 8.083 0.000 -1.609) 8.241 9.668 ( -1.293 0.000 -13.308) 13.371 11.196 ( 10.085 0.000 13.108) 16.538 16.602 ( 3.432 0.000 -0.681) 3.499 16.723 ( 1.047 0.000 0.924) 1.397 17.384 ( 2.724 0.000 1.974) 3.364 17.790 ( 6.747 0.000 10.606) 12.570 21.343 ( 0.980 0.000 4.579) 4.682 21.566 ( -1.539 0.000 -1.583) 2.207 28.139 ( -1.886 0.000 -0.717) 2.018 28.278 ( -1.345 0.000 -2.931) 3.225 37.012 ( -5.576 0.000 -0.531) 5.601 37.497 ( 4.040 0.000 0.743) 4.107 37.815 ( -0.228 0.000 3.661) 3.668 39.719 ( 2.254 0.000 -20.577) 20.700 ======================= Grid point 152 (52/318) ======================= q-point: (-0.31 0.00 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 312 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.888 ( -29.190 0.000 -6.492) 29.903 2.321 ( -21.353 0.000 -3.132) 21.582 2.968 ( -3.225 0.000 2.772) 4.253 3.278 ( 4.703 0.000 3.406) 5.807 3.918 ( -16.839 0.000 -8.320) 18.782 4.343 ( -36.612 0.000 -12.727) 38.761 4.663 ( -0.956 0.000 -1.029) 1.404 4.859 ( -16.035 0.000 0.116) 16.035 5.058 ( -7.079 0.000 -0.764) 7.120 5.528 ( 3.781 0.000 2.391) 4.473 6.051 ( 30.138 0.000 -14.807) 33.579 6.182 ( -5.936 0.000 -4.649) 7.540 6.451 ( 9.028 0.000 3.462) 9.669 6.675 ( -3.874 0.000 19.298) 19.683 8.059 ( 10.718 0.000 -1.799) 10.868 8.982 ( 9.890 0.000 -1.825) 10.057 9.583 ( -0.887 0.000 -9.724) 9.764 11.434 ( 9.102 0.000 6.320) 11.081 16.622 ( 0.534 0.000 -3.163) 3.208 16.801 ( 5.325 0.000 3.134) 6.179 17.424 ( 0.890 0.000 -0.712) 1.140 17.983 ( 7.065 0.000 9.683) 11.987 21.405 ( 1.948 0.000 7.836) 8.075 21.527 ( -1.487 0.000 -1.889) 2.404 28.095 ( -2.354 0.000 -0.881) 2.514 28.232 ( -1.782 0.000 -2.562) 3.121 36.908 ( -5.269 0.000 -0.145) 5.271 37.567 ( 3.035 0.000 0.334) 3.053 37.826 ( -1.252 0.000 4.926) 5.083 39.615 ( 2.348 0.000 -31.491) 31.578 ======================= Grid point 153 (53/318) ======================= q-point: (-0.23 0.00 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 312 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.260 ( -32.818 0.000 -7.491) 33.662 1.840 ( -28.017 0.000 -3.911) 28.288 2.817 ( -11.136 0.000 1.624) 11.254 3.141 ( -51.116 0.000 -15.549) 53.429 3.248 ( -7.756 0.000 -11.185) 13.611 3.894 ( -19.025 0.000 7.305) 20.379 4.310 ( -16.595 0.000 -15.174) 22.486 4.973 ( 12.553 0.000 8.872) 15.372 5.017 ( 3.273 0.000 2.900) 4.373 5.633 ( 4.420 0.000 4.706) 6.456 6.059 ( -4.362 0.000 -3.955) 5.888 6.384 ( 8.851 0.000 1.000) 8.907 6.660 ( 9.037 0.000 6.835) 11.331 6.885 ( 15.853 0.000 14.864) 21.731 8.221 ( 8.579 0.000 -3.057) 9.107 9.159 ( 10.219 0.000 -2.280) 10.470 9.510 ( -1.641 0.000 -7.818) 7.988 11.588 ( 6.225 0.000 -5.070) 8.029 16.608 ( 0.156 0.000 -2.936) 2.940 16.925 ( 5.689 0.000 2.675) 6.286 17.407 ( -1.173 0.000 -3.534) 3.724 18.147 ( 4.964 0.000 6.488) 8.169 21.482 ( -0.776 0.000 -0.576) 0.966 21.524 ( 3.155 0.000 12.285) 12.683 28.046 ( -2.019 0.000 -1.312) 2.408 28.186 ( -2.084 0.000 -0.584) 2.164 36.819 ( -4.418 0.000 0.341) 4.431 37.613 ( 2.017 0.000 -0.271) 2.035 37.828 ( -1.779 0.000 4.822) 5.140 39.389 ( -2.409 0.000 -50.345) 50.402 ======================= Grid point 154 (54/318) ======================= q-point: (-0.15 0.00 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 312 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.661 ( -26.863 0.000 4.092) 27.173 1.254 ( -32.344 0.000 -2.886) 32.473 2.059 ( -56.340 0.000 -7.757) 56.871 2.640 ( -8.230 0.000 2.976) 8.751 2.920 ( -16.040 0.000 -15.500) 22.306 3.486 ( -27.862 0.000 6.087) 28.520 4.076 ( -2.079 0.000 -8.985) 9.223 5.153 ( 7.469 0.000 0.754) 7.507 5.298 ( 15.998 0.000 9.362) 18.536 5.731 ( 2.852 0.000 4.443) 5.279 5.993 ( -0.139 0.000 -2.039) 2.044 6.507 ( 1.676 0.000 15.272) 15.364 6.831 ( 3.956 0.000 8.408) 9.292 7.289 ( 17.262 0.000 7.274) 18.732 8.389 ( 11.491 0.000 6.636) 13.270 9.321 ( 8.681 0.000 -3.185) 9.247 9.431 ( -1.965 0.000 -6.083) 6.392 11.538 ( -4.870 0.000 -26.624) 27.066 16.599 ( 0.513 0.000 -1.727) 1.801 17.031 ( 4.176 0.000 1.497) 4.436 17.354 ( -1.409 0.000 -4.268) 4.494 18.226 ( 0.705 0.000 0.629) 0.945 21.454 ( -0.841 0.000 -1.503) 1.722 21.731 ( 8.474 0.000 22.051) 23.623 28.011 ( -0.700 0.000 -1.496) 1.652 28.155 ( -1.758 0.000 3.032) 3.504 36.751 ( -3.186 0.000 0.780) 3.280 37.639 ( 1.169 0.000 -0.913) 1.483 37.808 ( -2.707 0.000 -0.135) 2.710 38.826 ( -21.483 0.000 -76.636) 79.590 ======================= Grid point 155 (55/318) ======================= q-point: (-0.08 0.00 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 312 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.543 ( -1.154 0.000 35.972) 35.991 0.653 ( -30.671 0.000 4.892) 31.059 1.057 ( -46.238 0.000 14.401) 48.429 2.497 ( -10.550 0.000 -11.968) 15.954 2.654 ( -0.852 0.000 6.431) 6.487 3.039 ( -20.906 0.000 1.977) 21.000 4.049 ( 1.819 0.000 -2.527) 3.113 5.220 ( 0.941 0.000 -8.218) 8.272 5.640 ( 12.099 0.000 9.623) 15.459 5.801 ( 1.936 0.000 7.114) 7.373 6.033 ( 4.119 0.000 -0.551) 4.156 6.624 ( 0.598 0.000 -0.076) 0.603 6.901 ( -1.544 0.000 8.649) 8.785 7.534 ( 7.111 0.000 -0.607) 7.137 8.934 ( 35.091 0.000 17.095) 39.034 9.428 ( 5.011 0.000 -4.647) 6.834 9.509 ( 24.114 0.000 34.478) 42.074 10.851 ( -51.660 0.000 -55.655) 75.936 16.609 ( 1.079 0.000 0.070) 1.081 17.091 ( 1.659 0.000 0.011) 1.659 17.326 ( 0.820 0.000 -2.367) 2.505 18.144 ( -8.326 0.000 -7.259) 11.046 21.439 ( -0.023 0.000 -0.875) 0.876 22.076 ( 10.164 0.000 9.471) 13.892 28.009 ( 1.494 0.000 -1.086) 1.847 28.174 ( 0.697 0.000 6.213) 6.252 36.711 ( -1.692 0.000 1.149) 2.046 37.450 ( -28.178 0.000 -42.129) 50.684 37.647 ( 0.515 0.000 -1.523) 1.607 37.963 ( -15.249 0.000 2.215) 15.409 ======================= Grid point 156 (56/318) ======================= q-point: ( 0.00 0.10 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.826 ( -5.211 25.411 13.380) 29.187 1.076 ( 0.434 24.306 25.324) 35.104 1.604 ( 22.691 45.544 31.231) 59.704 2.620 ( -1.949 25.031 -12.775) 28.170 2.845 ( -3.285 6.377 -2.385) 7.559 3.150 ( 9.277 23.470 6.307) 26.013 4.049 ( 3.057 -2.587 0.852) 4.094 5.109 ( -5.662 0.468 -16.177) 17.145 5.614 ( -2.150 -1.951 1.692) 3.360 5.985 ( -9.164 1.931 13.576) 16.493 6.234 ( -0.152 11.253 1.216) 11.320 6.425 ( -12.472 15.167 -5.264) 20.330 6.910 ( -0.876 1.659 8.960) 9.155 7.684 ( 2.525 3.642 3.916) 5.914 9.083 ( -4.979 4.598 -15.813) 17.204 9.333 ( -5.277 -3.133 -10.518) 12.178 9.551 ( -29.834 6.241 -0.107) 30.480 10.978 ( 54.599 -25.842 21.195) 64.017 16.702 ( 1.363 3.308 -0.342) 3.594 17.113 ( 2.089 1.005 -0.631) 2.403 17.299 ( -1.119 -1.858 -3.487) 4.106 17.922 ( -0.614 -6.579 -4.823) 8.181 21.378 ( -12.515 -6.962 4.863) 15.124 21.466 ( -4.090 -3.641 4.461) 7.063 28.025 ( 3.275 -2.728 0.093) 4.264 28.049 ( -2.867 -4.936 3.046) 6.470 37.068 ( -10.693 10.999 -14.197) 20.901 37.667 ( -1.835 -2.111 -3.105) 4.179 37.913 ( -3.883 16.419 2.932) 17.125 39.586 ( 88.230 24.346 -24.696) 94.801 ======================= Grid point 157 (57/318) ======================= q-point: ( 0.08 0.10 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.038 ( 14.643 14.043 17.136) 26.557 1.328 ( 12.741 21.213 20.102) 31.881 2.357 ( 33.302 30.195 29.847) 53.959 2.600 ( 6.030 28.079 -7.953) 29.800 2.958 ( 16.509 3.672 0.259) 16.915 3.429 ( 14.509 14.110 13.847) 24.523 4.136 ( 6.008 -2.308 1.542) 6.618 4.831 ( -11.193 -0.995 -22.244) 24.922 5.620 ( 4.443 -0.141 -1.358) 4.648 5.795 ( -20.237 1.168 14.047) 24.662 6.146 ( -8.355 11.240 5.591) 15.080 6.331 ( -0.106 22.814 2.193) 22.919 6.911 ( -3.411 5.971 5.846) 9.026 7.666 ( -8.662 4.468 6.464) 11.695 8.767 ( -13.118 6.918 3.706) 15.287 9.282 ( 6.385 -0.397 -10.157) 12.004 9.351 ( -4.838 -1.611 -5.224) 7.300 11.538 ( 5.541 -28.339 -5.029) 29.310 16.730 ( 1.174 3.386 2.293) 4.255 17.098 ( -3.131 6.166 -4.101) 8.040 17.297 ( 3.180 -8.081 0.061) 8.684 17.920 ( 2.073 -9.171 -9.396) 13.292 21.237 ( -3.887 -0.137 3.378) 5.151 21.483 ( 1.492 -1.055 2.150) 2.821 28.018 ( -1.474 -3.302 1.559) 3.938 28.102 ( 4.092 -2.979 1.892) 5.404 36.908 ( -1.964 12.298 -4.077) 13.105 37.610 ( -1.787 -2.576 -4.065) 5.133 37.877 ( -2.839 14.978 2.811) 15.501 40.444 ( 21.063 -14.596 -17.872) 31.242 ======================= Grid point 158 (58/318) ======================= q-point: ( 0.15 0.10 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.433 ( 15.815 8.331 18.097) 25.437 1.751 ( 20.979 15.337 11.591) 28.455 2.718 ( 10.118 24.197 -5.023) 26.704 3.058 ( 29.003 8.894 3.984) 30.597 3.443 ( 27.238 5.579 15.731) 31.945 3.752 ( 6.898 12.090 12.349) 18.608 4.304 ( 12.048 -3.429 0.381) 12.533 4.539 ( -1.641 -2.921 -16.687) 17.020 5.430 ( -24.745 2.922 11.095) 27.275 5.766 ( 11.044 0.373 -2.284) 11.284 6.022 ( -8.307 13.842 5.586) 17.082 6.373 ( 2.037 21.260 3.524) 21.646 6.862 ( -5.604 6.440 6.177) 10.537 7.452 ( -17.963 4.167 6.850) 19.671 8.616 ( -9.237 3.050 4.794) 10.845 9.218 ( -5.726 -1.002 -6.379) 8.630 9.400 ( 10.813 -1.774 -4.059) 11.685 11.373 ( -12.977 -19.891 -13.563) 27.350 16.770 ( 1.065 3.396 3.555) 5.030 16.988 ( -5.134 6.740 -4.858) 9.766 17.359 ( 2.592 -7.658 -0.773) 8.122 17.860 ( -2.282 -7.790 -9.108) 12.200 21.225 ( 0.421 0.604 0.435) 0.855 21.531 ( 1.893 -1.399 2.843) 3.691 28.014 ( 0.259 -3.318 0.787) 3.420 28.191 ( 3.856 -3.380 2.748) 5.818 36.901 ( 1.911 9.452 -0.371) 9.650 37.560 ( -0.733 -2.092 -4.653) 5.154 37.830 ( -3.367 13.808 0.648) 14.227 40.460 ( -5.540 -13.776 -7.275) 16.535 ======================= Grid point 159 (59/318) ======================= q-point: ( 0.23 0.10 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.835 ( 17.265 5.549 13.773) 22.772 2.189 ( 19.933 9.579 6.290) 22.992 2.889 ( 9.941 15.908 -2.581) 18.936 3.389 ( -15.747 4.783 -11.770) 20.234 3.527 ( 12.664 6.814 -8.310) 16.609 4.243 ( 32.087 -2.983 14.291) 35.252 4.585 ( 14.680 -3.185 0.298) 15.025 4.683 ( 14.040 0.015 5.316) 15.013 5.095 ( -12.512 5.750 7.883) 15.867 5.921 ( -3.992 15.694 4.497) 16.807 5.997 ( 12.821 -0.274 0.766) 12.847 6.425 ( 1.623 21.403 1.030) 21.489 6.789 ( -6.686 4.928 8.983) 12.234 7.104 ( -23.520 4.065 7.396) 24.989 8.422 ( -14.064 2.289 2.064) 14.398 9.068 ( -6.503 0.487 -5.926) 8.812 9.624 ( 12.730 -3.023 4.104) 13.713 10.996 ( -15.843 -16.155 -18.788) 29.410 16.805 ( 0.022 3.855 3.506) 5.211 16.864 ( -4.621 8.086 -4.736) 10.448 17.366 ( -0.664 -5.669 -3.094) 6.493 17.746 ( -4.899 -5.856 -5.557) 9.443 21.241 ( 1.011 0.528 -0.047) 1.142 21.581 ( 1.335 -1.768 3.232) 3.918 28.036 ( 1.565 -3.774 0.402) 4.106 28.268 ( 2.557 -3.726 2.578) 5.202 36.960 ( 3.950 7.592 1.190) 8.640 37.530 ( 0.411 -0.687 -4.482) 4.553 37.763 ( -3.341 11.248 -1.587) 11.840 40.266 ( -10.164 -11.748 -4.462) 16.162 ======================= Grid point 160 (60/318) ======================= q-point: ( 0.31 0.10 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.219 ( 16.699 2.844 8.011) 18.739 2.552 ( 16.060 4.528 3.363) 17.021 2.793 ( -27.824 10.163 -13.252) 32.451 3.062 ( 7.251 9.846 -5.046) 13.228 3.747 ( 12.475 4.065 -12.222) 17.931 4.588 ( -7.487 -1.705 4.048) 8.681 4.796 ( 14.997 -10.252 2.486) 18.336 4.998 ( 19.379 -4.615 0.578) 19.929 5.259 ( 17.126 8.374 9.752) 21.413 5.930 ( 2.526 17.578 5.433) 18.571 6.251 ( 12.194 -2.221 1.750) 12.517 6.433 ( -0.297 22.738 -2.409) 22.867 6.669 ( -22.019 0.252 11.642) 24.909 6.766 ( -6.991 6.156 7.920) 12.227 8.135 ( -16.877 1.730 0.296) 16.968 8.914 ( -6.398 1.504 -4.827) 8.155 9.900 ( 12.156 -3.482 10.034) 16.142 10.600 ( -13.519 -14.383 -21.025) 28.839 16.743 ( -4.050 9.259 -3.646) 10.744 16.837 ( -0.023 5.804 2.547) 6.338 17.311 ( -2.367 -3.743 -4.165) 6.080 17.627 ( -5.599 -4.203 -0.961) 7.067 21.260 ( 0.852 0.408 0.372) 1.016 21.614 ( 0.264 -1.952 2.900) 3.506 28.072 ( 2.090 -4.178 0.171) 4.675 28.313 ( 0.848 -3.951 1.603) 4.347 37.054 ( 5.044 6.580 2.114) 8.557 37.511 ( -0.465 2.410 -3.371) 4.170 37.701 ( -1.172 6.226 -3.271) 7.130 40.060 ( -8.656 -10.997 -4.999) 14.861 ======================= Grid point 161 (61/318) ======================= q-point: ( 0.38 0.10 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.251 ( -19.644 17.401 -9.312) 27.846 2.526 ( 12.269 0.566 2.683) 12.572 2.823 ( 11.273 1.385 2.103) 11.551 3.152 ( 3.868 2.469 -1.931) 4.978 3.873 ( 11.313 2.869 -14.743) 18.804 4.477 ( -5.323 0.518 2.752) 6.015 4.960 ( 3.467 -3.545 0.920) 5.043 5.304 ( 14.052 -7.111 -5.057) 16.541 5.557 ( 5.009 1.976 5.316) 7.567 6.048 ( 5.279 17.214 2.386) 18.163 6.265 ( -13.351 0.842 4.881) 14.240 6.393 ( -0.456 19.551 -2.805) 19.757 6.535 ( 5.409 -0.240 7.109) 8.936 6.750 ( -1.974 1.769 5.591) 6.188 7.837 ( -14.469 1.049 0.567) 14.518 8.785 ( -4.509 2.232 -3.674) 6.230 10.148 ( 4.692 -3.474 -3.452) 6.783 10.295 ( -3.795 -13.344 -3.234) 14.245 16.666 ( -1.967 11.456 -2.733) 11.941 16.846 ( -0.535 7.133 2.114) 7.459 17.251 ( -1.525 -2.712 -2.530) 4.010 17.540 ( -4.042 -2.904 3.231) 5.934 21.277 ( 0.548 0.283 0.924) 1.110 21.624 ( -0.726 -1.910 1.894) 2.786 28.109 ( 1.693 -4.420 -0.086) 4.734 28.320 ( -0.461 -4.040 0.230) 4.073 37.164 ( 4.926 6.289 2.597) 8.400 37.459 ( -3.027 5.315 -2.709) 6.690 37.696 ( 2.330 0.985 -2.875) 3.829 39.893 ( -5.571 -10.859 -6.806) 13.974 ======================= Grid point 162 (62/318) ======================= q-point: ( 0.46 0.10 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.049 ( 0.709 18.243 3.959) 18.681 2.685 ( 3.629 -0.581 -0.503) 3.710 2.981 ( 3.860 0.151 1.777) 4.252 3.190 ( 1.875 -0.115 -0.965) 2.112 4.034 ( 15.133 0.755 -13.912) 20.570 4.420 ( -1.783 1.193 0.427) 2.188 5.013 ( 3.209 1.532 1.624) 3.909 5.403 ( -9.055 -2.575 -0.730) 9.442 5.482 ( -2.883 -3.552 -1.952) 4.974 6.050 ( -5.032 10.969 -5.744) 13.365 6.155 ( -2.449 0.801 -2.387) 3.512 6.404 ( 2.585 21.197 -0.741) 21.367 6.661 ( 3.038 -0.569 4.878) 5.775 6.718 ( -4.114 0.508 1.394) 4.373 7.652 ( -5.377 0.409 2.488) 5.939 8.714 ( -0.783 2.240 -2.803) 3.673 9.947 ( -6.015 -7.096 -20.908) 22.884 10.510 ( 9.605 -8.936 18.372) 22.574 16.641 ( 0.517 12.580 -1.363) 12.664 16.843 ( -0.892 8.832 1.368) 8.982 17.235 ( 0.576 -2.961 0.428) 3.047 17.528 ( -0.350 -2.035 6.820) 7.126 21.291 ( 0.319 0.144 1.511) 1.551 21.612 ( -1.280 -1.734 0.576) 2.231 28.129 ( 0.534 -4.537 -0.393) 4.586 28.303 ( -0.954 -4.041 -1.137) 4.305 37.242 ( 0.656 7.289 1.774) 7.531 37.401 ( -0.113 4.298 -1.792) 4.658 37.736 ( 2.785 -0.662 -0.716) 2.951 39.772 ( -2.433 -10.848 -9.527) 14.641 ======================= Grid point 163 (63/318) ======================= q-point: (-0.46 0.10 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.281 ( 15.692 9.671 11.994) 21.991 2.652 ( -5.829 1.075 -1.770) 6.186 2.964 ( -6.360 2.237 1.117) 6.834 3.237 ( 2.897 -0.031 1.347) 3.195 4.183 ( 5.796 0.673 -11.148) 12.583 4.459 ( 5.589 -2.801 4.082) 7.467 5.130 ( -12.224 -1.695 -3.845) 12.926 5.138 ( 8.715 7.032 2.447) 11.462 5.410 ( -6.065 -8.217 -7.219) 12.507 5.818 ( -12.351 -3.245 -13.350) 18.474 6.008 ( -10.321 11.436 -9.296) 17.992 6.460 ( 3.076 23.368 1.444) 23.613 6.594 ( -6.352 4.644 -3.465) 8.598 6.723 ( -1.872 -0.429 7.781) 8.014 7.676 ( 5.479 -0.004 3.040) 6.266 8.728 ( 3.934 1.080 -2.356) 4.711 9.750 ( -3.186 -4.993 -16.816) 17.829 10.793 ( 9.301 -11.108 17.070) 22.389 16.663 ( 2.266 11.765 -0.695) 12.001 16.834 ( -0.565 10.632 1.083) 10.702 17.272 ( 2.140 -4.069 2.444) 5.207 17.609 ( 3.803 -1.736 9.450) 10.334 21.309 ( 0.375 -0.059 2.425) 2.455 21.586 ( -1.452 -1.535 -0.650) 2.211 28.123 ( -0.828 -4.529 -0.592) 4.642 28.275 ( -1.035 -4.038 -2.300) 4.761 37.194 ( -4.637 7.720 -0.370) 9.013 37.453 ( 4.620 3.939 0.474) 6.090 37.780 ( 1.518 -0.824 1.561) 2.328 39.686 ( 0.310 -10.691 -13.508) 17.230 ======================= Grid point 164 (64/318) ======================= q-point: (-0.38 0.10 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.358 ( -15.872 -1.388 -4.260) 16.493 2.667 ( -0.814 6.058 0.708) 6.154 2.845 ( 1.825 3.203 8.450) 9.220 3.298 ( 2.257 5.641 4.043) 7.299 4.134 ( -3.260 1.726 -10.114) 10.765 4.572 ( -0.426 -3.472 13.026) 13.487 4.891 ( -13.714 -10.051 -13.938) 21.986 5.157 ( -15.707 -7.817 -8.509) 19.499 5.231 ( -6.673 4.828 1.931) 8.460 5.665 ( 15.352 0.918 -16.492) 22.551 5.741 ( -8.253 14.138 -9.428) 18.891 6.464 ( -4.832 10.587 -3.466) 12.142 6.516 ( 0.679 18.753 2.701) 18.959 6.723 ( -2.512 6.306 11.657) 13.489 7.848 ( 10.767 -0.599 0.379) 10.790 8.829 ( 8.081 0.171 -2.069) 8.344 9.622 ( -1.553 -4.155 -12.649) 13.404 11.050 ( 8.575 -13.631 13.260) 20.861 16.695 ( 1.366 8.474 -1.899) 8.791 16.852 ( 1.944 12.778 2.294) 13.127 17.327 ( 1.946 -5.422 2.023) 6.106 17.767 ( 6.364 -2.146 10.543) 12.500 21.338 ( 0.795 -0.460 4.091) 4.193 21.552 ( -1.467 -1.352 -1.505) 2.499 28.095 ( -1.755 -4.333 -0.574) 4.710 28.237 ( -1.347 -4.071 -3.074) 5.276 37.102 ( -4.772 8.445 -0.137) 9.701 37.545 ( 4.597 4.692 0.728) 6.608 37.809 ( 0.071 -0.505 3.309) 3.348 39.615 ( 2.378 -10.157 -19.664) 22.260 ======================= Grid point 165 (65/318) ======================= q-point: (-0.31 0.10 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.911 ( -27.190 2.444 -7.428) 28.292 2.375 ( -20.819 4.512 -4.604) 21.794 3.017 ( 2.551 3.853 3.264) 5.657 3.387 ( 4.063 10.705 1.904) 11.607 3.915 ( -16.360 -0.121 -9.962) 19.155 4.352 ( -29.899 0.763 -11.281) 31.965 4.625 ( -4.948 -3.354 -0.673) 6.015 4.795 ( -11.714 -5.741 2.268) 13.241 5.089 ( -6.636 2.292 -0.049) 7.021 5.677 ( 4.359 11.814 0.277) 12.595 6.024 ( 24.676 -1.251 -14.640) 28.720 6.383 ( -1.139 17.878 -2.951) 18.155 6.515 ( -2.848 4.622 8.826) 10.362 6.827 ( 5.854 18.147 13.490) 23.357 8.046 ( 11.003 -1.234 -3.344) 11.566 8.990 ( 10.204 0.491 -1.971) 10.404 9.532 ( -1.310 -4.627 -9.428) 10.583 11.259 ( 7.217 -16.167 6.965) 19.026 16.689 ( -0.153 6.409 -2.834) 7.009 16.931 ( 4.339 12.182 2.812) 13.234 17.353 ( 0.061 -6.670 -0.298) 6.677 17.950 ( 6.349 -3.231 9.604) 11.957 21.390 ( 1.419 -1.379 6.855) 7.135 21.515 ( -1.430 -1.172 -1.821) 2.596 28.055 ( -2.125 -3.888 -0.616) 4.474 28.189 ( -1.797 -4.171 -2.902) 5.390 37.025 ( -3.630 10.403 0.941) 11.058 37.628 ( 3.972 6.177 0.593) 7.367 37.823 ( -0.959 -0.170 4.332) 4.440 39.525 ( 2.992 -8.672 -29.684) 31.069 ======================= Grid point 166 (66/318) ======================= q-point: (-0.23 0.10 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.308 ( -30.884 4.773 -9.917) 32.786 1.902 ( -26.645 5.821 -4.529) 27.647 2.990 ( -5.137 14.779 1.627) 15.731 3.229 ( -31.624 12.185 -11.866) 35.908 3.426 ( -15.048 13.372 -11.421) 23.145 3.877 ( -20.178 -1.285 4.659) 20.748 4.253 ( -16.530 -5.242 -14.340) 22.503 4.946 ( 12.014 -1.937 10.991) 16.398 5.070 ( 4.233 4.089 1.671) 6.118 5.801 ( 5.227 13.412 6.389) 15.749 6.186 ( -0.287 6.070 -4.438) 7.525 6.442 ( 3.878 9.142 4.596) 10.942 6.617 ( 11.291 0.797 3.609) 11.881 7.082 ( 12.628 17.663 12.806) 25.208 8.212 ( 10.033 -0.567 -4.504) 11.012 9.168 ( 10.048 0.739 -2.364) 10.348 9.459 ( -1.181 -4.573 -7.366) 8.750 11.375 ( 3.049 -19.136 -3.101) 19.624 16.668 ( -0.158 5.541 -2.597) 6.121 17.028 ( 4.406 9.636 1.654) 10.723 17.326 ( -1.907 -7.381 -2.356) 7.979 18.096 ( 3.876 -4.865 6.536) 9.023 21.467 ( 0.683 -2.236 5.071) 5.583 21.486 ( -0.051 -2.497 4.306) 4.977 28.012 ( -1.808 -3.302 -1.022) 3.901 28.140 ( -2.115 -4.369 -1.275) 5.019 36.989 ( -1.023 13.743 2.829) 14.068 37.698 ( 3.451 8.956 -0.287) 9.602 37.826 ( -1.633 -0.209 5.188) 5.443 39.343 ( 0.467 -4.126 -46.055) 46.242 ======================= Grid point 167 (67/318) ======================= q-point: (-0.15 0.10 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.748 ( -21.689 10.574 1.539) 24.178 1.376 ( -27.303 12.370 1.094) 29.994 2.399 ( -43.423 29.457 -9.110) 53.257 2.913 ( -3.977 23.946 1.496) 24.320 3.110 ( -12.038 16.049 -13.245) 24.039 3.487 ( -25.832 1.053 5.442) 26.420 4.023 ( -1.696 -4.880 -8.395) 9.857 5.192 ( 6.577 2.905 -0.564) 7.212 5.269 ( 15.024 -1.564 8.321) 17.245 5.924 ( 3.583 14.574 7.132) 16.617 6.135 ( -1.991 9.319 0.752) 9.559 6.547 ( 2.635 6.031 13.049) 14.615 6.826 ( 6.501 0.358 2.695) 7.046 7.395 ( 12.775 10.292 6.713) 17.725 8.430 ( 17.037 3.994 4.251) 18.008 9.319 ( 7.565 -0.661 -5.472) 9.360 9.415 ( 1.129 -0.805 -1.832) 2.298 11.267 ( -10.582 -22.381 -18.991) 31.201 16.659 ( 0.683 4.936 -1.790) 5.295 17.097 ( 2.281 5.364 -1.001) 5.914 17.278 ( -0.954 -5.670 -1.591) 5.966 18.152 ( -0.958 -6.878 1.445) 7.094 21.447 ( -0.785 -0.705 -1.455) 1.797 21.589 ( 0.980 -10.434 16.199) 19.293 27.981 ( -0.591 -2.878 -1.354) 3.235 28.100 ( -2.194 -4.771 1.430) 5.442 37.048 ( 5.589 17.103 6.788) 19.231 37.743 ( 1.999 10.810 -3.533) 11.547 37.838 ( -0.194 3.204 7.650) 8.296 38.950 ( -6.951 12.140 -69.370) 70.766 ======================= Grid point 168 (68/318) ======================= q-point: (-0.08 0.10 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.763 ( 9.589 21.344 35.463) 42.487 0.980 ( -18.129 23.292 11.669) 31.739 1.627 ( -31.925 45.322 -1.256) 55.452 2.793 ( -6.519 21.176 -14.180) 26.305 2.983 ( 2.921 25.024 4.128) 25.530 3.072 ( -18.283 7.742 0.771) 19.870 4.006 ( 1.809 -3.476 -1.862) 4.339 5.234 ( 0.332 1.232 -8.791) 8.883 5.548 ( 8.009 -2.506 7.220) 11.070 6.005 ( -1.121 8.339 10.394) 13.372 6.162 ( 4.338 11.650 1.120) 12.482 6.649 ( -0.214 5.051 -1.818) 5.372 6.870 ( -3.239 -3.057 9.261) 10.276 7.584 ( 6.381 4.658 0.155) 7.902 8.956 ( 27.396 0.458 -0.155) 27.400 9.361 ( 4.202 -2.725 -7.158) 8.736 9.663 ( 27.827 8.465 30.211) 41.937 10.635 ( -42.011 -14.072 -30.289) 53.669 16.675 ( 1.924 4.095 -1.255) 4.696 17.100 ( -0.162 0.281 -1.459) 1.494 17.292 ( 2.607 -1.302 -1.311) 3.196 18.060 ( -7.942 -7.365 -3.916) 11.517 21.431 ( -0.187 -0.803 -0.912) 1.229 21.638 ( -9.015 -21.793 15.097) 28.002 27.982 ( 1.531 -2.683 -1.012) 3.251 28.076 ( -2.235 -5.885 3.808) 7.358 37.266 ( 6.154 -2.171 2.875) 7.131 37.718 ( -1.518 4.062 -4.694) 6.390 37.974 ( 4.355 11.243 15.542) 19.671 38.430 ( 20.957 76.349 -72.699) 107.487 ======================= Grid point 169 (69/318) ======================= q-point: ( 0.00 0.20 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.254 ( -3.215 18.403 21.494) 28.478 1.587 ( -4.505 29.460 10.422) 31.572 2.494 ( 20.249 33.986 17.777) 43.372 2.959 ( -2.478 16.601 -0.297) 16.787 3.128 ( -0.338 12.705 -15.193) 19.808 3.675 ( 2.638 27.394 0.985) 27.539 4.075 ( 3.490 8.385 3.212) 9.633 5.105 ( -7.329 -0.675 -17.319) 18.818 5.606 ( -1.038 0.317 0.564) 1.223 6.028 ( -9.660 3.451 14.667) 17.898 6.302 ( -2.275 -3.151 1.270) 4.089 6.791 ( -2.724 11.186 8.747) 14.459 7.050 ( 4.059 21.606 3.973) 22.341 7.781 ( 2.755 6.040 3.886) 7.692 9.122 ( 8.744 -0.761 -13.650) 16.228 9.293 ( -0.830 -0.626 -12.804) 12.846 9.653 ( -30.056 4.265 -0.082) 30.357 10.597 ( 26.896 -14.029 19.243) 35.924 16.749 ( 1.253 1.904 0.850) 2.432 17.108 ( 0.660 -1.077 -0.062) 1.265 17.291 ( -0.153 0.489 -5.790) 5.813 17.753 ( -2.586 -10.237 -5.518) 11.914 21.291 ( -5.508 -1.783 4.033) 7.056 21.430 ( 0.519 -1.433 0.959) 1.801 27.946 ( 0.031 -5.013 1.590) 5.260 27.957 ( 1.535 -4.422 0.815) 4.752 37.127 ( -2.221 -0.846 -5.607) 6.090 37.566 ( -3.142 -7.016 -1.932) 7.926 38.324 ( -1.553 23.267 2.660) 23.470 39.895 ( 31.151 8.156 -18.238) 37.008 ======================= Grid point 170 (70/318) ======================= q-point: ( 0.08 0.20 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.386 ( 7.250 19.321 15.033) 25.531 1.692 ( 7.139 17.832 19.324) 27.246 3.000 ( 6.607 16.304 -5.302) 18.373 3.069 ( 16.502 9.032 2.928) 19.038 3.163 ( 19.554 33.472 11.832) 40.530 3.760 ( 7.254 17.901 4.933) 19.935 4.166 ( 3.820 7.627 4.686) 9.732 4.785 ( -13.038 -2.895 -23.865) 27.348 5.616 ( 2.741 -0.235 -0.043) 2.751 5.867 ( -15.990 6.029 11.764) 20.746 6.248 ( -5.911 -1.197 8.749) 10.626 6.791 ( -2.172 18.578 5.376) 19.462 7.148 ( 3.000 19.621 2.856) 20.054 7.808 ( -4.624 9.894 5.626) 12.285 8.962 ( -15.388 12.515 -4.413) 20.320 9.258 ( 5.947 -2.415 -10.096) 11.964 9.324 ( -7.193 -0.407 -1.728) 7.409 10.990 ( 5.566 -24.967 5.657) 26.198 16.788 ( 1.963 2.241 1.993) 3.585 17.128 ( 1.220 -7.285 0.485) 7.402 17.229 ( -1.849 5.712 -5.625) 8.227 17.714 ( 1.731 -11.173 -8.826) 14.343 21.243 ( -1.495 0.781 1.661) 2.367 21.455 ( 1.323 -1.727 1.455) 2.617 27.936 ( -1.044 -4.752 1.359) 5.052 28.022 ( 3.512 -4.867 1.843) 6.278 37.072 ( -0.309 4.251 -4.205) 5.987 37.521 ( -0.125 -6.063 -4.000) 7.265 38.284 ( -4.317 24.168 2.737) 24.703 40.192 ( 8.469 -10.027 -8.099) 15.422 ======================= Grid point 171 (71/318) ======================= q-point: ( 0.15 0.20 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.672 ( 12.742 15.053 14.855) 24.691 2.029 ( 16.176 12.533 14.452) 25.052 3.095 ( 6.342 8.679 -4.660) 11.716 3.302 ( 16.132 13.052 -4.797) 21.298 3.638 ( 15.084 13.323 10.664) 22.776 4.043 ( 7.211 16.867 6.869) 19.588 4.296 ( 12.724 4.329 4.892) 14.303 4.454 ( -2.773 -4.587 -14.062) 15.048 5.509 ( -20.858 5.075 10.344) 23.829 5.786 ( 7.912 1.892 -0.971) 8.193 6.200 ( -5.289 1.556 10.383) 11.756 6.776 ( -3.094 15.533 5.891) 16.898 7.173 ( -1.614 23.097 1.237) 23.186 7.644 ( -14.894 17.577 2.977) 23.231 8.729 ( -11.340 8.937 3.471) 14.850 9.194 ( -4.150 -1.262 -5.149) 6.732 9.359 ( 8.544 -1.980 -3.280) 9.364 10.920 ( -10.493 -23.671 -6.426) 26.678 16.841 ( 2.200 3.251 2.642) 4.731 17.104 ( -2.720 -1.105 -4.248) 5.164 17.219 ( 2.548 -0.300 -1.050) 2.772 17.679 ( 0.086 -9.689 -9.403) 13.502 21.243 ( 0.470 1.138 0.250) 1.256 21.493 ( 1.560 -2.321 2.070) 3.479 27.930 ( -0.156 -4.877 0.687) 4.928 28.100 ( 3.232 -5.669 2.657) 7.046 37.068 ( 1.918 6.248 -2.310) 6.932 37.509 ( 1.559 -3.236 -4.861) 6.045 38.197 ( -6.602 22.143 2.016) 23.194 40.160 ( -6.303 -14.809 -3.307) 16.431 ======================= Grid point 172 (72/318) ======================= q-point: ( 0.23 0.20 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.006 ( 14.328 11.387 11.523) 21.627 2.384 ( 14.596 9.375 6.256) 18.441 3.135 ( -1.043 5.579 -0.803) 5.733 3.548 ( 4.436 11.791 -9.483) 15.767 3.718 ( -0.011 11.110 -12.750) 16.911 4.138 ( 18.262 -7.410 2.443) 19.859 4.518 ( 9.075 -3.187 3.155) 10.123 4.743 ( 12.851 6.614 12.844) 19.335 5.226 ( -8.934 7.432 9.727) 15.155 5.977 ( 11.832 -0.929 -0.047) 11.869 6.183 ( -2.625 5.658 9.888) 11.691 6.734 ( -6.251 6.128 7.247) 11.364 7.099 ( -8.025 23.599 2.625) 25.064 7.365 ( -13.565 26.789 -0.805) 30.039 8.505 ( -15.341 6.382 2.421) 16.791 9.080 ( -5.214 0.682 -5.188) 7.387 9.556 ( 11.413 -3.071 5.546) 13.056 10.610 ( -14.426 -20.817 -14.527) 29.197 16.899 ( 2.198 4.891 2.679) 5.994 17.023 ( -2.391 4.390 -5.424) 7.376 17.253 ( 1.252 -2.499 -1.208) 3.046 17.611 ( -2.101 -6.908 -6.635) 9.806 21.256 ( 0.812 0.985 0.025) 1.277 21.533 ( 1.168 -2.916 2.384) 3.944 27.940 ( 0.929 -5.460 0.354) 5.549 28.166 ( 2.105 -6.408 2.469) 7.183 37.114 ( 3.986 6.778 -0.879) 7.913 37.519 ( 2.526 -0.499 -4.448) 5.140 38.066 ( -8.085 18.616 0.375) 20.299 39.978 ( -10.426 -16.053 -2.459) 19.299 ======================= Grid point 173 (73/318) ======================= q-point: ( 0.31 0.20 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.319 ( 13.073 7.329 6.896) 16.498 2.647 ( 11.786 4.849 1.504) 12.832 3.004 ( -12.886 9.009 -4.681) 16.405 3.306 ( -7.155 14.087 -11.935) 19.801 3.860 ( 11.202 7.194 -11.551) 17.626 4.535 ( 17.791 -11.046 5.074) 21.547 4.622 ( -3.986 0.734 3.284) 5.217 4.876 ( 9.969 -6.698 3.853) 12.613 5.397 ( 11.099 4.662 9.607) 15.402 6.194 ( 8.831 -1.716 -0.525) 9.012 6.227 ( 1.673 5.939 9.435) 11.274 6.613 ( -11.420 -4.432 11.367) 16.711 6.923 ( -10.281 26.356 1.441) 28.327 7.184 ( -5.488 33.227 -2.927) 33.804 8.199 ( -17.910 5.155 0.496) 18.644 8.944 ( -6.262 0.970 -3.637) 7.307 9.818 ( 10.714 -4.148 11.549) 16.291 10.263 ( -11.419 -17.411 -18.993) 28.183 16.937 ( 0.268 8.027 -3.156) 8.629 16.975 ( 0.612 5.961 0.746) 6.039 17.249 ( -0.302 0.082 -2.402) 2.423 17.534 ( -3.207 -4.072 -1.776) 5.479 21.271 ( 0.670 0.761 0.337) 1.068 21.561 ( 0.378 -3.265 2.150) 3.927 27.966 ( 1.561 -6.142 0.197) 6.341 28.203 ( 0.639 -6.872 1.482) 7.059 37.201 ( 5.445 7.201 0.383) 9.036 37.547 ( 2.768 1.370 -3.287) 4.510 37.910 ( -8.144 14.172 -1.386) 16.404 39.773 ( -9.318 -17.051 -3.563) 19.755 ======================= Grid point 174 (74/318) ======================= q-point: ( 0.38 0.20 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.555 ( 8.700 3.280 4.095) 10.160 2.684 ( -12.516 23.630 -8.979) 28.208 2.854 ( 9.057 1.680 -0.766) 9.243 3.201 ( -1.338 2.268 -3.002) 3.993 3.954 ( 8.214 5.268 -13.091) 16.328 4.532 ( -4.763 5.591 4.372) 8.548 4.838 ( 11.820 -8.354 1.103) 14.516 5.107 ( 11.061 -12.358 -3.628) 16.977 5.592 ( 4.135 -0.707 6.173) 7.463 6.068 ( -16.329 -5.744 0.677) 17.324 6.413 ( 8.101 -3.168 4.903) 9.985 6.606 ( 2.707 3.130 12.425) 13.096 6.762 ( -6.824 26.057 -3.100) 27.114 7.095 ( -2.907 32.558 -1.730) 32.733 7.880 ( -15.568 3.858 0.029) 16.039 8.820 ( -4.739 0.260 -2.855) 5.539 9.972 ( -7.302 -14.528 -14.923) 22.070 10.084 ( 9.052 -4.641 10.718) 14.776 16.908 ( 0.426 8.918 -4.814) 10.143 17.022 ( 1.672 9.316 4.120) 10.322 17.222 ( -0.714 2.541 -2.754) 3.814 17.483 ( -2.454 -1.567 3.361) 4.447 21.285 ( 0.414 0.525 0.725) 0.986 21.571 ( -0.414 -3.283 1.390) 3.589 27.995 ( 1.346 -6.688 -0.018) 6.823 28.209 ( -0.476 -7.047 0.116) 7.064 37.313 ( 5.933 7.897 1.178) 9.948 37.570 ( 0.575 4.411 -1.576) 4.719 37.767 ( -5.126 7.622 -2.560) 9.536 39.601 ( -6.270 -17.933 -5.532) 19.786 ======================= Grid point 175 (75/318) ======================= q-point: ( 0.46 0.20 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.483 ( -3.702 22.090 -5.656) 23.101 2.693 ( 4.072 3.329 2.751) 5.936 2.978 ( 4.574 -0.483 -0.416) 4.618 3.192 ( 1.203 0.645 -0.846) 1.606 4.056 ( 10.980 1.697 -11.433) 15.943 4.484 ( -2.605 5.462 0.901) 6.118 5.026 ( 9.560 -0.918 -1.126) 9.670 5.203 ( 2.457 -14.057 -6.407) 15.643 5.527 ( -16.171 4.714 6.953) 18.223 5.811 ( -7.284 -18.693 -8.587) 21.823 6.482 ( -3.930 3.004 -4.369) 6.600 6.647 ( -1.625 -0.364 1.692) 2.374 6.763 ( 4.350 23.788 9.040) 25.817 7.058 ( -0.074 32.464 -0.449) 32.468 7.673 ( -5.979 2.215 1.136) 6.477 8.740 ( -1.734 -1.032 -3.531) 4.067 9.777 ( -3.544 -8.093 -15.503) 17.843 10.318 ( 7.245 -9.219 15.611) 19.524 16.902 ( 1.411 9.761 -3.454) 10.450 17.078 ( 1.276 12.443 5.536) 13.679 17.195 ( -0.490 2.475 -2.266) 3.392 17.493 ( 0.321 -0.053 7.298) 7.305 21.296 ( 0.213 0.280 1.127) 1.181 21.564 ( -0.943 -3.069 0.365) 3.231 28.010 ( 0.376 -7.022 -0.326) 7.039 28.191 ( -0.904 -7.058 -1.241) 7.224 37.425 ( 4.542 9.947 1.156) 10.996 37.521 ( -3.736 7.889 -1.192) 8.810 37.726 ( 1.355 0.001 -1.074) 1.729 39.476 ( -2.858 -18.353 -8.198) 20.303 ======================= Grid point 176 (76/318) ======================= q-point: (-0.46 0.20 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.448 ( 0.459 5.110 -3.710) 6.332 2.752 ( 2.325 9.640 0.712) 9.942 3.007 ( -3.387 1.766 0.968) 3.941 3.250 ( 6.362 1.882 1.943) 6.913 4.187 ( 7.817 0.105 -9.206) 12.078 4.456 ( 0.027 2.911 1.475) 3.263 5.043 ( -12.569 -7.919 -7.152) 16.487 5.169 ( -3.075 -10.353 -7.417) 13.102 5.342 ( 2.074 8.002 6.163) 10.311 5.595 ( -7.748 -14.762 -13.175) 21.249 6.276 ( -10.788 7.330 -12.762) 18.248 6.628 ( -4.409 -3.151 6.924) 8.793 6.867 ( 1.752 23.887 5.364) 24.544 7.099 ( 4.031 33.336 2.009) 33.638 7.682 ( 5.526 1.177 0.884) 5.719 8.723 ( 2.841 -2.708 -4.364) 5.870 9.649 ( -1.815 -3.534 -12.276) 12.903 10.535 ( 6.149 -13.468 15.529) 21.456 16.908 ( 0.780 10.419 -2.491) 10.741 17.132 ( 0.787 15.581 6.257) 16.808 17.183 ( 0.402 -1.095 -1.072) 1.584 17.580 ( 3.481 -0.140 9.552) 10.168 21.308 ( 0.222 -0.027 1.771) 1.785 21.543 ( -1.188 -2.767 -0.606) 3.072 28.004 ( -0.741 -7.080 -0.515) 7.138 28.163 ( -0.997 -7.037 -2.408) 7.504 37.391 ( -5.188 11.162 -0.460) 12.317 37.562 ( 5.728 6.994 0.463) 9.052 37.763 ( 2.077 -0.630 1.083) 2.425 39.395 ( 0.358 -18.027 -11.890) 21.598 ======================= Grid point 177 (77/318) ======================= q-point: (-0.38 0.20 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.346 ( -10.247 0.419 -5.909) 11.836 2.785 ( -7.170 4.638 -5.061) 9.926 2.902 ( 1.550 2.387 3.459) 4.480 3.447 ( 11.156 8.370 3.726) 14.436 4.188 ( -1.083 4.216 -12.806) 13.526 4.520 ( 1.250 -0.853 13.219) 13.305 4.690 ( -16.281 -10.027 -11.339) 22.230 4.936 ( -15.205 -13.727 -6.470) 21.482 5.282 ( -9.376 -0.215 -2.778) 9.781 5.684 ( 20.009 1.269 -11.166) 22.949 5.991 ( -9.334 8.734 -11.371) 17.108 6.572 ( -6.464 -2.058 9.889) 11.992 6.900 ( -0.204 27.687 2.793) 27.829 7.218 ( 6.320 34.224 4.323) 35.070 7.839 ( 10.834 0.236 -2.979) 11.239 8.804 ( 8.532 -3.575 -4.097) 10.118 9.550 ( -2.279 -1.517 -9.286) 9.681 10.728 ( 5.430 -17.113 13.091) 22.220 16.892 ( -1.045 10.100 -2.257) 10.402 17.182 ( 0.936 17.520 5.387) 18.353 17.192 ( 0.559 -6.012 -0.134) 6.039 17.722 ( 5.044 -1.641 10.292) 11.579 21.327 ( 0.442 -0.542 2.936) 3.018 21.514 ( -1.251 -2.435 -1.287) 3.025 27.981 ( -1.376 -6.802 -0.397) 6.951 28.125 ( -1.274 -6.969 -3.260) 7.798 37.301 ( -4.328 10.380 0.635) 11.265 37.673 ( 5.284 7.528 1.837) 9.379 37.808 ( 2.117 1.293 1.142) 2.731 39.343 ( 3.242 -16.548 -17.259) 24.129 ======================= Grid point 178 (78/318) ======================= q-point: (-0.31 0.20 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.985 ( -22.613 4.932 -11.065) 25.654 2.465 ( -18.702 4.329 -6.439) 20.248 3.077 ( 10.217 1.491 3.691) 10.965 3.639 ( 7.703 11.385 -1.316) 13.809 3.951 ( -15.487 6.210 -13.311) 21.345 4.367 ( -15.421 0.765 -8.598) 17.673 4.523 ( -18.083 -7.696 -3.899) 20.035 4.687 ( 2.514 -3.211 12.930) 13.558 5.123 ( -4.904 0.874 -0.359) 4.994 5.830 ( 6.449 2.060 -11.623) 13.451 6.031 ( 14.401 1.427 -4.707) 15.218 6.524 ( -5.699 -0.889 13.620) 14.791 6.917 ( 1.547 32.176 0.818) 32.224 7.376 ( 7.288 33.500 6.103) 34.823 8.024 ( 12.259 -0.439 -7.293) 14.271 8.975 ( 11.809 -2.986 -4.030) 12.830 9.453 ( -2.879 -1.368 -6.405) 7.155 10.882 ( 4.012 -19.826 8.323) 21.873 16.848 ( -2.055 8.653 -2.216) 9.166 17.188 ( -0.903 -8.202 -0.994) 8.311 17.231 ( 1.158 15.812 4.141) 16.386 17.870 ( 4.215 -4.198 9.237) 10.987 21.359 ( 0.559 -1.516 4.716) 4.985 21.482 ( -1.210 -2.060 -1.572) 2.860 27.952 ( -1.491 -6.155 -0.201) 6.336 28.078 ( -1.627 -6.795 -3.399) 7.770 37.241 ( -3.060 9.766 2.325) 10.495 37.769 ( 1.624 3.461 7.052) 8.022 37.865 ( 5.065 8.661 -2.852) 10.431 39.303 ( 5.738 -12.817 -25.050) 28.718 ======================= Grid point 179 (79/318) ======================= q-point: (-0.23 0.20 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.447 ( -24.519 9.471 -13.247) 29.435 2.066 ( -20.578 10.912 -2.771) 23.456 3.274 ( 7.715 11.262 3.984) 14.221 3.543 ( -19.861 11.480 -11.039) 25.458 3.706 ( 0.017 16.276 -4.235) 16.818 3.883 ( -27.441 4.341 -7.282) 28.721 4.147 ( -15.414 -3.104 -10.648) 18.990 4.920 ( 11.711 -0.370 13.523) 17.893 5.149 ( 5.433 3.618 2.711) 7.068 5.962 ( 8.142 1.000 4.101) 9.171 6.183 ( 3.037 -3.941 -0.755) 5.032 6.551 ( 1.474 -0.769 10.075) 10.212 6.978 ( 5.012 32.956 -1.438) 33.366 7.546 ( 6.585 27.146 5.707) 28.510 8.219 ( 14.473 1.781 -7.383) 16.345 9.162 ( 10.783 -2.707 -6.090) 12.677 9.387 ( -0.732 -0.241 -2.001) 2.145 10.951 ( -0.477 -21.344 1.017) 21.373 16.797 ( -1.976 6.558 -2.022) 7.141 17.148 ( -2.101 -7.461 -2.232) 8.066 17.271 ( 0.949 11.768 2.549) 12.079 17.971 ( 1.245 -7.331 6.312) 9.754 21.400 ( -0.107 -3.281 6.839) 7.586 21.452 ( -1.063 -1.668 -1.510) 2.488 27.924 ( -1.210 -5.285 -0.446) 5.440 28.029 ( -1.716 -6.481 -2.294) 7.086 37.214 ( -1.826 7.542 3.674) 8.586 37.803 ( -2.523 -2.247 7.735) 8.441 37.976 ( 8.294 17.760 -1.838) 19.687 39.255 ( 8.454 -4.138 -35.162) 36.400 ======================= Grid point 180 (80/318) ======================= q-point: (-0.15 0.20 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.081 ( -8.027 21.556 4.779) 23.493 1.713 ( -16.335 20.555 3.849) 26.536 2.992 ( -29.241 25.550 -14.735) 41.533 3.394 ( -2.711 16.096 2.083) 16.455 3.419 ( -14.087 14.045 -6.218) 20.842 3.588 ( -8.679 10.862 0.220) 13.905 3.956 ( 1.045 3.865 -6.548) 7.675 5.227 ( 8.402 0.533 11.232) 14.037 5.286 ( 11.696 3.467 -3.369) 12.656 6.089 ( -1.132 0.630 9.329) 9.418 6.209 ( 0.733 -1.326 7.625) 7.774 6.672 ( 4.660 -2.979 8.613) 10.235 7.047 ( 2.203 29.864 -2.836) 30.079 7.655 ( 3.098 14.572 0.373) 14.903 8.527 ( 22.611 4.944 -2.358) 23.265 9.277 ( 6.848 -3.295 -10.052) 12.602 9.447 ( 6.541 4.499 7.685) 11.049 10.831 ( -11.565 -19.543 -7.919) 24.050 16.755 ( -1.243 4.146 -1.563) 4.602 17.102 ( -1.108 -4.193 -1.746) 4.675 17.294 ( 0.778 6.852 -0.025) 6.896 17.979 ( -3.234 -10.140 1.979) 10.826 21.420 ( -2.566 -4.679 5.232) 7.473 21.431 ( -0.713 -2.356 1.874) 3.094 27.905 ( -0.280 -4.580 -0.922) 4.680 27.991 ( -1.576 -5.959 -0.252) 6.169 37.210 ( -1.026 2.141 2.908) 3.754 37.767 ( -5.261 -5.156 4.183) 8.471 38.141 ( 8.543 21.120 3.623) 23.068 39.228 ( 15.370 13.250 -43.104) 47.642 ======================= Grid point 181 (81/318) ======================= q-point: (-0.08 0.20 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.164 ( -0.272 20.152 26.318) 33.149 1.575 ( -1.671 33.148 8.894) 34.361 2.433 ( -18.526 31.769 -5.720) 37.219 3.117 ( -14.121 12.209 1.103) 18.700 3.260 ( -3.777 12.050 -15.224) 19.779 3.603 ( 3.404 28.743 3.924) 29.208 3.997 ( 4.006 7.234 -0.611) 8.292 5.260 ( -1.373 1.315 -8.378) 8.591 5.541 ( 8.316 1.222 5.418) 10.000 6.077 ( -5.879 0.982 14.154) 15.358 6.284 ( 3.407 -1.831 0.233) 3.875 6.784 ( -1.057 -5.389 12.700) 13.837 7.013 ( -1.812 31.647 -1.908) 31.756 7.707 ( 3.418 7.484 -0.081) 8.228 8.933 ( 20.244 -2.417 -9.751) 22.600 9.321 ( 4.156 -1.579 -9.711) 10.680 9.780 ( 19.602 3.646 22.495) 30.059 10.419 ( -23.398 -7.878 -10.897) 26.986 16.736 ( -0.022 2.414 -0.553) 2.476 17.095 ( 0.807 -0.413 -0.458) 1.016 17.302 ( 1.259 1.688 -3.380) 3.982 17.878 ( -6.846 -10.765 -2.378) 12.977 21.377 ( -5.603 -5.087 5.160) 9.160 21.426 ( -0.803 -2.094 1.712) 2.821 27.910 ( 1.470 -4.284 -0.573) 4.565 27.966 ( -1.457 -5.417 1.391) 5.780 37.193 ( -1.689 -3.483 -1.878) 4.302 37.665 ( -6.464 -6.808 0.236) 9.391 38.291 ( 3.520 20.337 4.729) 21.174 39.415 ( 31.731 26.997 -35.155) 54.512 ======================= Grid point 182 (82/318) ======================= q-point: ( 0.00 0.30 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.619 ( -1.045 18.972 17.652) 25.935 2.155 ( -9.618 26.597 0.585) 28.289 2.840 ( 10.711 5.902 8.194) 14.720 3.165 ( -0.829 -5.524 -9.876) 11.347 3.423 ( 8.167 25.186 5.790) 27.103 4.123 ( -0.041 14.980 3.312) 15.342 4.407 ( 1.915 22.233 -5.274) 22.930 5.091 ( -8.954 -0.523 -17.538) 19.698 5.613 ( -1.338 0.551 1.229) 1.899 6.118 ( -5.954 0.795 5.632) 8.234 6.211 ( -0.854 -0.283 11.866) 11.900 6.828 ( 1.918 -2.177 17.725) 17.961 7.659 ( 0.458 30.920 -0.770) 30.933 7.919 ( 3.682 7.945 3.671) 9.495 9.081 ( 11.445 -1.894 -10.013) 15.324 9.300 ( 1.464 0.725 -8.962) 9.110 9.737 ( -20.835 4.768 0.450) 21.378 10.372 ( 11.280 -9.632 11.863) 18.994 16.793 ( 0.301 2.760 0.906) 2.921 17.086 ( -2.465 -1.074 -1.705) 3.184 17.296 ( 2.417 -0.205 -4.895) 5.463 17.536 ( -2.616 -11.115 -5.929) 12.866 21.282 ( -2.159 0.521 1.753) 2.829 21.400 ( 0.485 -1.629 0.365) 1.738 27.849 ( -0.199 -4.458 1.484) 4.703 27.868 ( 1.731 -4.415 0.723) 4.797 37.103 ( 0.015 -1.003 -2.317) 2.525 37.413 ( -2.945 -8.031 -1.463) 8.678 38.800 ( 0.609 24.287 2.474) 24.421 39.959 ( 12.612 -0.993 -9.566) 15.861 ======================= Grid point 183 (83/318) ======================= q-point: ( 0.08 0.30 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.759 ( 5.312 18.186 15.980) 24.785 2.077 ( 1.026 20.755 7.578) 22.120 3.085 ( 7.482 -7.251 -6.236) 12.143 3.129 ( 7.884 2.152 -0.443) 8.184 3.793 ( 19.708 25.306 13.599) 34.838 4.081 ( -0.585 12.914 -2.445) 13.157 4.424 ( 0.071 15.619 3.831) 16.082 4.754 ( -13.364 0.676 -23.289) 26.860 5.621 ( 1.637 1.078 1.592) 2.525 6.019 ( -10.699 7.458 8.750) 15.705 6.183 ( -7.435 -2.521 12.543) 14.797 6.909 ( -3.658 -2.908 12.866) 13.688 7.693 ( 2.370 28.934 -0.329) 29.032 8.030 ( 3.985 11.829 5.713) 13.728 9.191 ( 2.675 0.589 -0.861) 2.871 9.240 ( -2.105 8.875 -12.312) 15.322 9.353 ( -15.029 5.217 -0.731) 15.926 10.564 ( 1.433 -18.597 6.069) 19.614 16.809 ( 1.100 -0.085 1.328) 1.727 17.026 ( -1.846 -2.990 -1.888) 3.990 17.316 ( 1.943 2.759 -4.972) 6.009 17.498 ( 2.830 -9.965 -8.492) 13.394 21.266 ( -0.460 1.434 0.734) 1.675 21.417 ( 0.960 -2.041 0.819) 2.399 27.845 ( -0.827 -4.131 1.285) 4.405 27.920 ( 2.580 -5.202 1.862) 6.098 37.111 ( 1.971 0.602 -2.128) 2.963 37.387 ( 1.659 -7.115 -3.328) 8.029 38.775 ( -4.960 24.703 2.912) 25.364 40.029 ( -0.753 -7.499 -4.169) 8.613 ======================= Grid point 184 (84/318) ======================= q-point: ( 0.15 0.30 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.991 ( 9.886 16.349 13.448) 23.364 2.276 ( 12.130 13.175 11.543) 21.307 3.092 ( 2.823 -6.629 -4.705) 8.605 3.434 ( 19.370 -0.179 -0.868) 19.391 3.888 ( -2.587 10.651 -4.497) 11.847 4.322 ( -10.233 1.248 -24.058) 26.174 4.402 ( 10.975 11.060 8.783) 17.887 4.522 ( 9.464 13.542 14.053) 21.690 5.619 ( -10.474 5.440 8.213) 14.379 5.866 ( -3.560 7.135 4.525) 9.169 6.154 ( -3.059 -4.204 10.443) 11.666 6.850 ( -9.505 -5.961 9.937) 14.988 7.705 ( -1.498 27.151 0.211) 27.193 8.066 ( -3.357 20.597 1.253) 20.906 8.970 ( -16.869 14.072 3.728) 22.282 9.183 ( -1.188 0.820 -6.560) 6.717 9.344 ( 7.599 1.522 -0.907) 7.803 10.491 ( -9.246 -19.233 -3.215) 21.581 16.857 ( 3.026 -2.556 1.662) 4.296 16.999 ( -0.361 -3.930 -1.090) 4.094 17.317 ( 2.156 5.040 -5.796) 7.978 17.511 ( 3.415 -6.337 -8.661) 11.262 21.270 ( 0.419 1.558 0.171) 1.623 21.444 ( 1.117 -2.638 1.247) 3.125 27.838 ( -0.499 -4.040 0.824) 4.153 27.979 ( 2.235 -6.292 2.487) 7.125 37.146 ( 3.244 2.220 -2.087) 4.451 37.428 ( 4.630 -4.911 -3.747) 7.720 38.655 ( -9.579 23.204 2.471) 25.225 39.904 ( -10.069 -11.345 -1.398) 15.234 ======================= Grid point 185 (85/318) ======================= q-point: ( 0.23 0.30 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.263 ( 11.552 13.989 9.500) 20.479 2.555 ( 10.268 8.037 6.459) 14.552 3.132 ( 1.330 -3.440 0.952) 3.809 3.779 ( 16.099 7.042 -4.913) 18.246 3.889 ( 3.011 3.942 -12.285) 13.249 3.976 ( -3.174 -5.426 -10.202) 11.983 4.490 ( 1.857 1.213 5.669) 6.088 4.938 ( 11.277 11.716 14.077) 21.508 5.375 ( -14.277 7.616 11.291) 19.731 5.966 ( 8.715 0.242 1.215) 8.803 6.184 ( -0.149 -2.882 9.566) 9.992 6.685 ( -14.110 -9.164 8.704) 18.943 7.635 ( -6.214 27.231 0.587) 27.937 7.948 ( -7.274 25.898 -3.258) 27.097 8.676 ( -17.230 10.445 2.322) 20.282 9.090 ( -5.621 0.090 -4.699) 7.327 9.540 ( 10.466 2.522 7.155) 12.927 10.241 ( -11.423 -15.313 -10.978) 22.034 16.928 ( 3.166 -4.206 0.534) 5.291 16.995 ( 0.670 -1.861 -0.135) 1.983 17.334 ( 3.222 6.680 -5.635) 9.314 17.517 ( 2.197 -1.560 -6.376) 6.922 21.280 ( 0.543 1.396 0.121) 1.503 21.471 ( 0.876 -3.257 1.477) 3.682 27.839 ( 0.199 -4.353 0.533) 4.390 28.027 ( 1.363 -7.305 2.284) 7.774 37.212 ( 5.176 3.487 -1.681) 6.464 37.499 ( 5.002 -1.974 -3.265) 6.291 38.459 ( -12.384 20.232 1.202) 23.752 39.673 ( -13.206 -14.273 -1.044) 19.473 ======================= Grid point 186 (86/318) ======================= q-point: ( 0.31 0.30 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.502 ( 8.655 10.818 5.388) 14.865 2.741 ( 8.621 4.541 1.419) 9.847 3.126 ( -1.636 4.213 0.619) 4.562 3.560 ( -13.248 9.688 -16.006) 22.925 4.028 ( 11.387 9.684 -9.556) 17.742 4.260 ( 19.336 -14.584 3.192) 24.429 4.600 ( 8.079 -6.850 2.762) 10.946 4.916 ( -12.809 14.164 10.266) 21.681 5.412 ( 4.502 -4.021 7.820) 9.879 6.148 ( 9.052 -1.809 0.674) 9.255 6.241 ( -2.169 -2.639 7.166) 7.939 6.466 ( -11.671 -10.339 10.407) 18.746 7.498 ( -7.984 27.996 -0.206) 29.112 7.792 ( -6.939 24.270 -3.673) 25.508 8.357 ( -17.830 10.970 0.401) 20.938 8.927 ( -8.862 -3.086 -2.770) 9.784 9.770 ( 6.985 0.146 10.963) 13.000 9.996 ( -5.170 -8.288 -14.559) 17.532 16.946 ( 0.141 -4.091 -2.178) 4.637 17.049 ( 3.567 -0.080 2.140) 4.161 17.363 ( 3.160 8.764 -4.887) 10.520 17.526 ( 1.694 4.063 -1.991) 4.831 21.290 ( 0.397 1.146 0.314) 1.253 21.491 ( 0.374 -3.695 1.352) 3.952 27.851 ( 0.769 -4.978 0.343) 5.048 28.053 ( 0.284 -7.940 1.366) 8.062 37.316 ( 6.777 4.552 -0.753) 8.198 37.568 ( 4.273 0.473 -2.497) 4.971 38.223 ( -13.003 16.671 -0.338) 21.145 39.427 ( -11.872 -17.166 -2.163) 20.983 ======================= Grid point 187 (87/318) ======================= q-point: ( 0.38 0.30 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.643 ( 4.366 5.754 2.659) 7.697 2.890 ( 6.459 1.939 -2.442) 7.172 3.113 ( -0.090 16.274 -2.255) 16.430 3.259 ( -8.638 5.640 -9.380) 13.943 4.090 ( 3.593 9.074 -10.893) 14.625 4.577 ( 9.964 -9.770 1.578) 14.043 4.771 ( 3.590 9.656 4.901) 11.409 4.845 ( 6.958 -12.507 0.005) 14.312 5.471 ( -1.016 -11.320 1.898) 11.523 5.987 ( -20.415 -2.700 2.225) 20.713 6.344 ( 7.221 -3.354 4.353) 9.074 6.499 ( 3.120 -8.720 7.917) 12.184 7.365 ( -5.419 27.774 0.156) 28.298 7.656 ( -5.723 19.009 -1.918) 19.945 8.043 ( -14.810 14.709 -0.752) 20.887 8.757 ( -7.076 -6.619 -3.141) 10.186 9.789 ( -3.060 -2.490 -6.717) 7.790 10.016 ( 6.551 -2.204 6.178) 9.271 16.938 ( 0.445 -2.395 -1.441) 2.830 17.119 ( 2.390 -1.486 1.468) 3.174 17.397 ( 3.050 12.573 -2.403) 13.159 17.558 ( 1.514 9.023 2.226) 9.416 21.298 ( 0.197 0.866 0.503) 1.020 21.500 ( -0.176 -3.842 0.863) 3.941 27.867 ( 0.727 -5.671 0.038) 5.718 28.055 ( -0.543 -8.167 0.071) 8.185 37.448 ( 7.448 5.509 0.028) 9.265 37.627 ( 3.369 1.953 -1.473) 4.164 37.987 ( -11.608 13.289 -1.485) 17.707 39.221 ( -8.182 -19.628 -4.011) 21.640 ======================= Grid point 188 (88/318) ======================= q-point: ( 0.46 0.30 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.666 ( -3.367 2.749 -3.878) 5.825 2.935 ( 1.642 2.461 -5.395) 6.153 3.034 ( 0.607 16.360 -4.677) 17.026 3.235 ( 3.361 4.800 -0.901) 5.929 4.115 ( 6.571 4.586 -8.746) 11.862 4.609 ( -3.231 5.056 0.190) 6.003 4.857 ( 2.452 -14.435 -3.253) 14.998 5.044 ( 12.333 -1.065 -2.193) 12.572 5.395 ( -6.641 -20.947 -8.001) 23.386 5.623 ( -18.114 3.174 6.116) 19.380 6.437 ( -0.456 -3.801 -0.545) 3.867 6.557 ( -0.422 -6.256 4.377) 7.647 7.332 ( 0.535 26.034 4.152) 26.369 7.569 ( -2.580 11.552 0.283) 11.840 7.849 ( -4.604 20.725 -0.869) 21.248 8.640 ( -2.873 -8.344 -4.852) 10.070 9.713 ( -0.737 2.375 -6.989) 7.418 10.168 ( 4.245 -5.967 10.559) 12.850 16.950 ( 1.266 -1.767 0.168) 2.180 17.148 ( 0.203 -2.230 0.374) 2.270 17.452 ( 3.067 15.983 1.282) 16.325 17.604 ( 1.143 11.094 5.183) 12.298 21.304 ( 0.057 0.579 0.672) 0.889 21.495 ( -0.609 -3.727 0.167) 3.780 27.874 ( 0.077 -6.199 -0.385) 6.211 28.037 ( -0.872 -8.167 -1.247) 8.307 37.584 ( 6.797 6.058 -0.000) 9.105 37.673 ( 1.642 4.080 0.130) 4.400 37.792 ( -7.305 9.538 -1.903) 12.164 39.080 ( -3.710 -20.907 -6.427) 22.185 ======================= Grid point 189 (89/318) ======================= q-point: (-0.46 0.30 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.519 ( -5.626 3.715 -8.755) 11.051 2.921 ( 0.985 3.724 -6.404) 7.474 3.054 ( -2.105 4.812 -2.531) 5.830 3.323 ( 9.524 5.147 -0.727) 10.850 4.222 ( 8.532 3.804 -5.452) 10.816 4.532 ( -2.410 2.541 -4.773) 5.920 4.786 ( -7.819 -15.162 -4.981) 17.772 5.004 ( -15.789 -6.092 -6.781) 18.232 5.308 ( 3.245 -12.734 -7.687) 15.224 5.491 ( 2.553 5.376 4.399) 7.401 6.313 ( -8.478 -1.083 -7.494) 11.367 6.550 ( -4.441 -4.359 7.302) 9.594 7.400 ( 2.741 25.327 5.361) 26.033 7.592 ( 4.866 8.362 1.137) 9.741 7.859 ( 5.140 22.615 -0.845) 23.207 8.602 ( 2.726 -8.516 -6.229) 10.897 9.666 ( -0.781 5.475 -5.402) 7.731 10.301 ( 3.083 -9.800 11.888) 15.711 16.982 ( 1.494 -1.842 1.391) 2.750 17.132 ( -1.989 -1.413 -0.195) 2.447 17.514 ( 1.713 17.178 3.537) 17.622 17.664 ( 1.398 9.213 7.463) 11.939 21.309 ( 0.073 0.265 1.000) 1.038 21.480 ( -0.850 -3.433 -0.507) 3.573 27.865 ( -0.633 -6.394 -0.663) 6.460 28.010 ( -0.925 -8.085 -2.371) 8.476 37.586 ( -6.171 7.714 -0.053) 9.878 37.713 ( 2.864 5.302 1.713) 6.264 37.786 ( 6.598 6.123 -1.646) 9.151 39.006 ( 0.871 -20.440 -9.692) 22.638 ======================= Grid point 190 (90/318) ======================= q-point: (-0.38 0.30 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.380 ( -5.200 3.220 -9.581) 11.367 2.822 ( -12.005 -1.044 -6.890) 13.881 2.958 ( 1.625 4.119 -4.564) 6.359 3.564 ( 15.087 2.019 -4.054) 15.752 4.329 ( 5.908 9.998 -8.701) 14.511 4.473 ( -7.577 -7.982 -5.008) 12.092 4.547 ( -5.753 -5.316 1.356) 7.950 4.699 ( -14.898 -3.472 1.916) 15.417 5.224 ( -4.847 -5.391 -5.595) 9.157 5.677 ( 12.897 -3.200 -9.264) 16.199 6.108 ( -7.323 4.299 -4.889) 9.798 6.495 ( -6.574 -5.047 10.707) 13.540 7.481 ( 3.109 27.424 3.841) 27.865 7.744 ( 10.242 9.698 0.938) 14.136 7.980 ( 8.194 21.133 -3.947) 23.007 8.679 ( 9.603 -8.074 -6.343) 14.058 9.608 ( -2.695 7.428 -3.811) 8.772 10.425 ( 2.789 -12.929 11.465) 17.504 17.013 ( 0.734 -1.008 1.265) 1.776 17.074 ( -3.936 -1.856 -0.253) 4.359 17.547 ( -0.521 16.643 3.941) 17.111 17.743 ( 1.684 4.517 8.726) 9.969 21.319 ( 0.202 -0.152 1.666) 1.685 21.459 ( -0.902 -3.009 -0.972) 3.288 27.847 ( -0.868 -6.219 -0.556) 6.304 27.975 ( -1.036 -7.844 -3.171) 8.524 37.476 ( -5.731 7.132 1.210) 9.229 37.756 ( -0.081 0.806 4.614) 4.684 37.937 ( 10.501 11.042 -3.336) 15.599 38.997 ( 5.686 -17.684 -14.059) 23.296 ======================= Grid point 191 (91/318) ======================= q-point: (-0.31 0.30 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.098 ( -17.473 6.449 -15.883) 24.478 2.554 ( -11.101 4.592 -4.708) 12.903 3.060 ( 9.683 -2.722 2.243) 10.305 3.731 ( 6.584 -1.362 -15.018) 16.454 4.146 ( -13.986 5.170 -1.506) 14.987 4.394 ( -10.953 -2.091 -1.783) 11.292 4.428 ( -0.171 10.282 -11.250) 15.242 4.677 ( 4.568 1.459 18.400) 19.015 5.112 ( -2.272 -2.416 -1.659) 3.709 5.780 ( 8.953 -6.786 -17.801) 21.049 6.056 ( 0.993 1.407 3.097) 3.544 6.450 ( -5.556 -6.253 12.969) 15.433 7.564 ( 3.913 29.656 2.396) 30.009 7.962 ( 10.831 16.069 3.214) 19.643 8.093 ( 9.176 15.041 -10.943) 20.740 8.863 ( 13.572 -7.340 -7.197) 17.026 9.528 ( -3.753 8.886 -0.928) 9.691 10.532 ( 1.944 -14.999 8.935) 17.566 16.977 ( -4.717 2.161 -1.453) 5.388 17.034 ( -0.474 -4.999 1.601) 5.271 17.542 ( -2.292 14.132 3.111) 14.651 17.815 ( 0.268 -0.686 8.011) 8.045 21.336 ( 0.144 -0.760 2.642) 2.753 21.437 ( -0.825 -2.483 -1.161) 2.862 27.830 ( -0.684 -5.725 -0.215) 5.770 27.935 ( -1.124 -7.308 -3.387) 8.133 37.387 ( -5.194 5.413 2.431) 7.886 37.763 ( -2.806 -2.276 6.312) 7.273 38.128 ( 12.323 14.907 -3.708) 19.693 39.053 ( 11.015 -11.908 -18.971) 24.961 ======================= Grid point 192 (92/318) ======================= q-point: (-0.23 0.30 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.690 ( -13.723 15.179 -10.885) 23.178 2.324 ( -12.058 14.575 -0.629) 18.927 3.294 ( 8.944 -9.887 8.570) 15.849 3.621 ( -5.796 -2.815 -16.929) 18.114 3.865 ( -15.255 6.215 -0.701) 16.488 4.184 ( -16.273 14.526 -17.358) 27.877 4.282 ( 1.029 20.247 -0.692) 20.285 4.933 ( 11.741 1.423 15.305) 19.342 5.202 ( 8.115 1.424 5.036) 9.656 5.888 ( 10.859 -7.759 -7.871) 15.494 6.090 ( -0.917 -4.170 6.788) 8.019 6.447 ( -1.705 -9.071 8.906) 12.826 7.653 ( 4.206 30.163 1.609) 30.498 8.057 ( -1.309 23.591 -2.152) 23.725 8.291 ( 18.527 5.285 -9.298) 21.393 9.060 ( 12.423 -6.151 -9.410) 16.755 9.491 ( -0.391 10.013 4.214) 10.871 10.584 ( -1.245 -15.524 4.470) 16.203 16.879 ( -4.505 0.721 -1.324) 4.751 17.035 ( -0.135 -2.699 1.063) 2.904 17.501 ( -3.475 10.356 1.136) 10.982 17.834 ( -2.655 -5.666 5.345) 8.229 21.352 ( -0.574 -1.518 3.601) 3.949 21.416 ( -0.660 -1.930 -1.137) 2.336 27.819 ( -0.413 -5.033 -0.177) 5.053 27.897 ( -0.906 -6.517 -2.582) 7.069 37.307 ( -5.100 2.980 2.401) 6.376 37.720 ( -5.768 -5.973 5.993) 10.241 38.345 ( 12.765 18.456 -2.247) 22.553 39.185 ( 16.686 -3.333 -22.474) 28.189 ======================= Grid point 193 (93/318) ======================= q-point: (-0.15 0.30 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.542 ( -2.028 24.169 6.719) 25.168 2.148 ( -6.193 22.638 5.237) 24.048 3.216 ( -16.832 -4.791 -12.299) 21.390 3.445 ( -9.173 -6.451 3.899) 11.872 3.689 ( -12.051 18.484 -7.167) 23.200 3.847 ( 2.818 13.220 -5.303) 14.520 4.343 ( 5.353 27.318 -3.887) 28.108 5.247 ( 8.657 1.608 14.635) 17.079 5.362 ( 10.267 3.584 -4.685) 11.841 6.000 ( 1.454 -8.335 2.978) 8.970 6.158 ( 2.089 -2.753 11.276) 11.794 6.506 ( 3.884 -11.430 6.723) 13.818 7.724 ( 1.724 30.395 1.614) 30.487 7.952 ( -5.836 17.132 -5.612) 18.949 8.601 ( 19.837 2.886 -9.023) 21.983 9.206 ( 9.367 -3.781 -9.369) 13.777 9.587 ( 6.494 9.418 10.248) 15.359 10.515 ( -7.904 -12.827 -0.612) 15.079 16.807 ( -2.341 1.382 -0.696) 2.806 17.050 ( 1.254 -1.087 1.115) 2.000 17.428 ( -4.113 5.907 -1.878) 7.439 17.776 ( -5.771 -9.671 1.471) 11.358 21.350 ( -2.104 -1.914 3.764) 4.718 21.401 ( -0.325 -1.524 -0.755) 1.732 27.813 ( 0.160 -4.378 -0.477) 4.407 27.874 ( -0.592 -5.664 -0.843) 5.757 37.224 ( -4.816 0.347 0.675) 4.876 37.624 ( -7.492 -8.521 3.775) 11.958 38.560 ( 10.693 20.786 0.040) 23.375 39.409 ( 21.563 4.590 -21.870) 31.053 ======================= Grid point 194 (94/318) ======================= q-point: (-0.08 0.30 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.573 ( -3.728 21.149 16.012) 26.788 2.202 ( 3.844 29.287 9.613) 31.063 2.821 ( -13.945 7.678 -5.634) 16.887 3.279 ( -5.831 -5.903 -9.257) 12.431 3.427 ( -7.746 18.426 -1.743) 20.064 4.017 ( 7.437 13.111 6.525) 16.425 4.399 ( 4.032 27.464 -7.931) 28.869 5.279 ( -3.487 0.418 -6.886) 7.731 5.577 ( 6.385 1.831 4.334) 7.931 6.077 ( 4.223 -2.341 10.531) 11.585 6.189 ( -2.843 -4.031 2.047) 5.341 6.666 ( 4.259 -6.324 16.644) 18.307 7.701 ( -3.824 33.159 -0.514) 33.382 7.870 ( 0.332 8.794 -1.099) 8.869 8.885 ( 16.802 -1.386 -11.556) 20.440 9.291 ( 5.257 -1.757 -8.432) 10.091 9.834 ( 8.798 2.689 14.404) 17.091 10.301 ( -11.398 -4.840 -1.844) 12.520 16.785 ( -0.121 2.896 0.248) 2.909 17.090 ( 1.902 -0.236 0.749) 2.058 17.335 ( -3.116 1.342 -4.942) 5.995 17.652 ( -6.533 -11.432 -2.473) 13.397 21.320 ( -3.063 -1.062 2.864) 4.326 21.395 ( -0.000 -1.464 -0.084) 1.466 27.824 ( 1.276 -4.122 -0.023) 4.315 27.863 ( -0.561 -4.936 0.550) 4.998 37.144 ( -3.144 -1.267 -1.537) 3.722 37.504 ( -6.447 -8.723 1.068) 10.899 38.724 ( 6.173 22.575 1.558) 23.455 39.706 ( 21.630 5.490 -16.481) 27.742 ======================= Grid point 195 (95/318) ======================= q-point: ( 0.00 0.40 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.001 ( -0.153 19.459 10.102) 21.925 2.562 ( -7.590 8.652 -4.325) 12.295 2.816 ( 2.593 -2.019 3.267) 4.634 3.075 ( -2.035 -2.854 -0.250) 3.514 3.858 ( 9.856 18.451 4.797) 21.462 4.256 ( 1.474 -0.399 3.424) 3.749 4.800 ( -2.255 15.537 -11.711) 19.586 5.079 ( -8.014 -1.294 -15.298) 17.318 5.650 ( -0.116 3.836 2.480) 4.569 5.969 ( -0.391 -10.140 2.341) 10.414 6.383 ( -1.846 11.553 17.190) 20.793 6.749 ( 0.885 -5.737 19.019) 19.886 8.051 ( 2.626 8.894 0.840) 9.312 8.129 ( 2.212 10.748 0.965) 11.016 9.104 ( 9.491 4.895 -6.687) 12.600 9.299 ( 3.524 -1.395 -5.443) 6.632 9.854 ( -11.514 7.219 1.909) 13.723 10.194 ( 1.715 -8.767 6.276) 10.917 16.865 ( -1.764 4.605 -0.192) 4.935 17.056 ( -3.618 -2.545 -1.948) 4.833 17.282 ( 3.013 -1.033 -4.448) 5.471 17.344 ( -1.008 -7.272 -5.982) 9.470 21.302 ( -0.805 1.360 0.701) 1.729 21.367 ( 0.230 -1.736 0.169) 1.759 27.779 ( 0.132 -2.414 1.326) 2.758 27.793 ( 1.203 -2.945 0.971) 3.326 37.102 ( -0.126 1.188 -1.292) 1.760 37.264 ( -2.098 -6.778 -1.196) 7.195 39.257 ( 1.922 21.401 1.400) 21.533 39.865 ( 6.038 -8.487 -4.139) 11.209 ======================= Grid point 196 (96/318) ======================= q-point: ( 0.08 0.40 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.109 ( 4.615 17.380 11.421) 21.303 2.459 ( -1.024 15.126 0.653) 15.175 2.873 ( 3.233 -10.315 -2.066) 11.005 3.105 ( 5.597 -5.413 1.847) 8.002 4.139 ( 12.612 10.475 2.219) 16.544 4.239 ( -0.198 3.765 -4.868) 6.158 4.694 ( -3.671 10.686 -1.869) 11.452 4.809 ( -10.252 3.510 -13.904) 17.628 5.676 ( 1.559 4.883 3.101) 5.991 5.985 ( 0.250 -7.618 5.122) 9.183 6.321 ( -14.841 12.625 16.799) 25.726 6.779 ( -8.673 -9.109 15.931) 20.297 8.112 ( 2.513 13.177 0.870) 13.442 8.247 ( 7.113 8.002 3.512) 11.268 9.204 ( 3.456 3.078 -1.868) 4.991 9.313 ( 0.938 0.202 -3.855) 3.973 9.610 ( -12.577 16.296 -1.750) 20.659 10.234 ( -1.929 -15.490 3.493) 15.996 16.812 ( -2.122 1.240 -1.272) 2.768 16.969 ( -3.118 -4.031 -2.982) 5.904 17.334 ( 3.961 -0.900 -5.508) 6.844 17.363 ( 6.468 -2.827 -6.050) 9.297 21.298 ( -0.005 1.796 0.341) 1.828 21.376 ( 0.592 -2.092 0.404) 2.211 27.783 ( -0.416 -1.842 1.423) 2.364 27.828 ( 1.448 -3.839 1.815) 4.487 37.122 ( 2.816 1.019 -1.458) 3.331 37.255 ( 2.521 -5.856 -2.524) 6.857 39.235 ( -5.570 21.322 2.451) 22.173 39.860 ( -4.780 -10.326 -1.353) 11.459 ======================= Grid point 197 (97/318) ======================= q-point: ( 0.15 0.40 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.291 ( 7.435 13.816 11.978) 19.739 2.542 ( 6.832 11.411 4.820) 14.146 2.931 ( 5.099 -6.247 0.462) 8.077 3.310 ( 14.032 -11.424 2.717) 18.298 4.066 ( -3.629 7.789 -15.562) 17.777 4.279 ( -2.986 -3.115 -22.369) 22.781 4.629 ( -4.816 9.774 6.705) 12.794 4.757 ( 8.919 7.140 13.520) 17.701 5.732 ( 0.211 7.062 4.973) 8.640 6.033 ( -0.226 -0.549 5.422) 5.454 6.097 ( -15.235 7.571 14.451) 22.322 6.642 ( -14.451 -13.561 12.824) 23.605 8.133 ( -0.998 15.754 0.391) 15.790 8.348 ( 0.792 6.796 1.280) 6.960 9.157 ( -12.395 4.773 4.669) 14.079 9.228 ( -5.005 1.597 -7.423) 9.094 9.518 ( 4.704 16.415 0.698) 17.090 10.157 ( -6.139 -15.096 -2.084) 16.429 16.800 ( 1.361 -1.429 -0.429) 2.019 16.920 ( -0.339 -5.089 -2.199) 5.554 17.384 ( 5.224 2.339 -6.529) 8.683 17.450 ( 6.588 -0.831 -6.476) 9.275 21.304 ( 0.367 1.907 0.190) 1.951 21.392 ( 0.706 -2.530 0.649) 2.706 27.783 ( -0.475 -1.304 1.233) 1.856 27.864 ( 1.081 -5.014 2.195) 5.579 37.181 ( 4.609 1.899 -1.859) 5.321 37.324 ( 6.149 -5.218 -2.587) 8.470 39.085 ( -11.838 19.905 2.356) 23.279 39.687 ( -12.778 -11.333 0.023) 17.080 ======================= Grid point 198 (98/318) ======================= q-point: ( 0.23 0.40 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.519 ( 9.794 10.845 9.169) 17.251 2.690 ( 5.167 4.287 5.119) 8.443 3.095 ( 8.861 2.528 4.917) 10.444 3.610 ( 15.047 -15.926 2.583) 22.061 3.968 ( 3.094 3.150 -16.964) 17.529 4.005 ( -6.301 1.954 -17.365) 18.576 4.603 ( -3.594 10.487 7.685) 13.489 5.051 ( 11.094 -3.469 11.138) 16.099 5.601 ( -19.066 17.014 10.614) 27.670 6.004 ( 2.717 3.581 5.141) 6.828 6.119 ( 1.976 -3.552 6.768) 7.895 6.423 ( -15.801 -16.405 9.796) 24.795 8.074 ( -5.427 16.605 -0.226) 17.471 8.284 ( -7.051 7.915 -1.372) 10.689 8.873 ( -16.502 8.444 -0.268) 18.539 9.070 ( -9.992 -2.319 -3.493) 10.836 9.674 ( 8.076 10.166 5.404) 14.064 10.019 ( -5.004 -7.856 -6.377) 11.288 16.842 ( 2.630 -2.604 0.061) 3.701 16.928 ( 2.058 -4.894 -0.718) 5.357 17.450 ( 6.061 5.104 -6.317) 10.134 17.532 ( 6.410 1.376 -5.619) 8.634 21.312 ( 0.331 1.869 0.240) 1.913 21.408 ( 0.541 -2.994 0.812) 3.149 27.782 ( -0.230 -1.087 0.978) 1.480 27.891 ( 0.522 -6.055 1.982) 6.392 37.273 ( 6.477 3.186 -1.780) 7.434 37.436 ( 7.042 -4.220 -2.166) 8.491 38.838 ( -15.520 17.725 1.325) 23.596 39.413 ( -16.187 -12.599 -0.048) 20.513 ======================= Grid point 199 (99/318) ======================= q-point: ( 0.31 0.40 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.717 ( 5.475 9.630 4.508) 11.960 2.818 ( 6.637 2.912 2.811) 7.774 3.218 ( 2.809 6.400 1.094) 7.074 3.624 ( -9.124 -4.809 -12.199) 15.975 4.028 ( 18.163 -5.971 0.945) 19.142 4.151 ( 16.768 -1.395 -6.123) 17.905 4.565 ( -3.915 8.632 2.493) 9.801 5.220 ( -2.467 -14.594 4.290) 15.411 5.305 ( -13.287 22.626 9.658) 27.960 6.113 ( -1.465 -7.793 8.971) 11.973 6.156 ( -3.651 -3.672 0.945) 5.264 6.246 ( -0.730 -7.607 7.365) 10.614 7.936 ( -8.642 15.766 -1.026) 18.008 8.098 ( -11.509 7.775 -1.389) 13.958 8.584 ( -13.507 9.868 -1.984) 16.845 8.831 ( -12.466 -5.722 -3.010) 14.043 9.832 ( 3.602 5.189 5.956) 8.682 9.928 ( 0.430 -0.148 -5.930) 5.948 16.880 ( 1.570 -1.690 -0.330) 2.330 16.979 ( 2.987 -5.195 0.577) 6.020 17.534 ( 6.466 7.773 -4.447) 11.046 17.626 ( 6.445 3.906 -2.971) 8.101 21.318 ( 0.150 1.755 0.338) 1.794 21.420 ( 0.223 -3.372 0.777) 3.468 27.786 ( 0.057 -1.304 0.632) 1.450 27.905 ( -0.095 -6.661 1.213) 6.771 37.397 ( 7.711 3.993 -1.186) 8.764 37.550 ( 6.345 -2.478 -1.703) 7.022 38.544 ( -16.100 15.505 -0.087) 22.353 39.112 ( -15.285 -14.709 -1.109) 21.242 ======================= Grid point 200 (100/318) ======================= q-point: ( 0.38 0.40 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.771 ( -0.417 6.604 0.808) 6.666 2.916 ( 2.260 0.123 -2.271) 3.206 3.274 ( 3.385 5.862 -2.167) 7.108 3.437 ( -1.628 5.798 -9.724) 11.437 4.324 ( 0.738 13.652 -9.401) 16.592 4.363 ( 14.291 -7.703 2.975) 16.505 4.587 ( 9.733 -10.420 1.873) 14.381 5.009 ( -11.874 -0.525 0.222) 11.888 5.268 ( -3.264 2.452 2.583) 4.831 5.887 ( -16.230 -9.733 4.702) 19.500 6.283 ( 6.861 -2.498 4.875) 8.779 6.338 ( 3.291 -5.844 5.082) 8.415 7.766 ( -8.074 12.296 -1.144) 14.754 7.868 ( -11.924 5.847 0.150) 13.281 8.365 ( -8.470 13.318 -2.126) 15.926 8.616 ( -8.186 -5.956 -3.195) 10.615 9.843 ( -0.395 5.925 -2.091) 6.295 9.991 ( 3.606 -0.825 4.322) 5.689 16.903 ( 1.103 -0.364 0.117) 1.167 17.031 ( 1.938 -5.622 0.786) 5.998 17.634 ( 5.918 10.191 -1.234) 11.849 17.729 ( 5.285 6.209 0.187) 8.156 21.321 ( -0.026 1.582 0.352) 1.621 21.425 ( -0.121 -3.569 0.501) 3.606 27.789 ( 0.038 -1.821 0.081) 1.823 27.902 ( -0.587 -6.802 0.083) 6.828 37.539 ( 7.984 4.033 -0.651) 8.969 37.646 ( 4.916 -0.351 -1.187) 5.070 38.259 ( -13.811 13.948 -1.257) 19.669 38.852 ( -11.171 -17.325 -2.648) 20.784 ======================= Grid point 201 (101/318) ======================= q-point: ( 0.46 0.40 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.732 ( -3.073 4.147 -2.837) 5.890 2.902 ( 0.109 -3.243 -3.597) 4.844 3.279 ( 1.035 8.470 -9.248) 12.584 3.420 ( 2.213 8.976 -8.812) 12.772 4.242 ( 1.171 8.360 -9.307) 12.565 4.559 ( 4.825 -5.014 1.717) 7.167 4.679 ( -6.124 -6.869 -4.786) 10.373 4.904 ( 4.971 -18.212 -5.395) 19.634 5.216 ( -2.208 9.173 0.053) 9.435 5.631 ( -12.929 -3.559 4.119) 14.029 6.367 ( -1.130 -2.762 1.689) 3.429 6.432 ( 2.798 -5.651 6.485) 9.046 7.655 ( -3.174 5.849 -0.276) 6.660 7.711 ( -4.136 6.778 2.649) 8.370 8.256 ( -1.963 15.619 -1.420) 15.805 8.496 ( -2.688 -4.375 -3.571) 6.254 9.832 ( 0.283 8.029 -1.473) 8.168 10.073 ( 1.938 -4.139 6.241) 7.735 16.925 ( 0.911 0.073 1.165) 1.481 17.059 ( 0.630 -5.482 0.886) 5.589 17.729 ( 3.875 11.355 2.035) 12.169 17.815 ( 2.794 7.823 2.866) 8.787 21.322 ( -0.117 1.362 0.301) 1.400 21.422 ( -0.395 -3.546 0.068) 3.569 27.786 ( -0.306 -2.345 -0.594) 2.438 27.886 ( -0.812 -6.694 -1.118) 6.835 37.673 ( 6.202 3.169 -0.377) 6.975 37.714 ( 2.732 1.140 -0.380) 2.984 38.039 ( -7.903 13.834 -1.997) 16.057 38.678 ( -5.065 -19.226 -4.607) 20.409 ======================= Grid point 202 (102/318) ======================= q-point: (-0.46 0.40 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.623 ( -4.601 6.876 -9.097) 12.296 2.897 ( 0.490 -4.469 -4.956) 6.692 3.192 ( -3.901 8.028 -11.601) 14.637 3.404 ( 4.627 1.432 -10.330) 11.409 4.287 ( 7.078 0.341 -6.583) 9.672 4.473 ( -5.721 -8.281 -11.791) 15.502 4.585 ( -3.443 -0.814 1.042) 3.688 4.912 ( -2.388 -6.859 -3.691) 8.146 5.182 ( -2.457 3.273 -1.336) 4.305 5.512 ( -0.980 -3.764 0.313) 3.902 6.302 ( -5.737 1.078 0.630) 5.871 6.458 ( -4.162 -4.905 6.910) 9.441 7.672 ( 5.763 3.709 -0.583) 6.878 7.745 ( 4.230 7.569 3.957) 9.531 8.273 ( 4.164 15.132 -0.763) 15.713 8.472 ( 2.739 -2.874 -4.419) 5.941 9.829 ( -0.212 9.683 -0.533) 9.700 10.143 ( 1.349 -6.710 7.543) 10.185 16.948 ( 0.339 -0.474 2.077) 2.158 17.063 ( -0.871 -4.798 0.864) 4.952 17.794 ( 0.871 10.975 4.499) 11.893 17.863 ( -0.082 8.086 4.726) 9.367 21.322 ( -0.062 1.091 0.345) 1.146 21.412 ( -0.518 -3.303 -0.346) 3.361 27.772 ( -0.594 -2.649 -1.088) 2.925 27.861 ( -0.804 -6.503 -2.115) 6.886 37.697 ( -4.278 3.849 0.534) 5.780 37.750 ( 0.827 0.704 1.329) 1.716 38.004 ( 6.296 12.948 -3.373) 14.788 38.615 ( 2.120 -18.661 -7.362) 20.173 ======================= Grid point 203 (103/318) ======================= q-point: (-0.38 0.40 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.475 ( -4.039 6.325 -13.355) 15.319 2.753 ( -11.040 -5.593 -10.624) 16.311 3.083 ( 0.715 8.694 -8.827) 12.410 3.506 ( 11.285 -7.712 -10.755) 17.392 4.309 ( -4.018 -5.812 -0.830) 7.114 4.373 ( -1.281 -7.609 -3.536) 8.488 4.556 ( 4.395 11.291 -1.877) 12.261 4.838 ( -2.442 9.098 -0.563) 9.437 5.100 ( -4.468 -4.170 -3.688) 7.138 5.533 ( 4.231 -11.195 -8.469) 14.661 6.191 ( -6.387 4.464 1.796) 7.997 6.389 ( -7.371 -5.411 8.529) 12.504 7.836 ( 11.209 4.621 -2.172) 12.317 7.876 ( 7.879 10.056 2.256) 12.973 8.378 ( 6.719 14.188 -1.289) 15.751 8.551 ( 9.198 -3.315 -5.507) 11.222 9.810 ( -1.837 11.880 0.446) 12.029 10.215 ( 1.269 -9.009 8.265) 12.291 16.957 ( -0.966 -1.639 2.302) 2.986 17.036 ( -2.324 -3.483 0.594) 4.229 17.810 ( -2.431 9.665 5.269) 11.273 17.870 ( -2.408 6.221 5.852) 8.874 21.325 ( 0.082 0.750 0.627) 0.981 21.400 ( -0.478 -2.862 -0.589) 2.961 27.754 ( -0.485 -2.729 -1.141) 2.997 27.832 ( -0.690 -6.144 -2.718) 6.753 37.593 ( -6.641 5.119 1.687) 8.553 37.746 ( -2.742 -1.786 3.406) 4.723 38.170 ( 12.948 11.889 -4.735) 18.205 38.671 ( 9.568 -14.979 -10.593) 20.691 ======================= Grid point 204 (104/318) ======================= q-point: (-0.31 0.40 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.246 ( -10.669 8.677 -15.764) 20.920 2.588 ( -0.142 -3.338 -3.026) 4.507 3.055 ( -0.477 5.232 -4.162) 6.702 3.574 ( 1.514 -13.747 -14.401) 19.967 4.203 ( -5.632 5.454 0.309) 7.846 4.379 ( 2.567 -1.025 1.322) 3.064 4.700 ( 9.063 6.481 5.630) 12.484 4.825 ( -2.392 19.371 -2.646) 19.696 5.014 ( 1.726 -7.432 -0.413) 7.641 5.570 ( 8.053 -14.208 -15.219) 22.324 6.098 ( -5.425 2.963 4.086) 7.410 6.305 ( -7.220 -7.539 9.428) 14.066 7.983 ( 6.187 12.149 -0.420) 13.640 8.099 ( 14.754 5.038 -2.932) 15.864 8.474 ( 5.208 14.937 -4.410) 16.423 8.736 ( 13.718 -4.700 -6.802) 16.017 9.771 ( -2.937 14.484 2.460) 14.982 10.282 ( 0.664 -11.161 7.750) 13.604 16.929 ( -3.262 -1.842 1.381) 3.992 17.000 ( -1.660 -2.623 1.071) 3.284 17.764 ( -5.373 8.098 4.048) 10.528 17.842 ( -4.452 2.428 5.710) 7.637 21.332 ( 0.076 0.349 1.109) 1.165 21.388 ( -0.373 -2.298 -0.628) 2.411 27.743 ( -0.098 -2.692 -0.819) 2.816 27.805 ( -0.475 -5.468 -2.780) 6.153 37.480 ( -6.888 4.591 2.436) 8.628 37.688 ( -5.885 -5.037 4.387) 8.902 38.409 ( 15.788 13.119 -5.236) 21.185 38.840 ( 15.981 -9.936 -12.857) 22.790 ======================= Grid point 205 (105/318) ======================= q-point: (-0.23 0.40 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.037 ( -3.461 19.470 -5.173) 20.441 2.584 ( -2.143 7.776 1.129) 8.145 3.039 ( -0.441 -10.249 1.648) 10.390 3.421 ( -8.267 -14.260 -6.630) 17.767 4.100 ( -2.785 14.092 -7.781) 16.337 4.362 ( -6.974 4.441 -12.185) 14.725 4.730 ( 0.690 20.274 2.619) 20.454 4.971 ( 12.080 2.351 17.023) 21.005 5.207 ( 13.016 0.231 2.343) 13.228 5.664 ( 11.791 -14.458 -15.683) 24.373 6.049 ( -2.963 0.139 8.067) 8.595 6.245 ( -4.408 -9.879 8.528) 13.775 8.068 ( 3.456 13.330 -1.797) 13.887 8.314 ( 6.700 0.938 -1.629) 6.958 8.540 ( 9.054 18.593 -10.256) 23.084 8.947 ( 13.316 -5.478 -8.254) 16.597 9.752 ( -1.127 15.552 5.696) 16.601 10.320 ( -1.301 -12.245 5.966) 13.683 16.870 ( -3.093 0.291 0.807) 3.210 16.991 ( -0.183 -3.244 1.699) 3.667 17.663 ( -7.242 5.929 1.513) 9.481 17.765 ( -6.974 -1.619 3.499) 7.968 21.338 ( -0.351 0.008 1.546) 1.585 21.379 ( -0.314 -1.763 -0.545) 1.872 27.740 ( 0.217 -2.554 -0.499) 2.611 27.784 ( -0.101 -4.596 -2.115) 5.061 37.365 ( -7.017 3.409 2.048) 8.066 37.584 ( -7.804 -7.238 3.905) 11.338 38.681 ( 16.327 15.263 -4.436) 22.787 39.100 ( 20.047 -5.885 -13.092) 24.656 ======================= Grid point 206 (106/318) ======================= q-point: (-0.15 0.40 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.017 ( -1.451 23.728 4.986) 24.290 2.566 ( 0.571 17.283 6.870) 18.608 2.960 ( -7.856 -15.315 -5.753) 18.148 3.288 ( -6.508 -10.577 5.946) 13.769 4.026 ( -7.809 13.559 -10.588) 18.893 4.080 ( -2.359 9.560 -8.485) 12.998 4.834 ( 6.112 21.124 -1.742) 22.060 5.268 ( 4.881 -0.825 13.792) 14.654 5.425 ( 12.700 3.583 -2.818) 13.493 5.790 ( 7.874 -12.337 -5.529) 15.645 6.121 ( 3.004 -0.598 11.875) 12.264 6.283 ( 4.870 -9.746 10.118) 14.868 8.084 ( -0.258 11.129 -2.879) 11.498 8.282 ( -5.902 7.284 -2.327) 9.660 8.728 ( 15.676 12.422 -11.094) 22.872 9.121 ( 10.576 -5.198 -8.080) 14.288 9.808 ( 2.471 12.668 8.482) 15.444 10.294 ( -4.663 -10.550 3.613) 12.088 16.842 ( -0.413 2.796 1.040) 3.012 17.015 ( 1.646 -3.330 1.921) 4.182 17.518 ( -8.115 3.240 -2.009) 8.965 17.626 ( -8.860 -5.029 0.030) 10.188 21.334 ( -1.089 0.031 1.567) 1.908 21.371 ( -0.257 -1.464 -0.337) 1.524 27.745 ( 0.537 -2.298 -0.326) 2.382 27.777 ( 0.194 -3.846 -0.779) 3.929 37.247 ( -6.373 2.316 0.632) 6.810 37.456 ( -7.756 -7.963 2.549) 11.404 38.945 ( 13.993 17.737 -2.666) 22.749 39.409 ( 20.404 -4.419 -11.141) 23.664 ======================= Grid point 207 (107/318) ======================= q-point: (-0.08 0.40 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.994 ( -4.236 21.236 7.995) 23.083 2.699 ( 5.320 17.036 10.726) 20.822 2.754 ( -8.817 -9.161 -6.774) 14.406 3.173 ( -7.742 -4.441 0.923) 8.973 3.801 ( -4.266 17.659 -4.954) 18.830 4.159 ( 5.986 1.481 2.341) 6.595 4.876 ( 1.885 19.201 -9.942) 21.704 5.262 ( -4.292 -2.712 -6.933) 8.593 5.613 ( 3.882 2.672 3.654) 5.963 5.919 ( 6.187 -10.807 0.959) 12.489 6.240 ( 3.968 6.689 12.841) 15.013 6.537 ( 9.201 -6.840 18.370) 21.654 8.044 ( -1.395 8.497 -1.916) 8.821 8.159 ( -4.664 10.750 -1.302) 11.790 8.940 ( 13.417 7.815 -9.701) 18.309 9.239 ( 6.925 -3.817 -6.805) 10.433 9.915 ( 1.692 5.944 8.706) 10.677 10.201 ( -6.038 -5.848 2.519) 8.775 16.861 ( 1.216 4.888 1.020) 5.139 17.066 ( 2.110 -2.834 1.374) 3.791 17.353 ( -6.526 0.577 -5.230) 8.383 17.457 ( -7.441 -7.453 -3.486) 11.094 21.318 ( -1.369 0.612 1.164) 1.898 21.366 ( -0.115 -1.497 -0.056) 1.502 27.759 ( 1.039 -2.254 0.306) 2.501 27.780 ( 0.169 -3.234 0.384) 3.261 37.148 ( -3.978 1.685 -0.750) 4.384 37.339 ( -5.664 -7.648 0.751) 9.546 39.152 ( 8.918 20.034 -0.513) 21.935 39.695 ( 15.602 -5.854 -7.746) 18.376 ======================= Grid point 208 (108/318) ======================= q-point: ( 0.00 -0.50 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 312 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.373 ( 0.308 -17.591 2.237) 17.736 2.373 ( 0.308 17.591 2.237) 17.736 2.971 ( -4.768 -8.826 1.066) 10.088 2.971 ( -4.768 8.826 1.066) 10.088 4.144 ( 5.584 -10.348 2.583) 12.039 4.144 ( 5.584 10.348 2.583) 12.039 5.011 ( -5.382 -6.345 -13.227) 15.626 5.011 ( -5.382 6.345 -13.227) 15.626 5.776 ( 0.569 -8.670 3.143) 9.240 5.776 ( 0.569 8.670 3.143) 9.240 6.598 ( -0.475 -9.548 18.148) 20.511 6.598 ( -0.475 9.548 18.148) 20.511 8.180 ( 3.025 -3.704 0.692) 4.832 8.180 ( 3.025 3.704 0.692) 4.832 9.229 ( 5.987 -5.792 -4.685) 9.557 9.229 ( 5.987 5.792 -4.685) 9.557 10.018 ( -4.763 -8.972 3.398) 10.711 10.018 ( -4.763 8.972 3.398) 10.711 16.970 ( -3.617 -5.632 -1.363) 6.831 16.970 ( -3.617 5.632 -1.363) 6.831 17.271 ( 1.744 -0.631 -5.110) 5.436 17.271 ( 1.744 0.631 -5.110) 5.436 21.333 ( -0.151 -1.674 0.259) 1.701 21.333 ( -0.151 1.674 0.259) 1.701 27.759 ( 0.623 -0.378 1.181) 1.387 27.759 ( 0.623 0.378 1.181) 1.387 37.155 ( -1.036 -4.142 -1.085) 4.405 37.155 ( -1.036 4.142 -1.085) 4.405 39.626 ( 3.350 -15.622 -0.706) 15.993 39.626 ( 3.350 15.622 -0.706) 15.993 ======================= Grid point 210 (109/318) ======================= q-point: ( 0.08 -0.50 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 312 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.433 ( 3.701 -14.279 3.449) 15.148 2.433 ( 3.701 14.279 3.449) 15.148 2.923 ( 0.374 -11.614 1.534) 11.721 2.923 ( 0.374 11.614 1.534) 11.721 4.254 ( 5.151 -2.169 -5.425) 7.789 4.254 ( 5.151 2.169 -5.425) 7.789 4.828 ( -6.614 -2.644 -5.627) 9.077 4.828 ( -6.614 2.644 -5.627) 9.077 5.815 ( 1.757 -8.662 4.678) 10.000 5.815 ( 1.757 8.662 4.678) 10.000 6.570 ( -12.941 -11.862 16.677) 24.213 6.570 ( -12.941 11.862 16.677) 24.213 8.279 ( 5.153 -4.157 2.152) 6.961 8.279 ( 5.153 4.157 2.152) 6.961 9.282 ( 1.377 -3.353 -2.064) 4.171 9.282 ( 1.377 3.353 -2.064) 4.171 9.930 ( -5.576 -15.715 0.825) 16.696 9.930 ( -5.576 15.715 0.825) 16.696 16.873 ( -3.705 -4.672 -3.153) 6.745 16.873 ( -3.705 4.672 -3.153) 6.745 17.333 ( 6.541 -1.080 -5.104) 8.366 17.333 ( 6.541 1.080 -5.104) 8.366 21.336 ( 0.286 -1.996 0.248) 2.032 21.336 ( 0.286 1.996 0.248) 2.032 27.777 ( 0.368 -1.187 1.648) 2.064 27.777 ( 0.368 1.187 1.648) 2.064 37.164 ( 2.863 -3.335 -1.789) 4.745 37.164 ( 2.863 3.335 -1.789) 4.745 39.603 ( -5.831 -15.828 0.963) 16.895 39.603 ( -5.831 15.828 0.963) 16.895 ======================= Grid point 212 (110/318) ======================= q-point: ( 0.15 -0.50 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 312 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.534 ( 4.346 -10.008 5.869) 12.389 2.534 ( 4.346 10.008 5.869) 12.389 3.037 ( 9.969 -14.166 4.015) 17.781 3.037 ( 9.969 14.166 4.015) 17.781 4.197 ( -2.673 -5.378 -20.875) 21.722 4.197 ( -2.673 5.378 -20.875) 21.722 4.775 ( -0.321 -4.341 9.824) 10.745 4.775 ( -0.321 4.341 9.824) 10.745 5.900 ( 3.810 -8.855 5.559) 11.128 5.900 ( 3.810 8.855 5.559) 11.128 6.357 ( -18.708 -14.539 14.212) 27.628 6.357 ( -18.708 14.539 14.212) 27.628 8.346 ( 0.288 -5.982 1.112) 6.092 8.346 ( 0.288 5.982 1.112) 6.092 9.223 ( -7.577 -1.936 -0.989) 7.883 9.223 ( -7.577 1.936 -0.989) 7.883 9.858 ( -1.311 -16.179 -0.690) 16.247 9.858 ( -1.311 16.179 -0.690) 16.247 16.824 ( 0.161 -3.693 -2.087) 4.245 16.824 ( 0.161 3.693 -2.087) 4.245 17.427 ( 7.110 -1.831 -6.087) 9.537 17.427 ( 7.110 1.831 -6.087) 9.537 21.345 ( 0.442 -2.238 0.323) 2.304 21.345 ( 0.442 2.238 0.323) 2.304 27.791 ( 0.082 -2.157 1.752) 2.780 27.791 ( 0.082 2.157 1.752) 2.780 37.234 ( 5.807 -3.650 -1.989) 7.141 37.234 ( 5.807 3.650 -1.989) 7.141 39.431 ( -13.150 -15.067 1.438) 20.050 39.431 ( -13.150 15.067 1.438) 20.050 ======================= Grid point 214 (111/318) ======================= q-point: ( 0.23 -0.50 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 312 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.675 ( 6.542 -5.002 7.496) 11.135 2.675 ( 6.542 5.002 7.496) 11.135 3.288 ( 11.941 -15.186 4.358) 19.804 3.288 ( 11.941 15.186 4.358) 19.804 4.007 ( -1.930 -1.195 -18.155) 18.296 4.007 ( -1.930 1.195 -18.155) 18.296 4.858 ( 1.302 -13.451 8.775) 16.113 4.858 ( 1.302 13.451 8.775) 16.113 5.963 ( -6.866 -14.983 8.662) 18.619 5.963 ( -6.866 14.983 8.662) 18.619 6.123 ( -7.818 -9.007 7.910) 14.311 6.123 ( -7.818 9.007 7.910) 14.311 8.295 ( -5.969 -5.795 -0.158) 8.320 8.295 ( -5.969 5.795 -0.158) 8.320 9.000 ( -14.121 -4.741 -2.497) 15.104 9.000 ( -14.121 4.741 -2.497) 15.104 9.872 ( 2.282 -8.539 -0.011) 8.839 9.872 ( 2.282 8.539 -0.011) 8.839 16.844 ( 2.487 -2.709 -0.623) 3.730 16.844 ( 2.487 2.709 -0.623) 3.730 17.527 ( 7.574 -2.249 -5.881) 9.849 17.527 ( 7.574 2.249 -5.881) 9.849 21.354 ( 0.319 -2.444 0.433) 2.502 21.354 ( 0.319 2.444 0.433) 2.502 27.800 ( -0.105 -2.908 1.524) 3.285 27.800 ( -0.105 2.908 1.524) 3.285 37.347 ( 7.373 -4.333 -1.766) 8.732 37.347 ( 7.373 4.333 -1.766) 8.732 39.153 ( -17.002 -14.215 0.827) 22.177 39.153 ( -17.002 14.215 0.827) 22.177 ======================= Grid point 216 (112/318) ======================= q-point: ( 0.31 -0.50 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 312 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.834 ( 5.429 -1.995 4.263) 7.185 2.834 ( 5.429 1.995 4.263) 7.185 3.413 ( 0.742 -12.761 -2.875) 13.102 3.413 ( 0.742 12.761 -2.875) 13.102 4.047 ( 13.964 -5.505 -3.812) 15.487 4.047 ( 13.964 5.505 -3.812) 15.487 4.873 ( -4.033 -18.778 1.786) 19.289 4.873 ( -4.033 18.778 1.786) 19.289 5.759 ( -14.703 -22.054 9.320) 28.097 5.759 ( -14.703 22.054 9.320) 28.097 6.173 ( 4.008 -2.156 3.839) 5.954 6.173 ( 4.008 2.156 3.839) 5.954 8.131 ( -11.132 -4.165 -0.771) 11.910 8.131 ( -11.132 4.165 -0.771) 11.910 8.725 ( -12.421 -5.328 -3.279) 13.907 8.725 ( -12.421 5.328 -3.279) 13.907 9.917 ( 1.969 -2.355 0.786) 3.169 9.917 ( 1.969 2.355 0.786) 3.169 16.892 ( 2.554 -2.889 0.175) 3.860 16.892 ( 2.554 2.889 0.175) 3.860 17.641 ( 7.882 -2.548 -3.814) 9.120 17.641 ( 7.882 2.548 -3.814) 9.120 21.361 ( 0.088 -2.597 0.465) 2.640 21.361 ( 0.088 2.597 0.465) 2.640 27.805 ( -0.245 -3.197 0.961) 3.348 27.805 ( -0.245 3.197 0.961) 3.348 37.479 ( 7.709 -4.214 -1.341) 8.887 37.479 ( 7.709 4.214 -1.341) 8.887 38.834 ( -17.024 -13.974 -0.390) 22.029 38.834 ( -17.024 13.974 -0.390) 22.029 ======================= Grid point 218 (113/318) ======================= q-point: ( 0.38 -0.50 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 312 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.879 ( -1.510 -3.920 -1.081) 4.337 2.879 ( -1.510 3.920 -1.081) 4.337 3.411 ( 3.729 -6.636 -5.996) 9.690 3.411 ( 3.729 6.636 -5.996) 9.690 4.349 ( 15.614 -5.520 2.873) 16.809 4.349 ( 15.614 5.520 2.873) 16.809 4.719 ( -10.187 -18.384 -6.771) 22.081 4.719 ( -10.187 18.384 -6.771) 22.081 5.585 ( -9.375 -19.138 6.321) 22.228 5.585 ( -9.375 19.138 6.321) 22.228 6.272 ( 3.938 -1.435 4.226) 5.953 6.272 ( 3.938 1.435 4.226) 5.953 7.901 ( -11.875 -2.621 -0.699) 12.181 7.901 ( -11.875 2.621 -0.699) 12.181 8.528 ( -6.794 -4.470 -2.492) 8.505 8.528 ( -6.794 4.470 -2.492) 8.505 9.951 ( 1.055 -3.913 1.514) 4.327 9.951 ( 1.055 3.913 1.514) 4.327 16.935 ( 1.714 -3.544 0.628) 3.987 16.935 ( 1.714 3.544 0.628) 3.987 17.766 ( 6.727 -2.646 -0.695) 7.262 17.766 ( 6.727 2.646 -0.695) 7.262 21.363 ( -0.131 -2.654 0.339) 2.679 21.363 ( -0.131 2.654 0.339) 2.679 27.802 ( -0.435 -3.049 0.097) 3.082 27.802 ( -0.435 3.049 0.097) 3.082 37.611 ( 6.983 -3.038 -0.967) 7.677 37.611 ( 6.983 3.038 -0.967) 7.677 38.539 ( -13.599 -14.660 -1.684) 20.067 38.539 ( -13.599 14.660 -1.684) 20.067 ======================= Grid point 220 (114/318) ======================= q-point: ( 0.46 -0.50 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 312 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.822 ( -1.917 -4.628 -3.132) 5.908 2.822 ( -1.917 4.628 -3.132) 5.908 3.437 ( 2.317 -6.085 -10.712) 12.535 3.437 ( 2.317 6.085 -10.712) 12.535 4.463 ( -7.975 -13.691 -10.956) 19.263 4.463 ( -7.975 13.691 -10.956) 19.263 4.607 ( 8.363 -9.243 1.638) 12.572 4.607 ( 8.363 9.243 1.638) 12.572 5.465 ( -6.766 -12.470 2.355) 14.381 5.465 ( -6.766 12.470 2.355) 14.381 6.355 ( 1.293 -1.841 5.233) 5.696 6.355 ( 1.294 1.841 5.233) 5.696 7.736 ( -4.649 -2.820 0.354) 5.449 7.736 ( -4.649 2.820 0.354) 5.449 8.439 ( -1.662 -3.966 -1.666) 4.611 8.439 ( -1.662 3.966 -1.666) 4.611 9.978 ( 0.698 -6.083 2.421) 6.584 9.978 ( 0.698 6.083 2.421) 6.584 16.963 ( 0.795 -3.710 1.194) 3.978 16.963 ( 0.795 3.710 1.194) 3.978 17.871 ( 3.799 -2.391 2.275) 5.032 17.871 ( 3.799 2.391 2.275) 5.032 21.360 ( -0.263 -2.577 0.101) 2.593 21.360 ( -0.263 2.577 0.101) 2.593 27.789 ( -0.633 -2.722 -0.876) 2.929 27.789 ( -0.633 2.723 -0.876) 2.929 37.716 ( 4.374 -1.100 -0.484) 4.536 37.716 ( 4.374 1.100 -0.484) 4.536 38.331 ( -6.663 -15.959 -3.042) 17.559 38.331 ( -6.663 15.959 -3.042) 17.559 ======================= Grid point 222 (115/318) ======================= q-point: (-0.46 -0.50 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 312 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.773 ( -1.648 -7.569 -7.114) 10.517 2.773 ( -1.648 7.569 -7.114) 10.517 3.347 ( -1.928 -6.619 -14.436) 15.998 3.347 ( -1.928 6.619 -14.436) 15.998 4.312 ( -1.404 -5.192 -9.060) 10.536 4.312 ( -1.404 5.192 -9.060) 10.537 4.720 ( 3.720 -10.474 -0.302) 11.119 4.720 ( 3.720 10.474 -0.302) 11.119 5.357 ( -5.255 -10.593 -1.174) 11.883 5.357 ( -5.255 10.593 -1.174) 11.883 6.362 ( -4.027 -4.498 5.568) 8.213 6.362 ( -4.027 4.498 5.568) 8.213 7.753 ( 5.761 -3.810 0.629) 6.935 7.753 ( 5.761 3.810 0.629) 6.935 8.443 ( 2.961 -3.130 -1.483) 4.557 8.443 ( 2.961 3.130 -1.483) 4.557 10.007 ( 0.491 -7.800 3.401) 8.523 10.007 ( 0.491 7.800 3.401) 8.523 16.977 ( -0.351 -3.308 1.657) 3.716 16.977 ( -0.351 3.308 1.657) 3.716 17.927 ( 0.022 -1.932 4.424) 4.827 17.927 ( 0.022 1.932 4.424) 4.827 21.355 ( -0.246 -2.344 -0.091) 2.359 21.355 ( -0.246 2.344 -0.091) 2.359 27.769 ( -0.667 -2.428 -1.645) 3.008 27.769 ( -0.667 2.428 -1.645) 3.008 37.746 ( -1.450 -1.240 0.896) 2.107 37.746 ( -1.450 1.240 0.896) 2.107 38.280 ( 4.071 -15.252 -5.189) 16.617 38.280 ( 4.071 15.252 -5.189) 16.617 ======================= Grid point 224 (116/318) ======================= q-point: (-0.38 -0.50 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 312 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.618 ( -7.381 -7.589 -13.994) 17.547 2.618 ( -7.381 7.589 -13.994) 17.547 3.295 ( 4.130 -12.073 -10.878) 16.767 3.295 ( 4.130 12.073 -10.878) 16.767 4.275 ( 0.193 -2.158 -0.563) 2.238 4.275 ( 0.193 2.158 -0.563) 2.238 4.777 ( 4.106 -10.545 -2.922) 11.687 4.777 ( 4.106 10.545 -2.922) 11.687 5.262 ( -2.700 -15.003 -4.892) 16.010 5.262 ( -2.700 15.003 -4.892) 16.010 6.286 ( -7.237 -5.046 5.536) 10.416 6.286 ( -7.237 5.046 5.536) 10.416 7.920 ( 11.252 -3.155 -0.860) 11.718 7.920 ( 11.252 3.155 -0.860) 11.718 8.525 ( 6.864 -2.071 -2.320) 7.536 8.525 ( 6.864 2.071 -2.320) 7.536 10.034 ( -0.122 -10.099 4.313) 10.983 10.034 ( -0.122 10.099 4.313) 10.983 16.968 ( -1.682 -2.576 1.751) 3.540 16.968 ( -1.682 2.576 1.751) 3.540 17.923 ( -3.552 -1.515 5.329) 6.581 17.923 ( -3.552 1.515 5.329) 6.581 21.351 ( -0.113 -1.961 -0.097) 1.967 21.351 ( -0.113 1.961 -0.097) 1.967 27.748 ( -0.435 -2.118 -1.967) 2.923 27.748 ( -0.435 2.118 -1.967) 2.923 37.685 ( -5.612 -4.115 2.379) 7.354 37.685 ( -5.612 4.115 2.379) 7.354 38.405 ( 12.659 -12.248 -7.273) 19.056 38.405 ( 12.659 12.248 -7.273) 19.056 ======================= Grid point 226 (117/318) ======================= q-point: (-0.31 -0.50 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 312 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.436 ( -2.583 -10.001 -9.375) 13.950 2.436 ( -2.583 10.001 -9.375) 13.950 3.273 ( -2.266 -14.894 -8.635) 17.365 3.273 ( -2.266 14.894 -8.635) 17.365 4.323 ( 4.234 -4.975 0.540) 6.555 4.323 ( 4.234 4.975 0.540) 6.555 4.837 ( 1.691 -8.655 5.870) 10.594 4.837 ( 1.691 8.655 5.870) 10.594 5.233 ( 6.180 -19.428 -12.093) 23.704 5.233 ( 6.180 19.428 -12.093) 23.704 6.177 ( -7.652 -5.178 5.947) 10.988 6.177 ( -7.652 5.178 5.947) 10.988 8.122 ( 10.686 -3.208 -2.539) 11.443 8.122 ( 10.686 3.208 -2.539) 11.443 8.658 ( 9.439 -4.922 -4.673) 11.626 8.658 ( 9.439 4.922 -4.673) 11.626 10.051 ( -1.004 -12.985 5.196) 14.022 10.051 ( -1.004 12.985 5.196) 14.022 16.939 ( -2.326 -2.502 1.692) 3.813 16.939 ( -2.326 2.502 1.692) 3.813 17.859 ( -6.470 -1.601 4.602) 8.099 17.859 ( -6.470 1.601 4.602) 8.099 21.350 ( -0.036 -1.496 0.078) 1.499 21.350 ( -0.036 1.496 0.078) 1.499 27.732 ( -0.033 -1.663 -1.804) 2.454 27.732 ( -0.033 1.663 -1.804) 2.454 37.580 ( -7.322 -5.513 2.985) 9.639 37.580 ( -7.322 5.513 2.985) 9.639 38.642 ( 17.434 -10.581 -8.202) 21.981 38.642 ( 17.434 10.581 -8.202) 21.981 ======================= Grid point 228 (118/318) ======================= q-point: (-0.23 -0.50 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 312 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.427 ( 3.235 -18.527 0.149) 18.808 2.427 ( 3.235 18.527 0.149) 18.808 3.125 ( -7.967 -14.168 -3.093) 16.546 3.125 ( -7.967 14.168 -3.093) 16.546 4.331 ( -2.057 -7.620 -10.621) 13.232 4.331 ( -2.057 7.620 -10.621) 13.232 4.972 ( 5.141 -4.568 20.052) 21.198 4.972 ( 5.141 4.568 20.052) 21.198 5.351 ( 14.730 -15.214 -16.545) 26.873 5.351 ( 14.730 15.214 -16.545) 26.873 6.097 ( -4.472 -4.864 7.802) 10.224 6.097 ( -4.472 4.864 7.802) 10.224 8.254 ( 4.912 -6.294 -3.593) 8.755 8.254 ( 4.912 6.294 -3.593) 8.755 8.814 ( 11.141 -9.206 -7.402) 16.238 8.814 ( 11.141 9.206 -7.402) 16.238 10.060 ( -1.498 -14.632 5.966) 15.872 10.060 ( -1.498 14.632 5.966) 15.872 16.913 ( -1.253 -3.756 1.831) 4.363 16.913 ( -1.253 3.756 1.831) 4.363 17.738 ( -8.746 -1.988 2.180) 9.231 17.738 ( -8.746 1.988 2.180) 9.231 21.349 ( -0.187 -1.108 0.283) 1.158 21.349 ( -0.187 1.108 0.283) 1.158 27.726 ( 0.345 -1.161 -1.271) 1.756 27.726 ( 0.345 1.161 -1.271) 1.756 37.454 ( -7.962 -5.666 2.580) 10.107 37.454 ( -7.962 5.666 2.580) 10.107 38.938 ( 19.210 -10.622 -7.665) 23.251 38.938 ( 19.210 10.622 -7.665) 23.251 ======================= Grid point 230 (119/318) ======================= q-point: (-0.15 -0.50 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 312 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.467 ( -1.776 -20.891 1.953) 21.057 2.467 ( -1.776 20.891 1.953) 21.057 3.022 ( -2.654 -15.321 5.210) 16.399 3.022 ( -2.654 15.321 5.210) 16.399 4.176 ( -5.570 -1.056 -10.204) 11.673 4.176 ( -5.570 1.056 -10.204) 11.673 5.157 ( 3.463 -11.113 5.644) 12.936 5.157 ( 3.463 11.113 5.644) 12.936 5.554 ( 12.973 -10.036 -4.638) 17.045 5.554 ( 12.973 10.036 -4.638) 17.045 6.149 ( 4.974 -3.835 11.361) 12.982 6.149 ( 4.974 3.835 11.361) 12.982 8.256 ( -1.696 -6.339 -4.020) 7.696 8.256 ( -1.696 6.339 -4.020) 7.696 8.977 ( 11.225 -10.073 -8.132) 17.134 8.977 ( 11.225 10.073 -8.132) 17.134 10.067 ( -1.741 -12.754 6.102) 14.246 10.067 ( -1.741 12.754 6.102) 14.246 16.924 ( 1.225 -5.134 2.017) 5.651 16.924 ( 1.225 5.134 2.017) 5.651 17.565 ( -9.999 -2.009 -1.346) 10.288 17.565 ( -9.999 2.009 -1.346) 10.288 21.345 ( -0.468 -1.015 0.368) 1.177 21.345 ( -0.468 1.015 0.368) 1.177 27.730 ( 0.593 -0.849 -0.493) 1.147 27.730 ( 0.593 0.849 -0.493) 1.147 37.323 ( -7.237 -5.364 1.436) 9.122 37.323 ( -7.237 5.364 1.436) 9.122 39.243 ( 17.449 -12.064 -5.801) 21.992 39.243 ( 17.449 12.064 -5.801) 21.992 ======================= Grid point 232 (120/318) ======================= q-point: (-0.08 -0.50 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 312 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.403 ( -4.167 -19.820 1.196) 20.288 2.403 ( -4.167 19.820 1.196) 20.288 3.029 ( -2.553 -11.374 5.485) 12.883 3.029 ( -2.553 11.374 5.485) 12.883 4.078 ( 0.239 -9.546 -2.684) 9.919 4.078 ( 0.239 9.546 -2.684) 9.919 5.150 ( -1.958 -9.164 -9.096) 13.060 5.150 ( -1.958 9.164 -9.096) 13.060 5.719 ( 4.805 -8.333 2.403) 9.914 5.719 ( 4.805 8.333 2.403) 9.914 6.391 ( 9.758 -7.868 16.390) 20.634 6.391 ( 9.758 7.868 16.390) 20.634 8.185 ( -2.526 -4.902 -2.411) 6.018 8.185 ( -2.526 4.902 -2.411) 6.018 9.123 ( 9.102 -8.297 -6.922) 14.128 9.123 ( 9.102 8.297 -6.922) 14.128 10.061 ( -2.762 -7.991 5.243) 9.949 10.061 ( -2.762 7.991 5.243) 9.949 16.973 ( 2.216 -5.977 1.534) 6.557 16.973 ( 2.216 5.977 1.534) 6.557 17.371 ( -8.080 -1.862 -4.686) 9.525 17.371 ( -8.080 1.862 -4.686) 9.525 21.338 ( -0.511 -1.280 0.327) 1.417 21.338 ( -0.511 1.280 0.327) 1.417 27.741 ( 0.699 -0.548 0.397) 0.973 27.741 ( 0.699 0.548 0.397) 0.973 37.213 ( -4.789 -4.940 0.066) 6.881 37.213 ( -4.789 4.940 0.066) 6.881 39.494 ( 11.857 -14.128 -3.206) 18.721 39.494 ( 11.857 14.128 -3.206) 18.721 ======================= Grid point 286 (121/318) ======================= q-point: ( 0.00 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 318 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.870 ( 6.356 0.000 18.468) 19.531 0.943 ( 5.196 0.000 19.148) 19.841 2.045 ( -1.319 0.000 -10.396) 10.479 2.310 ( 17.551 0.000 47.563) 50.698 2.763 ( -5.054 0.000 -2.610) 5.688 3.206 ( 18.443 0.000 17.501) 25.425 4.083 ( 3.066 0.000 -1.182) 3.286 4.740 ( -11.123 0.000 -17.844) 21.027 5.727 ( -9.341 0.000 1.647) 9.485 6.039 ( 2.146 0.000 4.341) 4.842 6.076 ( 0.865 0.000 0.126) 0.874 6.404 ( -7.811 0.000 9.624) 12.394 7.141 ( -5.221 0.000 14.186) 15.116 7.777 ( 5.482 0.000 8.932) 10.480 8.823 ( 8.831 0.000 -8.798) 12.466 9.265 ( 0.588 0.000 -10.528) 10.544 9.314 ( -34.457 0.000 -7.524) 35.269 11.310 ( 33.214 0.000 -5.026) 33.592 16.697 ( 2.706 0.000 3.461) 4.393 17.044 ( -2.339 0.000 -2.850) 3.687 17.293 ( 2.744 0.000 -2.347) 3.611 17.865 ( -2.058 0.000 -6.898) 7.198 21.419 ( -1.456 0.000 -0.777) 1.650 21.644 ( -15.182 0.000 0.835) 15.205 28.056 ( 3.628 0.000 0.232) 3.636 28.156 ( -4.233 0.000 1.612) 4.529 36.745 ( -0.057 0.000 2.401) 2.402 37.583 ( -0.030 0.000 -3.227) 3.227 37.858 ( -0.426 0.000 4.126) 4.148 39.147 ( 68.172 0.000 -2.071) 68.204 ======================= Grid point 287 (122/318) ======================= q-point: ( 0.08 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 318 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.246 ( 21.260 0.000 13.139) 24.993 1.339 ( 19.642 0.000 16.819) 25.859 2.072 ( 10.156 0.000 -8.948) 13.535 2.653 ( 7.945 0.000 5.527) 9.678 3.131 ( 30.679 0.000 27.212) 41.009 3.674 ( 17.054 0.000 18.407) 25.093 4.157 ( 6.914 0.000 -3.228) 7.631 4.382 ( -12.756 0.000 -21.656) 25.133 5.671 ( 1.805 0.000 3.979) 4.369 6.013 ( -5.467 0.000 0.301) 5.475 6.115 ( 1.992 0.000 2.181) 2.954 6.155 ( -26.023 0.000 14.386) 29.735 7.129 ( -5.429 0.000 15.178) 16.120 7.785 ( -10.350 0.000 8.360) 13.304 8.816 ( -12.318 0.000 0.616) 12.334 9.062 ( 15.680 0.000 -8.258) 17.722 9.180 ( -2.732 0.000 -10.347) 10.701 11.490 ( -2.532 0.000 -17.259) 17.444 16.765 ( 2.006 0.000 4.123) 4.585 16.958 ( -4.636 0.000 -3.681) 5.919 17.341 ( 3.330 0.000 -3.159) 4.590 17.825 ( 1.365 0.000 -7.664) 7.785 21.319 ( -6.361 0.000 2.474) 6.825 21.564 ( 0.923 0.000 3.915) 4.022 28.071 ( -1.400 0.000 0.113) 1.405 28.177 ( 4.333 0.000 2.249) 4.882 36.776 ( 1.767 0.000 2.524) 3.081 37.558 ( -0.602 0.000 -3.283) 3.338 37.774 ( -7.633 0.000 1.648) 7.809 40.028 ( 33.554 0.000 -26.007) 42.453 ======================= Grid point 288 (123/318) ======================= q-point: ( 0.15 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 318 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.739 ( 23.886 0.000 8.558) 25.373 1.761 ( 14.530 0.000 18.116) 23.223 2.288 ( 17.364 0.000 -7.228) 18.809 2.923 ( 20.643 0.000 -7.866) 22.091 3.658 ( -23.483 0.000 -10.708) 25.809 3.895 ( 33.669 0.000 22.089) 40.268 4.314 ( 13.366 0.000 -5.415) 14.421 4.368 ( 18.931 0.000 2.503) 19.096 5.670 ( -29.726 0.000 11.839) 31.997 5.831 ( 8.419 0.000 6.933) 10.906 5.892 ( -7.024 0.000 0.989) 7.094 6.148 ( 0.882 0.000 -0.323) 0.940 7.112 ( -6.617 0.000 15.849) 17.175 7.544 ( -18.270 0.000 4.258) 18.760 8.618 ( -9.441 0.000 -3.325) 10.009 9.052 ( -4.587 0.000 -9.297) 10.367 9.400 ( 19.603 0.000 4.372) 20.085 11.168 ( -16.865 0.000 -20.225) 26.334 16.805 ( -1.399 0.000 0.546) 1.501 16.846 ( -3.823 0.000 -0.456) 3.850 17.352 ( 0.446 0.000 -5.516) 5.534 17.806 ( -0.024 0.000 -3.610) 3.610 21.263 ( -1.871 0.000 2.644) 3.239 21.626 ( 2.273 0.000 4.489) 5.032 28.060 ( 0.227 0.000 0.058) 0.234 28.273 ( 4.225 0.000 1.795) 4.591 36.840 ( 3.483 0.000 2.658) 4.381 37.521 ( -1.294 0.000 -3.239) 3.488 37.641 ( -5.663 0.000 -2.581) 6.224 40.213 ( 6.661 0.000 -24.097) 25.001 ======================= Grid point 289 (124/318) ======================= q-point: ( 0.23 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 318 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.106 ( 12.092 0.000 16.047) 20.093 2.203 ( 21.349 0.000 5.137) 21.959 2.574 ( 15.270 0.000 -8.684) 17.566 3.056 ( -28.056 0.000 -13.005) 30.924 3.234 ( 17.665 0.000 -13.198) 22.051 4.480 ( 21.032 0.000 -5.170) 21.658 4.696 ( 28.110 0.000 8.580) 29.390 4.741 ( 15.542 0.000 4.947) 16.310 5.200 ( -24.260 0.000 7.883) 25.509 5.800 ( -3.123 0.000 2.271) 3.861 6.097 ( 13.496 0.000 7.354) 15.370 6.144 ( -0.340 0.000 -2.330) 2.355 7.064 ( -8.375 0.000 14.558) 16.795 7.187 ( -21.650 0.000 2.130) 21.754 8.394 ( -13.007 0.000 -2.496) 13.244 8.908 ( -5.297 0.000 -7.864) 9.482 9.788 ( 16.821 0.000 8.505) 18.849 10.721 ( -16.511 0.000 -19.500) 25.551 16.692 ( -5.746 0.000 -3.877) 6.932 16.846 ( -0.857 0.000 3.712) 3.810 17.305 ( -1.350 0.000 -5.732) 5.889 17.775 ( -2.748 0.000 1.413) 3.090 21.264 ( 0.142 0.000 2.224) 2.228 21.684 ( 0.869 0.000 4.575) 4.657 28.078 ( 1.661 0.000 -0.237) 1.678 28.344 ( 2.280 0.000 1.021) 2.498 36.934 ( 4.852 0.000 2.755) 5.580 37.471 ( -2.121 0.000 -3.106) 3.761 37.555 ( -0.753 0.000 -5.014) 5.070 40.102 ( -2.767 0.000 -19.790) 19.983 ======================= Grid point 290 (125/318) ======================= q-point: ( 0.31 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 318 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.326 ( -22.935 0.000 -15.082) 27.450 2.394 ( 10.020 0.000 10.943) 14.837 2.589 ( 16.914 0.000 3.805) 17.337 2.941 ( 10.506 0.000 0.928) 10.547 3.399 ( 10.751 0.000 -17.259) 20.334 4.713 ( -6.377 0.000 5.556) 8.458 4.918 ( 11.725 0.000 -10.947) 16.041 4.960 ( 5.996 0.000 2.247) 6.404 5.275 ( 22.695 0.000 1.390) 22.737 5.815 ( 2.359 0.000 3.519) 4.236 6.117 ( -0.606 0.000 -2.910) 2.973 6.350 ( 7.092 0.000 2.795) 7.623 6.816 ( -17.221 0.000 4.643) 17.836 6.970 ( -9.549 0.000 9.487) 13.461 8.120 ( -15.023 0.000 -0.101) 15.023 8.769 ( -4.939 0.000 -6.285) 7.993 10.005 ( 1.356 0.000 -10.925) 11.009 10.466 ( 0.460 0.000 3.209) 3.242 16.577 ( -4.306 0.000 -2.724) 5.095 16.838 ( -1.971 0.000 2.584) 3.250 17.257 ( -0.592 0.000 -2.902) 2.962 17.728 ( -4.131 0.000 5.371) 6.776 21.286 ( 0.659 0.000 2.198) 2.295 21.706 ( -1.174 0.000 3.537) 3.726 28.112 ( 2.133 0.000 -0.546) 2.202 28.368 ( 0.065 0.000 -0.146) 0.160 37.048 ( 5.609 0.000 2.804) 6.271 37.406 ( -2.956 0.000 -2.936) 4.166 37.559 ( 3.980 0.000 -4.364) 5.906 39.919 ( -4.476 0.000 -17.412) 17.978 ======================= Grid point 291 (126/318) ======================= q-point: ( 0.38 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 318 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.986 ( -6.430 0.000 3.375) 7.262 2.593 ( 6.106 0.000 4.473) 7.570 2.884 ( 12.330 0.000 3.508) 12.820 3.101 ( 5.588 0.000 -0.092) 5.589 3.492 ( 12.758 0.000 -18.609) 22.562 4.514 ( -10.919 0.000 0.906) 10.956 5.028 ( 1.417 0.000 1.659) 2.182 5.193 ( 17.520 0.000 -10.361) 20.354 5.556 ( 5.811 0.000 -3.079) 6.577 5.873 ( 0.059 0.000 2.391) 2.392 6.106 ( 1.539 0.000 -1.586) 2.210 6.235 ( -11.643 0.000 -9.734) 15.176 6.775 ( 3.154 0.000 11.322) 11.753 6.820 ( -10.122 0.000 1.312) 10.206 7.870 ( -11.949 0.000 3.011) 12.323 8.662 ( -2.876 0.000 -4.672) 5.486 9.801 ( -6.543 0.000 -22.596) 23.524 10.684 ( 10.304 0.000 17.079) 19.947 16.509 ( -1.715 0.000 -1.202) 2.094 16.807 ( -2.599 0.000 1.307) 2.909 17.259 ( 1.449 0.000 1.127) 1.836 17.700 ( -2.791 0.000 8.332) 8.787 21.312 ( 0.650 0.000 2.455) 2.539 21.685 ( -2.564 0.000 1.789) 3.126 28.145 ( 1.673 0.000 -0.819) 1.863 28.349 ( -1.373 0.000 -1.339) 1.918 37.168 ( 5.058 0.000 3.125) 5.945 37.330 ( -3.085 0.000 -3.094) 4.369 37.639 ( 6.094 0.000 -1.650) 6.314 39.741 ( -3.718 0.000 -16.890) 17.294 ======================= Grid point 292 (127/318) ======================= q-point: (-0.54 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 318 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.145 ( 13.826 0.000 19.011) 23.507 2.658 ( -0.142 0.000 -1.772) 1.778 3.055 ( 1.127 0.000 4.639) 4.774 3.170 ( 4.615 0.000 -1.112) 4.747 3.697 ( 20.073 0.000 -16.113) 25.740 4.365 ( -3.027 0.000 -4.277) 5.239 5.071 ( 2.618 0.000 2.660) 3.733 5.356 ( 0.430 0.000 -7.167) 7.180 5.436 ( -10.022 0.000 -2.556) 10.343 5.803 ( -7.719 0.000 -1.838) 7.935 5.995 ( -7.386 0.000 -16.063) 17.680 6.161 ( 3.917 0.000 0.986) 4.039 6.618 ( -9.978 0.000 -5.361) 11.327 6.889 ( 1.061 0.000 10.649) 10.701 7.742 ( -4.153 0.000 5.284) 6.720 8.618 ( 0.978 0.000 -3.572) 3.703 9.576 ( -3.495 0.000 -20.217) 20.517 10.968 ( 9.484 0.000 15.249) 17.958 16.500 ( 1.107 0.000 0.024) 1.108 16.763 ( -2.444 0.000 0.303) 2.463 17.317 ( 2.757 0.000 4.089) 4.931 17.733 ( 0.637 0.000 9.938) 9.958 21.341 ( 0.821 0.000 3.052) 3.161 21.639 ( -2.905 0.000 0.101) 2.907 28.161 ( 0.529 0.000 -0.959) 1.095 28.309 ( -1.710 0.000 -2.145) 2.743 37.208 ( -4.099 0.000 1.725) 4.447 37.317 ( 4.964 0.000 -1.609) 5.218 37.748 ( 5.355 0.000 1.364) 5.525 39.579 ( -2.762 0.000 -17.929) 18.141 ======================= Grid point 293 (128/318) ======================= q-point: (-0.46 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 318 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.565 ( 14.647 0.000 16.731) 22.236 2.567 ( -7.936 0.000 -4.226) 8.991 2.999 ( -6.715 0.000 5.222) 8.506 3.261 ( 3.427 0.000 1.342) 3.680 3.907 ( 7.252 0.000 -13.463) 15.292 4.467 ( 20.923 0.000 -7.620) 22.268 5.037 ( -18.764 0.000 -4.562) 19.311 5.154 ( 3.505 0.000 1.037) 3.656 5.349 ( -7.551 0.000 -5.147) 9.138 5.604 ( -9.615 0.000 -3.088) 10.099 5.694 ( -15.595 0.000 -12.444) 19.951 6.245 ( 4.222 0.000 2.130) 4.729 6.406 ( -8.684 0.000 -6.223) 10.683 6.944 ( -1.627 0.000 11.116) 11.234 7.771 ( 3.424 0.000 4.782) 5.881 8.656 ( 5.188 0.000 -3.496) 6.256 9.439 ( 0.425 0.000 -16.810) 16.815 11.206 ( 7.857 0.000 10.634) 13.222 16.539 ( 2.587 0.000 -0.087) 2.589 16.730 ( -0.815 0.000 0.406) 0.910 17.391 ( 2.010 0.000 4.336) 4.780 17.840 ( 4.317 0.000 9.844) 10.749 21.384 ( 1.656 0.000 4.217) 4.531 21.584 ( -2.561 0.000 -1.012) 2.753 28.152 ( -0.795 0.000 -0.931) 1.224 28.265 ( -1.495 0.000 -2.308) 2.750 37.118 ( -5.590 0.000 0.679) 5.631 37.412 ( 5.185 0.000 -0.563) 5.216 37.842 ( 3.129 0.000 3.552) 4.734 39.418 ( -2.701 0.000 -20.459) 20.636 ======================= Grid point 294 (129/318) ======================= q-point: (-0.38 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 318 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.291 ( -20.148 0.000 -3.049) 20.378 2.620 ( -12.980 0.000 -0.174) 12.981 3.034 ( 2.544 0.000 8.204) 8.590 3.302 ( 0.079 0.000 2.825) 2.826 3.863 ( -0.256 0.000 -14.492) 14.495 4.612 ( -15.655 0.000 -17.781) 23.690 4.910 ( 1.721 0.000 12.562) 12.680 5.076 ( -9.087 0.000 -5.812) 10.787 5.089 ( -6.810 0.000 -10.293) 12.342 5.414 ( 0.649 0.000 -8.669) 8.694 5.566 ( 3.405 0.000 9.538) 10.127 6.230 ( -6.741 0.000 -4.650) 8.189 6.364 ( 7.183 0.000 4.559) 8.508 6.981 ( -1.555 0.000 13.522) 13.611 7.897 ( 7.134 0.000 2.501) 7.559 8.761 ( 8.357 0.000 -4.181) 9.344 9.379 ( 2.457 0.000 -14.027) 14.241 11.379 ( 5.718 0.000 4.531) 7.295 16.569 ( 0.924 0.000 -2.001) 2.204 16.759 ( 3.317 0.000 2.095) 3.923 17.428 ( -0.227 0.000 1.968) 1.981 17.994 ( 6.078 0.000 7.998) 10.045 21.457 ( 3.039 0.000 5.514) 6.296 21.536 ( -1.725 0.000 -0.838) 1.918 28.120 ( -2.009 0.000 -1.096) 2.288 28.230 ( -1.041 0.000 -1.310) 1.673 37.018 ( -5.667 0.000 1.079) 5.769 37.494 ( 4.127 0.000 -1.048) 4.258 37.901 ( 0.698 0.000 4.111) 4.170 39.223 ( -4.592 0.000 -24.273) 24.703 ======================= Grid point 295 (130/318) ======================= q-point: (-0.31 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 318 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.804 ( -29.747 0.000 0.250) 29.748 2.268 ( -22.693 0.000 -2.140) 22.793 2.999 ( -7.705 0.000 -0.441) 7.718 3.259 ( -6.338 0.000 -4.655) 7.863 3.689 ( -17.526 0.000 -10.866) 20.621 4.114 ( -19.697 0.000 -10.441) 22.293 4.618 ( -23.804 0.000 1.323) 23.841 4.951 ( -0.405 0.000 -5.842) 5.856 5.029 ( -1.350 0.000 11.148) 11.229 5.701 ( 2.930 0.000 10.675) 11.070 5.788 ( 32.658 0.000 -9.296) 33.955 6.094 ( -5.448 0.000 -3.555) 6.505 6.587 ( 11.975 0.000 9.089) 15.034 7.063 ( 1.578 0.000 14.854) 14.938 8.052 ( 8.365 0.000 1.769) 8.550 8.907 ( 10.144 0.000 -5.213) 11.405 9.348 ( 2.125 0.000 -11.817) 12.007 11.458 ( 1.800 0.000 -3.386) 3.835 16.562 ( 0.266 0.000 -2.432) 2.446 16.859 ( 5.359 0.000 2.288) 5.827 17.404 ( -2.443 0.000 -1.179) 2.713 18.139 ( 5.063 0.000 4.587) 6.832 21.481 ( -1.294 0.000 -1.724) 2.156 21.599 ( 5.622 0.000 8.869) 10.500 28.068 ( -2.636 0.000 -1.389) 2.980 28.214 ( -0.496 0.000 0.898) 1.026 36.924 ( -5.283 0.000 1.572) 5.512 37.552 ( 2.991 0.000 -1.704) 3.443 37.908 ( -1.985 0.000 0.651) 2.089 38.943 ( -9.662 0.000 -26.720) 28.414 ======================= Grid point 296 (131/318) ======================= q-point: (-0.23 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 318 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.297 ( -25.621 0.000 13.245) 28.842 1.784 ( -27.636 0.000 -1.279) 27.666 2.807 ( -10.467 0.000 -4.029) 11.216 2.990 ( -46.746 0.000 0.331) 46.747 3.014 ( -13.720 0.000 -8.872) 16.339 3.929 ( -1.026 0.000 -13.155) 13.195 4.131 ( -28.470 0.000 8.529) 29.720 4.995 ( 6.026 0.000 -2.721) 6.612 5.206 ( 11.647 0.000 12.086) 16.784 5.798 ( 1.766 0.000 8.580) 8.760 5.989 ( -3.382 0.000 -2.877) 4.440 6.284 ( 23.659 0.000 -5.810) 24.362 6.865 ( 9.847 0.000 12.327) 15.777 7.206 ( 5.786 0.000 7.554) 9.515 8.253 ( 12.181 0.000 5.661) 13.432 9.065 ( 10.388 0.000 -6.505) 12.257 9.327 ( 2.564 0.000 -6.282) 6.785 11.372 ( -6.906 0.000 -13.656) 15.303 16.561 ( 0.934 0.000 -1.508) 1.774 16.967 ( 4.885 0.000 1.347) 5.067 17.337 ( -2.902 0.000 -3.003) 4.176 18.218 ( 1.484 0.000 0.089) 1.486 21.447 ( -1.052 0.000 -1.792) 2.078 21.793 ( 8.881 0.000 10.292) 13.594 28.016 ( -2.030 0.000 -1.075) 2.297 28.221 ( -0.080 0.000 3.291) 3.292 36.843 ( -4.478 0.000 1.947) 4.884 37.586 ( 1.974 0.000 -2.298) 3.030 37.788 ( -8.829 0.000 -15.152) 17.537 38.570 ( -15.211 0.000 -14.283) 20.866 ======================= Grid point 297 (132/318) ======================= q-point: (-0.15 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 318 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.131 ( -6.970 0.000 32.568) 33.306 1.269 ( -27.708 0.000 4.682) 28.101 2.130 ( -46.454 0.000 12.711) 48.162 2.548 ( -13.616 0.000 -11.269) 17.674 2.781 ( -5.453 0.000 2.180) 5.873 3.534 ( -27.359 0.000 -3.542) 27.587 3.989 ( 0.581 0.000 3.318) 3.369 5.064 ( 2.643 0.000 -6.827) 7.321 5.552 ( 16.033 0.000 13.534) 20.981 5.877 ( 1.785 0.000 7.075) 7.297 5.959 ( 1.885 0.000 -1.176) 2.222 6.530 ( 5.323 0.000 -7.187) 8.944 7.064 ( 3.074 0.000 13.223) 13.575 7.350 ( 9.009 0.000 -2.200) 9.273 8.564 ( 16.346 0.000 -0.979) 16.375 9.201 ( 8.580 0.000 -8.079) 11.785 9.495 ( 18.771 0.000 17.689) 25.792 10.982 ( -25.002 0.000 -22.908) 33.909 16.582 ( 1.875 0.000 0.127) 1.880 17.046 ( 3.035 0.000 -0.027) 3.035 17.281 ( -0.845 0.000 -2.961) 3.079 18.180 ( -4.461 0.000 -4.636) 6.434 21.424 ( -0.327 0.000 -1.486) 1.521 22.010 ( 7.573 0.000 3.699) 8.428 27.987 ( -0.425 0.000 -0.398) 0.582 28.246 ( 0.020 0.000 4.076) 4.076 36.783 ( -3.295 0.000 2.173) 3.947 37.388 ( -15.926 0.000 -20.463) 25.930 37.599 ( 1.155 0.000 -2.754) 2.986 38.316 ( -10.955 0.000 11.595) 15.951 ======================= Grid point 298 (133/318) ======================= q-point: (-0.08 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 318 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.880 ( -18.021 0.000 15.027) 23.465 1.075 ( -24.559 0.000 19.461) 31.335 1.790 ( 1.260 0.000 43.765) 43.783 2.233 ( -11.195 0.000 -11.519) 16.063 2.856 ( 8.764 0.000 11.284) 14.288 3.050 ( -22.175 0.000 -0.513) 22.181 4.035 ( 2.404 0.000 1.071) 2.632 4.983 ( -5.014 0.000 -12.797) 13.745 5.840 ( 2.222 0.000 8.068) 8.368 5.957 ( 2.724 0.000 6.139) 6.716 6.024 ( 4.286 0.000 -0.151) 4.289 6.444 ( -3.470 0.000 -7.002) 7.815 7.140 ( -2.884 0.000 13.515) 13.820 7.554 ( 12.087 0.000 3.643) 12.624 8.737 ( 9.009 0.000 -13.968) 16.621 9.275 ( 4.857 0.000 -9.635) 10.790 10.180 ( -45.275 0.000 -17.123) 48.405 10.358 ( 53.213 0.000 25.653) 59.073 16.631 ( 2.598 0.000 1.973) 3.262 17.075 ( 0.430 0.000 -1.518) 1.578 17.273 ( 1.400 0.000 -2.782) 3.114 18.011 ( -8.590 0.000 -6.435) 10.733 21.419 ( 0.588 0.000 -1.044) 1.198 21.982 ( -11.248 0.000 -8.094) 13.858 27.999 ( 1.880 0.000 0.175) 1.888 28.236 ( -3.572 0.000 1.139) 3.749 36.749 ( -1.791 0.000 2.299) 2.914 37.445 ( 31.026 0.000 12.138) 33.316 37.597 ( 0.517 0.000 -3.058) 3.102 38.296 ( 2.797 0.000 21.447) 21.629 ======================= Grid point 299 (134/318) ======================= q-point: ( 0.00 0.10 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.125 ( -2.143 17.795 14.867) 23.287 1.451 ( 2.123 36.408 13.714) 38.963 2.372 ( 10.046 27.777 6.423) 30.228 2.489 ( 11.292 19.059 28.074) 35.762 2.797 ( -3.991 3.535 -2.712) 5.982 3.336 ( 14.982 12.513 11.384) 22.597 4.072 ( 2.219 0.522 0.645) 2.370 4.731 ( -11.286 -1.193 -18.871) 22.021 5.679 ( -6.460 -2.151 3.430) 7.624 6.164 ( -2.309 8.766 3.521) 9.725 6.303 ( 0.332 16.746 3.987) 17.217 6.435 ( -3.675 7.146 5.382) 9.671 7.144 ( -5.012 0.782 13.428) 14.354 7.812 ( 5.518 3.431 8.527) 10.720 8.838 ( 9.350 1.567 -9.393) 13.346 9.090 ( -7.868 -8.017 -12.732) 16.979 9.496 ( -23.806 8.886 -5.472) 25.993 11.158 ( 27.963 -13.354 0.960) 31.003 16.730 ( 2.611 2.687 2.647) 4.587 17.069 ( -0.447 2.277 -3.247) 3.991 17.241 ( 1.277 -4.593 -2.151) 5.230 17.789 ( -3.138 -7.210 -7.168) 10.640 21.397 ( -2.911 -2.116 -0.305) 3.611 21.566 ( -8.807 -5.866 3.355) 11.101 28.028 ( 3.590 -2.717 0.189) 4.506 28.104 ( -2.932 -4.521 2.270) 5.847 36.893 ( -2.686 9.839 -3.500) 10.783 37.593 ( -1.607 -1.394 -3.768) 4.327 37.994 ( -2.175 15.023 4.285) 15.773 39.285 ( 56.301 12.496 -7.907) 58.210 ======================= Grid point 300 (135/318) ======================= q-point: ( 0.08 0.10 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.387 ( 16.738 10.358 15.798) 25.239 1.653 ( 10.412 25.564 11.832) 30.032 2.454 ( 8.147 31.125 -6.304) 32.786 2.738 ( 7.491 9.194 1.728) 11.985 3.213 ( 29.062 9.161 26.019) 40.069 3.752 ( 18.106 7.276 16.145) 25.326 4.113 ( 2.588 -2.277 -5.349) 6.364 4.383 ( -10.318 -0.451 -18.895) 21.533 5.660 ( 2.641 -0.442 3.923) 4.749 6.039 ( -16.425 2.352 7.712) 18.297 6.259 ( -8.662 12.661 5.473) 16.288 6.397 ( -1.131 21.756 3.339) 22.040 7.118 ( -6.031 0.175 13.324) 14.627 7.825 ( -10.350 4.112 8.222) 13.844 8.789 ( -8.818 -1.434 -4.461) 9.986 9.060 ( 15.010 -0.107 -8.044) 17.030 9.229 ( -6.605 3.997 -5.432) 9.440 11.333 ( -2.831 -14.411 -12.091) 19.023 16.794 ( 2.162 2.418 3.659) 4.890 17.002 ( -3.957 4.180 -4.837) 7.518 17.278 ( 3.194 -6.011 -1.886) 7.063 17.734 ( 1.032 -8.478 -7.470) 11.346 21.306 ( -5.081 -1.117 2.522) 5.781 21.543 ( 1.349 -1.973 3.386) 4.144 28.038 ( -1.476 -3.223 0.189) 3.550 28.143 ( 4.468 -3.234 2.087) 5.897 36.872 ( 0.892 7.838 -0.015) 7.888 37.532 ( -2.359 -2.900 -3.398) 5.052 37.932 ( -5.703 15.678 2.305) 16.842 39.981 ( 27.492 -3.924 -22.584) 35.794 ======================= Grid point 301 (136/318) ======================= q-point: ( 0.15 0.10 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.797 ( 15.286 5.929 16.458) 23.231 1.956 ( 15.595 15.876 8.272) 23.742 2.613 ( 11.990 27.098 -5.239) 30.092 2.982 ( 19.160 5.997 -7.448) 21.413 3.669 ( -21.312 1.275 -12.262) 24.621 3.904 ( 27.606 -0.614 15.200) 31.520 4.305 ( 12.792 3.716 -1.053) 13.362 4.410 ( 21.079 1.906 4.517) 21.642 5.662 ( -27.432 1.179 9.903) 29.189 5.810 ( 9.879 -0.197 5.214) 11.172 6.120 ( -7.943 17.464 4.039) 19.606 6.410 ( 0.568 24.220 -0.057) 24.226 7.083 ( -6.494 -1.622 13.811) 15.347 7.576 ( -18.783 3.427 4.173) 19.543 8.623 ( -7.878 0.963 -4.915) 9.335 9.067 ( -5.015 1.286 -7.815) 9.375 9.391 ( 18.107 -0.753 5.219) 18.859 11.034 ( -17.033 -12.643 -17.191) 27.304 16.849 ( 1.235 2.911 3.733) 4.892 16.884 ( -5.190 4.727 -4.784) 8.495 17.301 ( 0.898 -4.934 -4.416) 6.682 17.721 ( 0.713 -8.040 -3.446) 8.776 21.263 ( -1.457 0.082 2.394) 2.803 21.602 ( 2.187 -2.283 3.910) 5.028 28.024 ( 0.027 -3.451 -0.008) 3.451 28.238 ( 4.067 -3.510 1.674) 5.627 36.913 ( 3.027 6.361 1.207) 7.147 37.475 ( -1.333 -2.491 -3.351) 4.383 37.825 ( -5.938 15.926 -1.240) 17.042 40.124 ( 5.119 -8.173 -21.416) 23.487 ======================= Grid point 302 (137/318) ======================= q-point: ( 0.23 0.10 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.136 ( 11.613 3.576 14.807) 19.154 2.302 ( 16.862 8.285 4.471) 19.312 2.798 ( 9.281 19.502 -8.375) 23.165 3.091 ( -22.631 3.091 -12.420) 26.000 3.297 ( 15.163 5.969 -12.881) 20.771 4.462 ( 21.972 -5.642 5.012) 23.232 4.530 ( 16.963 -4.838 -3.558) 17.995 4.859 ( 15.066 4.973 8.106) 17.817 5.256 ( -16.238 5.644 6.645) 18.431 5.988 ( 0.249 13.496 2.986) 13.825 6.106 ( 8.833 4.149 7.354) 12.220 6.406 ( -0.416 24.568 -2.151) 24.666 7.033 ( -7.583 -2.323 12.792) 15.051 7.213 ( -21.887 2.917 2.252) 22.196 8.407 ( -12.799 1.632 -3.350) 13.330 8.930 ( -5.078 1.949 -6.813) 8.718 9.764 ( 16.187 -2.227 8.706) 18.514 10.594 ( -17.090 -12.007 -17.499) 27.248 16.762 ( -4.704 6.400 -4.403) 9.082 16.884 ( 0.149 3.709 3.502) 5.103 17.267 ( -0.904 -3.543 -5.108) 6.282 17.708 ( -1.623 -6.269 1.632) 6.678 21.267 ( 0.204 0.286 2.034) 2.064 21.657 ( 0.923 -2.683 3.993) 4.899 28.038 ( 1.475 -3.849 -0.262) 4.130 28.304 ( 2.142 -3.893 0.861) 4.526 36.995 ( 4.708 5.477 1.930) 7.475 37.450 ( 0.743 -0.601 -2.992) 3.141 37.707 ( -4.952 13.398 -3.811) 14.783 40.008 ( -3.342 -8.946 -18.252) 20.600 ======================= Grid point 303 (138/318) ======================= q-point: ( 0.31 0.10 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.391 ( 4.095 3.066 4.238) 6.643 2.489 ( -15.940 12.150 -8.531) 21.783 2.616 ( 14.527 2.402 2.680) 14.966 3.025 ( 7.032 7.266 0.024) 10.111 3.455 ( 10.357 5.521 -15.820) 19.698 4.689 ( -4.581 -1.212 4.796) 6.742 4.847 ( 13.169 -8.753 0.763) 15.831 4.901 ( 8.226 -2.754 -7.204) 11.276 5.378 ( 15.280 7.821 0.960) 17.192 6.013 ( 2.281 17.248 2.732) 17.612 6.326 ( 5.337 2.224 2.951) 6.491 6.381 ( 0.542 20.898 -1.943) 20.995 6.827 ( -18.738 1.822 4.474) 19.351 6.954 ( -8.351 -1.099 8.523) 11.983 8.127 ( -15.336 0.987 -0.983) 15.399 8.801 ( -4.741 2.783 -5.561) 7.820 9.956 ( -0.782 -4.920 -13.330) 14.230 10.356 ( 1.968 -9.931 7.021) 12.321 16.666 ( -3.024 8.245 -3.235) 9.359 16.896 ( -0.776 5.659 2.700) 6.318 17.228 ( -0.391 -2.644 -2.665) 3.775 17.683 ( -3.158 -4.227 5.584) 7.683 21.288 ( 0.624 0.177 2.024) 2.125 21.678 ( -0.924 -2.716 3.081) 4.209 28.070 ( 2.020 -4.140 -0.495) 4.633 28.325 ( 0.025 -4.160 -0.327) 4.173 37.105 ( 5.566 5.244 2.521) 8.052 37.456 ( 0.320 3.275 -1.565) 3.644 37.615 ( -1.152 7.140 -4.979) 8.781 39.824 ( -4.872 -9.252 -16.421) 19.468 ======================= Grid point 304 (139/318) ======================= q-point: ( 0.38 0.10 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.142 ( -6.637 14.564 -0.224) 16.007 2.603 ( 5.780 1.165 4.901) 7.667 2.868 ( 11.053 -1.404 1.938) 11.309 3.124 ( 3.602 1.810 -0.874) 4.125 3.547 ( 11.567 5.236 -16.332) 20.687 4.523 ( -9.843 1.619 1.238) 10.052 4.992 ( 3.484 -4.124 1.028) 5.495 5.129 ( 15.527 -6.426 -9.687) 19.397 5.587 ( 5.408 3.716 -2.219) 6.926 6.030 ( -3.751 5.414 -5.127) 8.347 6.260 ( -10.532 11.384 -3.178) 15.831 6.345 ( 0.857 21.090 -1.684) 21.175 6.733 ( 0.236 -1.929 10.142) 10.327 6.841 ( -6.349 1.214 3.257) 7.238 7.863 ( -12.308 -0.320 1.830) 12.447 8.696 ( -3.164 2.829 -4.540) 6.215 9.735 ( -6.181 -6.184 -21.348) 23.069 10.594 ( 9.972 -8.251 17.217) 21.540 16.617 ( -0.688 9.970 -1.823) 10.158 16.888 ( -1.423 8.084 1.678) 8.378 17.232 ( 1.317 -2.534 1.188) 3.093 17.672 ( -2.183 -2.664 8.478) 9.151 21.312 ( 0.589 -0.025 2.254) 2.330 21.661 ( -2.229 -2.391 1.526) 3.608 28.101 ( 1.595 -4.298 -0.714) 4.640 28.306 ( -1.330 -4.250 -1.505) 4.701 37.222 ( 5.133 5.161 2.773) 7.790 37.407 ( -3.812 7.310 -2.115) 8.511 37.638 ( 5.132 0.202 -2.174) 5.577 39.645 ( -4.014 -9.457 -16.078) 19.080 ======================= Grid point 305 (140/318) ======================= q-point: (-0.54 0.10 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.227 ( 10.090 7.446 11.935) 17.312 2.673 ( 0.203 1.687 -0.114) 1.702 3.034 ( 3.807 -2.070 3.264) 5.425 3.163 ( 3.097 -0.550 -1.740) 3.594 3.732 ( 17.741 3.473 -13.920) 22.816 4.380 ( -3.844 1.775 -4.270) 6.013 5.054 ( 3.139 -1.814 1.344) 3.867 5.267 ( 2.901 -8.296 -8.051) 11.919 5.489 ( -12.686 5.496 -0.730) 13.845 5.837 ( -7.733 -9.053 -13.567) 18.050 6.057 ( -10.094 16.045 -5.470) 19.730 6.406 ( 4.416 22.514 0.768) 22.956 6.668 ( -6.981 6.336 -2.059) 9.649 6.869 ( 1.046 -1.713 10.462) 10.653 7.724 ( -4.199 -1.566 3.819) 5.888 8.638 ( 0.036 1.372 -4.282) 4.497 9.534 ( -2.658 -3.580 -18.122) 18.663 10.866 ( 8.658 -9.582 15.072) 19.848 16.617 ( 1.361 10.713 -0.805) 10.829 16.867 ( -1.459 10.327 0.810) 10.461 17.285 ( 2.358 -2.961 4.243) 5.686 17.712 ( 0.863 -1.865 9.961) 10.171 21.338 ( 0.722 -0.297 2.788) 2.896 21.619 ( -2.614 -1.925 0.010) 3.247 28.116 ( 0.487 -4.369 -0.816) 4.471 28.266 ( -1.658 -4.246 -2.306) 5.108 37.280 ( -3.408 6.929 1.571) 7.880 37.364 ( 3.755 4.578 -1.515) 6.112 37.737 ( 5.206 -0.969 1.189) 5.427 39.483 ( -2.921 -9.438 -17.102) 19.750 ======================= Grid point 306 (141/318) ======================= q-point: (-0.46 0.10 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.469 ( 1.469 -4.723 2.300) 5.455 2.668 ( 2.680 4.881 5.469) 7.805 3.017 ( -5.444 1.319 4.186) 6.993 3.262 ( 6.116 -0.028 1.158) 6.225 3.922 ( 6.633 1.722 -12.432) 14.195 4.426 ( 15.895 -3.201 -7.768) 17.979 4.972 ( -15.633 -5.304 -6.857) 17.876 5.203 ( 2.217 -0.536 -2.583) 3.446 5.323 ( -6.664 1.549 -0.455) 6.857 5.578 ( -12.944 -7.037 -7.800) 16.670 5.800 ( -11.749 13.082 -7.553) 19.137 6.482 ( 1.772 20.634 0.079) 20.710 6.535 ( -4.178 14.921 -1.173) 15.539 6.936 ( -0.570 -0.141 11.549) 11.564 7.743 ( 3.337 -2.691 2.880) 5.165 8.654 ( 4.616 -0.687 -4.541) 6.511 9.419 ( 0.380 -1.362 -14.564) 14.633 11.087 ( 6.848 -11.275 10.799) 17.048 16.645 ( 1.677 9.704 -0.976) 9.896 16.856 ( 0.098 12.193 0.831) 12.222 17.351 ( 1.424 -3.679 4.703) 6.139 17.820 ( 4.217 -1.802 9.765) 10.789 21.376 ( 1.439 -0.741 3.826) 4.154 21.569 ( -2.366 -1.506 -0.988) 2.974 28.109 ( -0.730 -4.279 -0.717) 4.399 28.221 ( -1.512 -4.300 -2.528) 5.212 37.195 ( -4.963 7.440 0.462) 8.955 37.453 ( 5.185 3.997 -0.492) 6.565 37.830 ( 3.178 -1.136 3.387) 4.782 39.326 ( -2.646 -9.032 -19.513) 21.664 ======================= Grid point 307 (142/318) ======================= q-point: (-0.38 0.10 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.264 ( -18.675 -2.446 -3.964) 19.247 2.642 ( -12.396 1.806 -1.896) 12.670 3.028 ( 2.746 -0.928 7.039) 7.613 3.363 ( 3.162 5.119 1.792) 6.278 3.860 ( -2.283 0.236 -14.599) 14.779 4.542 ( -11.686 -5.704 -15.788) 20.454 4.856 ( 11.061 -4.875 12.174) 17.156 5.000 ( -19.387 -4.973 -4.864) 20.598 5.199 ( -10.032 5.737 -8.316) 14.237 5.371 ( 3.957 -1.685 -9.805) 10.707 5.721 ( 4.689 12.453 8.315) 15.691 6.405 ( -4.405 17.325 -2.105) 18.000 6.578 ( 3.358 19.668 3.264) 20.217 7.007 ( 0.857 3.826 13.745) 14.294 7.852 ( 6.993 -4.253 0.169) 8.187 8.752 ( 8.751 -1.380 -5.073) 10.208 9.361 ( 1.434 -1.057 -11.914) 12.047 11.243 ( 4.665 -12.808 5.262) 14.611 16.653 ( 0.142 8.025 -1.978) 8.267 16.891 ( 2.978 12.444 1.344) 12.866 17.380 ( -0.824 -4.419 2.649) 5.217 17.969 ( 5.675 -2.359 7.887) 9.999 21.440 ( 2.611 -1.577 5.019) 5.873 21.524 ( -1.710 -1.237 -0.890) 2.291 28.081 ( -1.806 -3.880 -0.791) 4.353 28.183 ( -1.164 -4.565 -1.664) 4.996 37.114 ( -4.179 9.016 1.305) 10.023 37.540 ( 4.646 4.558 -1.173) 6.613 37.891 ( 0.965 -0.936 4.091) 4.307 39.141 ( -4.101 -7.957 -23.199) 24.866 ======================= Grid point 308 (143/318) ======================= q-point: (-0.31 0.10 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.786 ( -28.910 -1.490 -2.540) 29.060 2.299 ( -21.138 2.870 -2.327) 21.459 3.067 ( -1.786 5.084 0.968) 5.475 3.350 ( -5.778 9.962 -4.856) 12.498 3.675 ( -10.834 -2.050 -11.506) 15.937 4.132 ( -21.040 1.998 -9.155) 23.033 4.564 ( -23.642 -4.509 -0.383) 24.071 4.990 ( -3.545 -0.276 1.551) 3.880 5.043 ( 2.215 4.523 7.133) 8.732 5.681 ( 27.163 -5.714 -6.558) 28.521 5.908 ( 7.429 14.070 8.141) 17.872 6.331 ( -1.802 22.024 -2.062) 22.194 6.680 ( 4.471 8.760 7.828) 12.570 7.147 ( 5.466 9.563 13.317) 17.282 7.997 ( 8.902 -5.220 -0.414) 10.328 8.901 ( 10.437 -1.295 -6.526) 12.377 9.323 ( 1.411 -1.383 -9.346) 9.552 11.309 ( 0.823 -13.821 -1.737) 13.954 16.636 ( -0.308 6.983 -2.158) 7.315 16.967 ( 4.022 10.062 0.809) 10.866 17.352 ( -2.851 -4.680 -0.056) 5.480 18.103 ( 4.394 -3.457 4.488) 7.170 21.470 ( -1.074 -1.037 -1.542) 2.147 21.561 ( 4.138 -3.423 7.776) 9.451 28.034 ( -2.453 -3.346 -1.240) 4.330 28.162 ( -0.692 -4.991 0.511) 5.065 37.062 ( -2.454 12.244 2.620) 12.760 37.608 ( 3.715 5.742 -2.302) 7.216 37.911 ( -0.901 0.395 1.735) 1.994 38.884 ( -8.241 -5.617 -26.060) 27.903 ======================= Grid point 309 (144/318) ======================= q-point: (-0.23 0.10 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.285 ( -23.483 0.882 10.905) 25.906 1.877 ( -23.181 8.501 2.027) 24.774 2.976 ( -9.662 13.531 -3.483) 16.987 3.070 ( -22.240 12.458 -5.994) 26.187 3.209 ( -24.180 13.943 -5.841) 28.517 3.895 ( -1.506 -2.860 -10.517) 11.002 4.094 ( -27.122 -2.963 7.769) 28.368 5.021 ( 5.548 2.092 -3.185) 6.730 5.218 ( 9.885 1.586 12.603) 16.096 6.000 ( 4.523 14.935 9.460) 18.248 6.082 ( 7.097 3.705 -4.028) 8.962 6.388 ( 12.224 16.627 -3.743) 20.974 6.839 ( 6.078 -1.009 12.281) 13.740 7.327 ( 6.493 10.948 5.322) 13.796 8.206 ( 13.637 -4.138 3.979) 14.797 9.040 ( 9.120 -2.999 -9.305) 13.369 9.328 ( 4.420 1.072 -2.418) 5.151 11.222 ( -7.403 -13.613 -10.315) 18.615 16.624 ( 0.346 5.891 -1.516) 6.093 17.036 ( 3.042 6.080 -0.471) 6.815 17.290 ( -2.845 -3.863 -1.463) 5.016 18.168 ( 0.686 -4.904 0.069) 4.952 21.439 ( -0.969 -0.731 -1.720) 2.105 21.707 ( 5.514 -7.530 9.222) 13.120 27.984 ( -1.945 -3.054 -1.158) 3.802 28.161 ( -0.592 -5.566 2.768) 6.244 37.069 ( 1.508 17.203 4.716) 17.901 37.640 ( 1.486 6.533 -5.323) 8.557 37.856 ( -3.441 6.950 -10.033) 12.681 38.542 ( -13.271 -2.167 -16.775) 21.499 ======================= Grid point 310 (145/318) ======================= q-point: (-0.15 0.10 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.182 ( -1.641 11.327 31.184) 33.218 1.519 ( -17.840 16.695 11.851) 27.156 2.350 ( -40.172 20.057 3.783) 45.060 2.758 ( -11.147 18.523 -11.538) 24.505 3.018 ( -2.017 20.389 0.710) 20.501 3.526 ( -25.994 0.337 -3.025) 26.171 3.968 ( 0.859 -1.439 5.088) 5.357 5.074 ( 2.167 1.230 -7.708) 8.101 5.522 ( 12.807 -0.961 13.594) 18.701 6.101 ( 2.580 17.466 7.523) 19.192 6.117 ( 1.494 10.703 -1.318) 10.887 6.559 ( 4.503 6.585 -6.402) 10.229 7.028 ( 4.930 -2.477 12.910) 14.040 7.440 ( 6.365 7.827 -1.809) 10.250 8.528 ( 17.071 -3.299 -2.035) 17.506 9.132 ( 7.247 -5.186 -8.529) 12.335 9.561 ( 20.567 5.348 16.018) 26.612 10.868 ( -22.856 -9.970 -17.442) 30.430 16.634 ( 1.396 4.635 -0.344) 4.853 17.069 ( 1.200 1.642 -1.257) 2.391 17.248 ( -0.446 -2.189 -1.914) 2.942 18.117 ( -4.936 -6.130 -4.439) 9.036 21.417 ( -0.334 -0.619 -1.452) 1.614 21.835 ( 1.778 -14.010 5.895) 15.303 27.956 ( -0.357 -2.970 -0.593) 3.050 28.168 ( -1.066 -6.577 3.892) 7.716 37.208 ( 8.991 13.471 7.888) 18.015 37.485 ( -7.673 25.094 -28.278) 38.578 37.734 ( 0.532 15.286 -7.992) 17.257 38.303 ( -9.130 -0.415 11.028) 14.323 ======================= Grid point 311 (146/318) ======================= q-point: (-0.08 0.10 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.236 ( -12.251 24.192 16.006) 31.489 1.464 ( -9.002 27.022 17.445) 33.400 1.922 ( -1.528 20.291 31.846) 37.792 2.527 ( -6.396 23.018 -9.359) 25.658 3.026 ( -9.208 6.259 0.420) 11.142 3.121 ( -4.929 16.533 4.173) 17.750 4.023 ( 1.962 0.054 3.117) 3.683 4.983 ( -5.152 -0.016 -13.736) 14.670 5.744 ( 0.290 -2.899 9.607) 10.039 6.146 ( 2.028 9.394 -0.348) 9.617 6.216 ( 4.823 14.350 6.965) 16.664 6.489 ( -3.728 8.717 -6.565) 11.532 7.132 ( -1.977 -0.629 13.779) 13.934 7.606 ( 10.760 4.932 3.131) 12.244 8.726 ( 10.819 -1.271 -13.581) 17.410 9.187 ( 3.178 -6.521 -9.450) 11.913 10.178 ( -35.360 -0.993 -9.521) 36.633 10.348 ( 42.610 -0.773 18.651) 46.520 16.672 ( 2.326 3.456 1.140) 4.319 17.076 ( 0.578 0.145 -1.416) 1.536 17.242 ( 0.903 -2.375 -2.942) 3.887 17.947 ( -8.528 -6.307 -6.596) 12.490 21.411 ( 0.342 -0.814 -1.071) 1.388 21.777 ( -10.370 -15.313 0.627) 18.504 27.969 ( 2.055 -2.811 0.034) 3.482 28.153 ( -2.943 -6.583 2.848) 7.753 37.053 ( -10.420 9.593 -13.198) 19.359 37.601 ( 7.133 5.832 -3.604) 9.893 37.849 ( 19.761 34.982 -1.669) 40.212 38.391 ( 17.400 13.126 20.235) 29.741 ======================= Grid point 312 (147/318) ======================= q-point: ( 0.00 0.20 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 522 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.536 ( -6.091 22.026 9.502) 24.750 1.961 ( -1.583 17.657 18.613) 25.704 2.841 ( 6.844 6.578 -4.813) 10.643 2.885 ( 5.216 14.013 1.675) 15.046 3.071 ( 12.654 33.292 20.450) 41.069 3.659 ( 6.178 19.025 -0.207) 20.004 4.187 ( 1.298 12.191 5.362) 13.381 4.693 ( -12.444 -2.192 -20.127) 23.764 5.660 ( -4.764 -0.090 3.392) 5.849 6.299 ( -8.872 2.338 10.478) 13.927 6.404 ( 4.175 3.293 7.015) 8.802 6.924 ( -2.628 31.064 3.788) 31.404 7.192 ( -0.534 5.328 9.902) 11.257 7.903 ( 5.841 5.629 7.789) 11.246 8.866 ( 13.675 -0.002 -11.357) 17.776 9.006 ( -5.482 0.755 -12.877) 14.016 9.638 ( -23.528 5.820 -2.509) 24.367 10.863 ( 18.107 -15.320 6.414) 24.571 16.782 ( 2.123 2.367 2.352) 3.955 17.097 ( 1.663 -1.624 -1.140) 2.589 17.163 ( -0.835 -0.892 -5.674) 5.804 17.603 ( -4.315 -11.056 -8.090) 14.364 21.347 ( -3.998 -2.391 1.159) 4.800 21.472 ( -1.375 -3.524 2.641) 4.614 27.957 ( 3.037 -4.190 0.266) 5.181 28.002 ( -1.249 -5.477 2.408) 6.112 37.022 ( -0.949 3.333 -3.689) 5.061 37.509 ( -3.594 -6.338 -3.327) 8.010 38.397 ( -2.324 23.554 4.075) 24.017 39.554 ( 32.776 12.677 -12.913) 37.440 ======================= Grid point 313 (148/318) ======================= q-point: ( 0.08 0.20 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 522 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.657 ( 10.586 16.411 12.243) 23.049 2.072 ( 3.563 16.013 13.728) 21.391 2.907 ( 5.184 11.863 -2.552) 13.196 2.984 ( 10.841 10.059 -4.274) 15.394 3.565 ( 15.027 25.314 17.344) 34.168 3.926 ( 22.633 9.162 11.067) 26.808 4.137 ( -10.002 5.064 -13.781) 17.765 4.396 ( -3.843 4.205 -6.431) 8.591 5.661 ( 2.793 0.521 3.627) 4.607 6.115 ( -18.193 5.265 10.731) 21.768 6.445 ( -3.745 3.748 8.359) 9.897 6.915 ( -1.756 25.975 6.038) 26.725 7.215 ( -1.738 12.090 4.517) 13.023 7.954 ( -7.798 9.104 7.731) 14.264 8.806 ( -4.766 3.714 -12.584) 13.959 9.067 ( 13.527 1.150 -6.189) 14.920 9.312 ( -11.742 4.318 1.158) 12.564 10.990 ( -4.242 -18.836 -4.388) 19.800 16.841 ( 2.379 1.913 2.978) 4.264 17.092 ( -3.100 1.445 -5.488) 6.467 17.140 ( 3.311 -4.254 -1.075) 5.497 17.528 ( 0.938 -11.490 -7.997) 14.030 21.288 ( -2.828 -0.460 2.082) 3.542 21.494 ( 1.597 -2.796 2.178) 3.887 27.956 ( -1.529 -4.698 0.390) 4.956 28.059 ( 4.212 -5.006 1.750) 6.773 37.010 ( 1.071 5.180 -1.708) 5.559 37.446 ( -1.095 -5.553 -3.018) 6.414 38.344 ( -5.669 24.359 2.773) 25.163 39.909 ( 14.605 -2.873 -16.323) 22.091 ======================= Grid point 314 (149/318) ======================= q-point: ( 0.15 0.20 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 522 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.968 ( 12.503 11.165 13.664) 21.626 2.260 ( 9.448 13.667 7.455) 18.211 3.038 ( 8.860 9.025 -1.414) 12.726 3.181 ( 13.422 14.139 -6.537) 20.562 3.708 ( -18.583 3.361 -20.692) 28.014 3.892 ( 15.028 0.498 8.921) 17.483 4.395 ( 8.010 3.251 -1.028) 8.705 4.543 ( 24.052 13.316 13.310) 30.544 5.723 ( -16.260 3.650 8.995) 18.937 5.840 ( 0.469 4.468 5.195) 6.868 6.404 ( -5.097 6.516 8.032) 11.530 6.915 ( -2.916 18.232 6.994) 19.744 7.185 ( -2.951 18.137 0.896) 18.398 7.720 ( -18.431 13.244 3.219) 22.923 8.677 ( -5.007 4.927 -8.509) 11.033 9.094 ( -5.256 1.328 -5.507) 7.728 9.386 ( 14.347 0.787 8.078) 16.484 10.723 ( -17.341 -17.508 -11.319) 27.118 16.900 ( 1.961 2.178 2.711) 3.992 16.999 ( -3.032 4.520 -4.972) 7.372 17.185 ( 2.219 -5.079 -2.658) 6.147 17.527 ( 2.470 -10.418 -4.045) 11.446 21.269 ( -0.703 0.546 1.785) 1.995 21.543 ( 1.893 -3.508 2.605) 4.762 27.937 ( -0.422 -4.850 -0.046) 4.869 28.143 ( 3.480 -5.837 1.434) 6.946 37.038 ( 2.808 5.238 -0.735) 5.988 37.431 ( 1.130 -2.213 -2.375) 3.438 38.221 ( -8.385 23.062 0.223) 24.540 39.937 ( 0.250 -9.632 -15.917) 18.606 ======================= Grid point 315 (150/318) ======================= q-point: ( 0.23 0.20 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 522 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.252 ( 9.878 8.051 11.966) 17.481 2.477 ( 10.115 8.875 3.152) 13.821 3.126 ( -3.419 3.580 -1.235) 5.102 3.229 ( -9.962 17.839 -17.814) 27.107 3.445 ( 14.011 8.408 -11.746) 20.124 4.264 ( 18.584 -11.533 7.429) 23.099 4.517 ( 8.985 0.397 -3.860) 9.787 4.971 ( 7.443 7.482 7.708) 13.069 5.408 ( -10.233 9.032 6.236) 15.006 6.038 ( 10.824 -1.248 4.937) 11.963 6.374 ( -2.650 9.941 7.779) 12.898 6.873 ( -6.108 8.069 6.005) 11.768 7.120 ( -4.553 21.497 0.103) 21.974 7.379 ( -18.273 18.178 0.977) 25.793 8.473 ( -12.493 5.298 -5.070) 14.486 8.973 ( -4.624 2.090 -5.050) 7.159 9.721 ( 14.379 -1.388 9.425) 17.249 10.302 ( -17.790 -15.868 -12.828) 27.071 16.895 ( -1.939 5.269 -4.235) 7.033 16.981 ( 1.899 5.195 2.681) 6.147 17.190 ( 0.784 -2.891 -4.023) 5.016 17.557 ( 1.237 -7.986 1.474) 8.215 21.276 ( 0.284 0.664 1.571) 1.730 21.587 ( 0.974 -4.157 2.679) 5.041 27.941 ( 0.911 -5.421 -0.273) 5.504 28.198 ( 1.707 -6.590 0.584) 6.833 37.109 ( 5.038 5.182 0.384) 7.237 37.454 ( 2.518 0.799 -1.659) 3.120 38.046 ( -9.567 19.968 -2.296) 22.261 39.784 ( -5.803 -12.651 -14.690) 20.236 ======================= Grid point 316 (151/318) ======================= q-point: ( 0.31 0.20 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 522 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.470 ( 7.131 5.485 7.377) 11.634 2.672 ( 9.698 3.147 0.587) 10.213 2.795 ( -14.597 16.628 -11.953) 25.148 3.172 ( -0.180 6.729 -2.456) 7.165 3.605 ( 9.538 9.389 -12.916) 18.600 4.621 ( 15.191 -13.220 3.824) 20.498 4.677 ( 6.618 -1.662 -0.592) 6.850 4.885 ( -6.218 3.093 -1.209) 7.049 5.500 ( 8.935 3.308 -0.421) 9.537 6.196 ( 0.501 -1.084 -0.943) 1.522 6.422 ( 3.429 5.793 9.378) 11.544 6.774 ( -6.282 0.619 4.380) 7.683 6.976 ( -12.530 21.785 3.449) 25.367 7.138 ( -6.114 27.461 -1.574) 28.177 8.177 ( -16.278 4.642 -2.372) 17.092 8.853 ( -5.105 1.671 -4.963) 7.313 9.823 ( -6.378 -7.715 -16.674) 19.448 10.150 ( 6.737 -8.937 14.430) 18.261 16.844 ( -0.571 7.595 -3.891) 8.552 17.043 ( 2.440 7.926 3.875) 9.154 17.178 ( 0.429 -0.891 -3.094) 3.248 17.586 ( -0.369 -4.592 5.746) 7.364 21.293 ( 0.495 0.421 1.582) 1.710 21.606 ( -0.404 -4.300 2.049) 4.780 27.964 ( 1.560 -6.075 -0.415) 6.286 28.212 ( -0.133 -7.041 -0.619) 7.069 37.223 ( 6.235 5.819 1.810) 8.718 37.503 ( 3.477 2.059 -0.857) 4.130 37.853 ( -8.933 15.631 -3.962) 18.435 39.580 ( -6.532 -14.540 -13.941) 21.176 ======================= Grid point 317 (152/318) ======================= q-point: ( 0.38 0.20 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 522 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.481 ( -6.504 16.729 -7.526) 19.463 2.655 ( 3.792 5.446 3.934) 7.714 2.844 ( 8.316 -0.468 -0.644) 8.354 3.152 ( -0.063 0.721 -2.241) 2.355 3.685 ( 8.830 8.447 -11.943) 17.087 4.601 ( -9.154 6.455 1.989) 11.376 4.873 ( 9.652 -7.545 1.983) 12.411 4.956 ( 10.829 -10.212 -9.389) 17.599 5.611 ( 4.514 -4.834 -5.026) 8.307 5.979 ( -17.885 -2.979 -7.909) 19.781 6.567 ( -0.069 -2.041 8.394) 8.639 6.669 ( -4.751 10.427 -2.245) 11.676 6.868 ( -0.282 20.044 9.609) 22.230 7.064 ( -2.041 29.064 -1.236) 29.162 7.879 ( -13.899 2.700 -0.216) 14.161 8.729 ( -4.613 -0.828 -5.834) 7.483 9.607 ( -4.146 -4.677 -15.528) 16.739 10.407 ( 8.568 -9.486 16.003) 20.481 16.831 ( 1.195 9.320 -2.532) 9.731 17.110 ( 2.094 13.661 3.018) 14.146 17.178 ( 0.906 -2.199 0.391) 2.410 17.619 ( -0.371 -1.593 8.624) 8.778 21.311 ( 0.406 0.047 1.735) 1.783 21.597 ( -1.479 -3.924 0.939) 4.298 27.988 ( 1.257 -6.622 -0.567) 6.764 28.190 ( -1.279 -7.191 -1.775) 7.516 37.348 ( 5.639 6.794 2.248) 9.111 37.560 ( 1.186 5.134 0.787) 5.328 37.692 ( -4.000 7.975 -4.474) 9.980 39.389 ( -5.096 -15.691 -13.946) 21.602 ======================= Grid point 318 (153/318) ======================= q-point: (-0.54 0.20 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 522 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.389 ( -0.008 7.784 -2.868) 8.296 2.729 ( 1.568 3.992 0.798) 4.363 2.982 ( 7.090 -2.745 0.405) 7.613 3.150 ( 1.972 -0.753 -3.688) 4.249 3.829 ( 12.996 5.986 -8.820) 16.808 4.444 ( -6.330 4.795 -5.004) 9.386 5.010 ( 3.395 -4.174 -1.460) 5.575 5.055 ( 4.782 -10.533 -5.931) 13.000 5.535 ( -12.825 -16.675 -15.069) 25.877 5.628 ( -8.212 4.330 1.253) 9.368 6.348 ( -14.247 8.246 -6.362) 17.648 6.759 ( 2.879 0.386 7.661) 8.193 6.938 ( -0.036 22.432 6.878) 23.463 7.057 ( 2.550 30.628 0.755) 30.744 7.699 ( -5.240 -0.161 0.815) 5.306 8.626 ( -1.879 -3.776 -7.138) 8.291 9.488 ( -0.583 0.692 -11.297) 11.333 10.636 ( 6.525 -12.487 13.833) 19.744 16.851 ( 1.884 10.672 -1.528) 10.944 17.134 ( 0.414 12.185 -0.949) 12.229 17.233 ( 2.048 1.795 6.531) 7.076 17.682 ( 1.389 -0.244 9.864) 9.964 21.330 ( 0.468 -0.413 2.103) 2.194 21.566 ( -1.929 -3.295 -0.169) 3.822 28.000 ( 0.318 -6.975 -0.618) 7.010 28.150 ( -1.565 -7.190 -2.572) 7.795 37.451 ( 3.185 8.723 1.369) 9.387 37.494 ( -3.833 9.260 -1.481) 10.130 37.716 ( 4.609 -0.992 0.593) 4.751 39.226 ( -3.408 -15.969 -14.875) 22.088 ======================= Grid point 319 (154/318) ======================= q-point: (-0.46 0.20 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 522 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.380 ( -1.785 -4.073 -3.112) 5.428 2.745 ( 1.062 2.759 -0.549) 3.007 3.027 ( -4.392 -0.850 0.819) 4.548 3.251 ( 11.137 -1.417 -2.473) 11.496 3.987 ( 5.832 5.001 -8.095) 11.160 4.372 ( 6.933 -2.065 -10.370) 12.644 4.838 ( -13.731 -8.282 -10.066) 18.933 5.081 ( -4.349 -8.568 -0.160) 9.610 5.351 ( 0.919 -6.839 -6.336) 9.368 5.484 ( -8.124 3.286 0.770) 8.797 6.051 ( -11.991 10.669 -5.825) 17.074 6.794 ( -3.219 2.746 7.977) 9.030 6.963 ( -0.130 25.475 4.206) 25.820 7.160 ( 6.181 29.666 3.818) 30.542 7.681 ( 2.556 -2.751 -1.521) 4.051 8.596 ( 3.728 -5.784 -7.396) 10.102 9.431 ( 0.207 3.785 -8.340) 9.161 10.812 ( 4.696 -15.175 10.597) 19.095 16.868 ( 0.583 11.253 -1.407) 11.355 17.137 ( 0.877 9.498 -1.263) 9.622 17.300 ( 0.330 4.459 7.185) 8.463 17.788 ( 3.702 -0.643 9.466) 10.184 21.357 ( 0.957 -1.070 2.838) 3.180 21.527 ( -1.879 -2.668 -0.889) 3.382 27.994 ( -0.585 -7.003 -0.384) 7.038 28.105 ( -1.507 -7.191 -2.901) 7.899 37.385 ( -4.323 10.849 -0.086) 11.679 37.562 ( 5.733 6.872 -0.466) 8.962 37.804 ( 3.353 -1.357 2.943) 4.663 39.080 ( -2.372 -15.226 -16.989) 22.936 ======================= Grid point 320 (155/318) ======================= q-point: (-0.38 0.20 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 522 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.204 ( -15.035 -3.364 -7.220) 17.015 2.671 ( -11.389 0.908 -5.017) 12.478 2.987 ( 4.060 -3.256 4.409) 6.821 3.428 ( 9.194 -0.489 -5.510) 10.730 3.926 ( -4.776 7.815 -10.820) 14.176 4.431 ( -4.589 -4.935 -10.501) 12.477 4.724 ( 8.445 -8.810 1.217) 12.264 4.897 ( -12.843 -4.588 6.830) 15.252 5.201 ( -10.994 -3.633 -5.148) 12.671 5.425 ( 2.776 4.614 -13.056) 14.123 5.967 ( 3.331 11.316 8.518) 14.550 6.781 ( -2.771 8.262 8.353) 12.071 6.970 ( -2.055 25.664 4.449) 26.128 7.318 ( 7.840 29.291 5.023) 30.735 7.748 ( 6.751 -5.466 -5.433) 10.246 8.678 ( 9.371 -6.480 -7.583) 13.686 9.387 ( -0.445 4.704 -6.201) 7.796 10.933 ( 2.795 -16.963 6.457) 18.365 16.851 ( -1.355 10.735 -1.694) 10.952 17.148 ( 0.931 5.574 -1.717) 5.907 17.326 ( -1.453 6.086 5.571) 8.378 17.917 ( 4.276 -2.265 7.542) 8.961 21.401 ( 1.699 -2.145 3.729) 4.625 21.489 ( -1.530 -2.181 -0.868) 2.802 27.975 ( -1.242 -6.510 -0.143) 6.629 28.062 ( -1.321 -7.317 -2.404) 7.814 37.325 ( -2.629 10.924 1.735) 11.370 37.671 ( 6.672 8.599 -1.822) 11.035 37.871 ( 1.721 -0.933 4.258) 4.687 38.928 ( -2.353 -12.965 -20.432) 24.313 ======================= Grid point 321 (156/318) ======================= q-point: (-0.31 0.20 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 522 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.765 ( -24.471 0.137 -6.698) 25.372 2.377 ( -15.857 5.063 -1.543) 16.717 3.153 ( 8.631 3.441 2.034) 9.512 3.524 ( 5.164 -4.470 -8.724) 11.080 3.700 ( -11.120 15.170 -9.982) 21.294 4.191 ( -17.804 3.606 -5.945) 19.114 4.456 ( -21.816 -6.242 -0.746) 22.703 4.975 ( -1.208 -0.023 5.807) 5.931 5.143 ( 5.208 3.861 8.401) 10.611 5.547 ( 22.401 -6.838 -12.741) 26.662 6.146 ( 6.280 7.624 12.144) 15.654 6.796 ( -1.696 8.388 10.380) 13.453 6.949 ( -1.805 30.520 2.742) 30.696 7.490 ( 7.311 23.787 2.802) 25.042 7.883 ( 11.660 -4.258 -4.081) 13.067 8.822 ( 10.866 -6.729 -9.841) 16.130 9.352 ( 0.402 5.275 -3.082) 6.123 10.982 ( -0.391 -17.499 1.359) 17.556 16.806 ( -2.109 9.144 -1.767) 9.549 17.139 ( -0.759 0.167 -2.225) 2.357 17.320 ( -1.735 8.192 2.783) 8.824 18.016 ( 2.293 -4.807 4.177) 6.768 21.440 ( -0.196 -2.023 -0.551) 2.105 21.484 ( 1.226 -3.832 4.795) 6.260 27.944 ( -1.872 -5.564 -0.809) 5.926 28.034 ( -0.752 -7.544 -0.286) 7.586 37.304 ( -1.607 10.043 3.715) 10.828 37.777 ( 6.058 10.289 -4.508) 12.763 37.933 ( 2.505 2.414 6.049) 6.978 38.745 ( -3.063 -7.562 -24.319) 25.651 ======================= Grid point 322 (157/318) ======================= q-point: (-0.23 0.20 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 522 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.401 ( -11.728 11.388 12.014) 20.287 2.090 ( -15.569 12.624 4.406) 20.523 3.201 ( -7.770 8.301 -9.724) 14.961 3.417 ( -5.772 13.404 -6.142) 15.834 3.477 ( -12.970 15.077 -10.101) 22.306 3.875 ( -3.923 2.853 0.930) 4.939 4.046 ( -23.647 -0.187 4.210) 24.020 5.067 ( 7.512 2.717 -1.573) 8.141 5.278 ( 5.422 4.280 12.096) 13.930 5.949 ( 20.476 -10.005 -4.726) 23.274 6.293 ( 1.765 6.361 11.566) 13.317 6.843 ( -0.286 1.440 13.697) 13.775 6.963 ( 2.680 36.318 0.079) 36.417 7.590 ( 3.484 14.204 -3.173) 14.966 8.144 ( 16.883 -0.266 0.719) 16.900 8.944 ( 9.345 -6.001 -11.800) 16.205 9.403 ( 6.308 6.674 2.880) 9.624 10.913 ( -6.774 -15.934 -4.420) 17.869 16.760 ( -1.718 6.791 -1.444) 7.152 17.101 ( -1.611 -2.054 -1.760) 3.148 17.297 ( -1.507 7.343 -0.423) 7.508 18.037 ( -1.588 -7.786 -0.115) 7.947 21.419 ( -0.735 -1.248 -1.489) 2.077 21.550 ( 1.214 -7.324 6.603) 9.936 27.903 ( -1.549 -4.848 -1.227) 5.235 28.027 ( -0.612 -7.410 1.948) 7.686 37.294 ( -2.507 4.972 3.584) 6.622 37.813 ( 0.818 5.989 -5.649) 8.274 38.072 ( 9.341 14.676 5.664) 18.295 38.543 ( -2.047 4.316 -24.747) 25.203 ======================= Grid point 323 (158/318) ======================= q-point: (-0.15 0.20 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 522 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.526 ( 7.867 20.239 31.795) 38.502 1.875 ( -11.926 20.323 10.691) 25.875 2.770 ( -25.520 18.929 -6.233) 32.379 3.120 ( -8.914 13.340 -16.523) 23.031 3.385 ( -6.543 11.946 -2.162) 13.791 3.670 ( -13.016 18.849 1.001) 22.929 3.969 ( 4.543 2.634 9.035) 10.451 5.118 ( 0.682 3.205 -9.226) 9.791 5.534 ( 11.299 2.046 15.239) 19.081 6.151 ( 5.410 -6.621 -4.422) 9.626 6.352 ( -1.864 6.212 9.321) 11.355 6.967 ( 3.950 4.116 12.023) 13.307 7.014 ( 0.979 28.543 2.475) 28.666 7.621 ( 3.613 9.914 -2.729) 10.899 8.458 ( 16.794 -3.186 -5.760) 18.038 9.045 ( 8.220 -3.226 -9.758) 13.160 9.677 ( 19.700 6.198 13.742) 24.806 10.656 ( -16.990 -10.333 -9.067) 21.855 16.732 ( -0.470 4.515 -0.466) 4.563 17.075 ( -0.114 -0.846 -0.864) 1.215 17.257 ( -1.632 3.361 -3.271) 4.966 17.952 ( -6.189 -10.148 -4.336) 12.653 21.400 ( -0.392 -1.057 -1.295) 1.717 21.582 ( -2.300 -10.235 5.803) 11.988 27.881 ( 0.010 -4.316 -0.813) 4.392 28.028 ( -1.047 -7.102 3.108) 7.823 37.229 ( -5.339 -1.591 -1.811) 5.858 37.740 ( -4.355 0.624 -6.258) 7.649 38.348 ( 8.495 13.282 15.009) 21.768 38.446 ( 14.762 33.332 -26.087) 44.827 ======================= Grid point 324 (159/318) ======================= q-point: (-0.08 0.20 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 522 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.694 ( -13.114 17.255 14.866) 26.281 1.879 ( 0.831 23.906 21.946) 32.462 2.504 ( 3.687 27.639 13.121) 30.816 2.918 ( -2.760 11.693 -14.889) 19.132 3.145 ( -13.931 11.076 1.738) 17.882 3.599 ( 1.714 26.827 -2.172) 26.970 4.100 ( 3.452 8.620 8.389) 12.514 4.985 ( -6.869 0.416 -15.660) 17.105 5.725 ( -1.948 0.156 9.235) 9.440 6.234 ( 8.643 -1.659 -0.214) 8.803 6.352 ( -4.045 3.964 9.644) 11.184 6.970 ( -3.272 34.480 0.103) 34.635 7.118 ( 0.994 -0.676 14.622) 14.672 7.732 ( 7.844 7.442 2.847) 11.181 8.682 ( 14.231 -2.948 -12.607) 19.239 9.097 ( 2.876 -1.943 -10.283) 10.853 10.130 ( -15.910 -3.504 2.000) 16.414 10.333 ( 20.072 -0.807 7.417) 21.413 16.740 ( 1.133 3.182 1.071) 3.544 17.082 ( 1.059 0.502 -1.018) 1.552 17.206 ( -0.907 -1.009 -5.033) 5.213 17.774 ( -8.366 -10.765 -6.993) 15.323 21.387 ( -0.572 -1.508 -0.856) 1.826 21.529 ( -5.938 -8.797 4.341) 11.467 27.899 ( 2.302 -3.973 -0.092) 4.593 28.021 ( -1.797 -6.513 3.019) 7.401 37.101 ( -4.642 -0.456 -5.643) 7.321 37.614 ( -5.163 -3.637 -4.345) 7.666 38.394 ( -0.102 19.911 3.083) 20.148 38.934 ( 36.958 32.162 -7.999) 49.641 ======================= Grid point 325 (160/318) ======================= q-point: ( 0.00 0.30 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.938 ( -4.240 17.672 10.086) 20.785 2.279 ( -5.234 15.693 11.393) 20.086 2.867 ( 4.821 -2.159 -5.699) 7.771 3.063 ( 0.606 5.082 0.929) 5.201 3.616 ( 18.307 19.911 10.243) 28.923 4.047 ( -3.039 17.248 -4.922) 18.193 4.475 ( 4.033 13.645 7.808) 16.230 4.683 ( -13.111 2.928 -18.702) 23.026 5.672 ( -2.986 1.509 3.552) 4.880 6.238 ( -1.895 -6.598 6.874) 9.715 6.541 ( -2.056 9.522 15.434) 18.251 7.172 ( -2.781 0.273 14.558) 14.824 7.646 ( 1.029 30.459 -0.088) 30.477 8.031 ( 6.529 7.224 6.847) 11.904 8.856 ( 13.866 0.776 -11.584) 18.085 9.091 ( 0.682 5.706 -9.005) 10.682 9.748 ( -20.344 5.957 -0.393) 21.202 10.573 ( 9.146 -13.919 6.410) 17.846 16.822 ( 0.371 1.649 1.876) 2.525 17.036 ( -3.010 -2.598 -2.754) 4.837 17.180 ( 3.440 0.706 -5.652) 6.654 17.375 ( -3.992 -11.338 -8.674) 14.824 21.317 ( -2.446 -0.652 1.236) 2.817 21.415 ( 0.337 -2.408 1.045) 2.646 27.873 ( 1.783 -4.044 0.721) 4.478 27.899 ( 0.144 -4.716 2.046) 5.143 37.054 ( 0.604 0.715 -1.891) 2.110 37.367 ( -4.035 -7.518 -2.813) 8.983 38.871 ( 0.107 23.544 4.060) 23.892 39.739 ( 16.476 5.518 -10.267) 20.182 ======================= Grid point 326 (161/318) ======================= q-point: ( 0.08 0.30 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.006 ( 6.127 18.015 8.888) 21.002 2.332 ( 2.512 11.478 12.588) 17.220 2.954 ( 5.950 -4.248 -2.637) 7.772 3.135 ( 9.388 5.603 -0.982) 10.977 3.930 ( -5.151 7.535 -0.299) 9.132 4.007 ( 10.133 0.129 -10.107) 14.312 4.397 ( -1.797 20.250 -1.826) 20.411 4.586 ( 3.356 12.748 7.748) 15.290 5.686 ( 2.090 2.354 4.013) 5.100 6.199 ( -7.738 0.607 8.037) 11.173 6.484 ( -11.619 4.360 13.953) 18.673 7.146 ( -7.453 0.602 9.935) 12.434 7.688 ( 2.344 28.509 -0.094) 28.605 8.165 ( 0.989 11.027 6.992) 13.094 8.920 ( 1.391 6.622 -16.884) 18.189 9.125 ( 8.536 4.809 -4.668) 10.853 9.423 ( -14.338 8.071 5.928) 17.489 10.624 ( -5.740 -17.845 -0.290) 18.748 16.846 ( 1.314 -2.102 2.178) 3.300 16.991 ( -0.769 -4.344 -1.363) 4.617 17.196 ( 1.592 3.005 -5.995) 6.892 17.314 ( 2.918 -9.074 -8.230) 12.593 21.290 ( -1.221 0.601 1.299) 1.881 21.438 ( 1.297 -2.801 1.072) 3.268 27.867 ( -1.328 -3.935 0.696) 4.211 27.956 ( 3.231 -5.221 1.548) 6.332 37.073 ( 1.906 1.582 -1.418) 2.854 37.325 ( 1.308 -6.377 -2.366) 6.927 38.837 ( -5.924 24.451 2.824) 25.316 39.863 ( 3.587 -2.418 -10.519) 11.374 ======================= Grid point 327 (162/318) ======================= q-point: ( 0.15 0.30 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.223 ( 9.634 14.059 9.633) 19.577 2.494 ( 7.370 10.281 7.383) 14.646 3.064 ( 6.643 -3.400 1.787) 7.674 3.377 ( 16.132 5.739 -4.657) 17.744 3.752 ( -8.302 -1.307 -15.410) 17.553 3.908 ( -2.810 0.385 -4.703) 5.493 4.532 ( 2.680 10.939 3.303) 11.736 4.824 ( 17.023 13.186 11.296) 24.315 5.768 ( 0.426 1.817 6.111) 6.390 6.012 ( -14.447 11.307 7.416) 19.788 6.387 ( -5.543 -4.635 10.929) 13.102 7.023 ( -11.060 -3.497 6.780) 13.435 7.703 ( -0.864 26.934 -0.674) 26.956 8.096 ( -9.944 20.672 1.486) 22.987 8.816 ( -3.399 8.642 -13.452) 16.347 9.119 ( -5.186 1.229 -4.474) 6.958 9.453 ( 9.731 6.916 12.131) 17.019 10.388 ( -16.090 -15.534 -6.125) 23.189 16.895 ( 2.238 -3.790 1.774) 4.746 16.981 ( 0.309 -3.737 -0.568) 3.793 17.193 ( 2.444 3.654 -5.610) 7.127 17.358 ( 5.411 -5.386 -5.101) 9.182 21.285 ( -0.150 1.140 1.128) 1.610 21.471 ( 1.424 -3.572 1.362) 4.079 27.849 ( -0.775 -3.715 0.151) 3.798 28.018 ( 2.433 -6.465 1.250) 7.020 37.108 ( 3.287 2.259 -1.468) 4.250 37.376 ( 4.601 -3.649 -1.039) 5.964 38.689 ( -10.928 23.247 0.715) 25.697 39.768 ( -6.225 -7.531 -10.603) 14.418 ======================= Grid point 328 (163/318) ======================= q-point: ( 0.23 0.30 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.443 ( 8.262 10.878 7.944) 15.802 2.646 ( 5.413 8.029 2.696) 10.051 3.145 ( -0.833 0.267 -0.793) 1.181 3.512 ( -6.383 8.607 -15.201) 18.599 3.627 ( 14.942 9.661 -8.833) 19.865 4.012 ( 13.071 -13.986 5.962) 20.050 4.548 ( 0.148 3.616 -1.040) 3.766 5.153 ( 8.530 9.283 5.868) 13.905 5.576 ( -17.083 7.564 6.551) 19.798 6.028 ( 7.536 1.264 4.071) 8.658 6.388 ( -1.631 -5.015 9.583) 10.938 6.823 ( -13.714 -8.424 4.786) 16.791 7.641 ( -5.502 25.688 -0.464) 26.274 7.892 ( -10.260 26.527 -1.990) 28.511 8.609 ( -11.726 7.830 -7.407) 15.927 8.999 ( -5.572 0.151 -4.827) 7.373 9.737 ( 11.285 3.532 10.395) 15.744 10.033 ( -15.280 -9.888 -6.922) 19.472 16.915 ( -0.041 -2.867 -1.631) 3.298 17.020 ( 3.229 -1.747 2.360) 4.364 17.224 ( 3.980 5.592 -4.257) 8.076 17.444 ( 5.476 -2.376 -0.290) 5.976 21.294 ( 0.276 1.134 1.048) 1.568 21.502 ( 0.863 -4.241 1.426) 4.556 27.843 ( 0.155 -4.077 -0.156) 4.083 28.056 ( 1.002 -7.463 0.425) 7.542 37.188 ( 5.942 3.053 -0.556) 6.703 37.462 ( 4.728 -0.725 -0.229) 4.788 38.455 ( -13.617 20.507 -1.581) 24.667 39.542 ( -10.402 -11.350 -10.704) 18.751 ======================= Grid point 329 (164/318) ======================= q-point: ( 0.31 0.30 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.609 ( 4.813 8.334 5.143) 10.912 2.742 ( 5.117 3.972 -1.254) 6.598 3.071 ( -3.057 9.848 -6.355) 12.112 3.293 ( -8.898 6.060 -8.076) 13.459 3.821 ( 9.429 12.275 -10.344) 18.617 4.346 ( 16.791 -13.992 4.931) 22.406 4.588 ( 7.353 -5.985 -3.863) 10.238 5.078 ( -14.983 15.630 4.841) 22.186 5.468 ( 0.120 -7.388 -3.151) 8.033 6.160 ( 0.953 -1.014 -0.592) 1.512 6.408 ( -1.822 -4.573 8.816) 10.097 6.639 ( -6.691 -10.484 6.763) 14.157 7.506 ( -7.988 25.993 0.552) 27.198 7.723 ( -6.365 25.729 -2.883) 26.661 8.320 ( -15.591 9.494 -3.351) 18.559 8.832 ( -8.486 -4.212 -6.671) 11.587 9.728 ( -6.185 0.130 -9.957) 11.722 10.040 ( 7.871 -2.380 14.149) 16.366 16.905 ( 0.469 -0.701 -1.632) 1.837 17.095 ( 2.863 -2.305 1.880) 4.128 17.291 ( 5.127 10.100 -1.205) 11.391 17.551 ( 4.618 1.677 4.033) 6.356 21.305 ( 0.269 0.835 1.049) 1.368 21.517 ( -0.023 -4.508 1.070) 4.633 27.851 ( 0.716 -4.854 -0.377) 4.921 28.060 ( -0.421 -7.993 -0.729) 8.037 37.316 ( 7.543 3.768 0.910) 8.480 37.542 ( 4.022 1.378 -0.013) 4.252 38.184 ( -13.587 17.051 -3.237) 22.041 39.284 ( -10.029 -14.710 -10.880) 20.864 ======================= Grid point 330 (165/318) ======================= q-point: ( 0.38 0.30 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.667 ( -1.075 5.041 -0.383) 5.169 2.808 ( 2.947 2.996 -5.112) 6.617 2.955 ( -3.059 14.411 -9.463) 17.510 3.154 ( -1.360 -0.137 -4.142) 4.362 3.870 ( 4.698 10.210 -9.229) 14.542 4.620 ( 8.530 -10.239 2.340) 13.531 4.767 ( 9.630 -9.012 -4.816) 14.041 4.848 ( -6.434 10.823 0.588) 12.605 5.381 ( -5.927 -15.491 -10.197) 19.470 5.969 ( -14.824 -0.146 -3.791) 15.302 6.496 ( 1.499 -3.862 9.665) 10.515 6.622 ( -0.969 -7.042 4.172) 8.242 7.409 ( -2.573 24.805 3.303) 25.156 7.619 ( -3.422 21.323 -1.682) 21.661 8.019 ( -14.223 13.002 -1.350) 19.317 8.637 ( -7.064 -7.520 -8.101) 13.118 9.619 ( -0.837 6.186 -6.445) 8.972 10.248 ( 5.767 -6.384 12.689) 15.330 16.921 ( 1.797 0.486 -0.161) 1.869 17.140 ( 1.318 -2.692 0.376) 3.021 17.398 ( 5.672 14.431 2.646) 15.730 17.656 ( 3.223 5.584 6.752) 9.336 21.315 ( 0.126 0.399 1.088) 1.166 21.514 ( -0.800 -4.323 0.406) 4.415 27.861 ( 0.560 -5.739 -0.607) 5.798 28.035 ( -1.296 -8.129 -1.845) 8.436 37.464 ( 7.157 4.647 1.745) 8.710 37.614 ( 3.884 1.925 0.157) 4.338 37.930 ( -11.308 13.754 -3.730) 18.192 39.056 ( -7.332 -17.201 -11.151) 21.771 ======================= Grid point 331 (166/318) ======================= q-point: (-0.54 0.30 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.519 ( -8.953 5.614 -9.323) 14.092 2.809 ( 0.734 2.690 -5.245) 5.940 2.954 ( 6.262 0.901 -3.988) 7.479 3.138 ( 2.536 -0.280 -8.524) 8.897 3.950 ( 8.965 5.806 -5.953) 12.228 4.535 ( -10.954 2.078 -8.170) 13.822 4.771 ( 1.535 -12.439 -4.095) 13.186 5.029 ( 9.907 1.761 0.688) 10.086 5.151 ( -8.452 -18.209 -12.491) 23.644 5.703 ( -11.582 1.303 -0.022) 11.655 6.423 ( -10.078 1.573 0.416) 10.208 6.693 ( 2.119 -4.505 8.578) 9.918 7.439 ( 1.849 21.187 4.528) 21.745 7.580 ( -0.528 14.350 0.992) 14.394 7.825 ( -4.688 18.901 -1.525) 19.533 8.492 ( -2.918 -8.162 -8.673) 12.262 9.593 ( 0.733 9.447 -3.993) 10.282 10.406 ( 3.879 -10.314 11.074) 15.622 16.965 ( 2.388 0.986 1.147) 2.826 17.151 ( -0.227 -2.124 -0.122) 2.140 17.518 ( 4.476 16.773 4.681) 17.980 17.749 ( 2.128 7.305 7.967) 11.017 21.324 ( 0.145 -0.117 1.249) 1.263 21.495 ( -1.227 -3.843 -0.270) 4.043 27.862 ( -0.051 -6.438 -0.709) 6.477 27.995 ( -1.493 -8.073 -2.624) 8.619 37.590 ( 5.450 5.708 0.666) 7.920 37.692 ( 3.146 2.949 1.713) 4.640 37.736 ( -6.201 9.664 -3.275) 11.940 38.882 ( -4.268 -18.144 -11.854) 22.089 ======================= Grid point 332 (167/318) ======================= q-point: (-0.46 0.30 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.326 ( -5.310 -0.762 -9.100) 10.564 2.784 ( 0.586 1.386 -5.910) 6.098 2.972 ( -5.351 -4.619 -5.279) 8.823 3.202 ( 11.670 -3.429 -9.957) 15.719 4.099 ( 8.671 5.133 -5.240) 11.358 4.320 ( -0.759 -4.226 -14.425) 15.051 4.666 ( -8.554 -7.891 -5.649) 12.936 4.931 ( -7.422 -5.408 0.117) 9.184 5.199 ( 3.209 -5.937 -1.919) 7.016 5.544 ( -4.908 0.528 -2.131) 5.376 6.231 ( -9.193 8.220 1.544) 12.429 6.749 ( -2.192 -4.315 11.431) 12.413 7.497 ( 2.103 22.109 2.894) 22.397 7.604 ( 2.746 5.751 -0.192) 6.376 7.827 ( 4.584 25.457 -1.946) 25.940 8.442 ( 3.419 -8.276 -8.356) 12.248 9.582 ( -0.074 11.012 -2.702) 11.339 10.528 ( 2.792 -13.061 9.179) 16.206 17.011 ( 1.541 1.801 1.261) 2.685 17.128 ( -2.091 -2.267 -0.159) 3.088 17.604 ( 1.502 17.659 4.636) 18.319 17.834 ( 2.011 5.812 7.972) 10.069 21.338 ( 0.481 -0.757 1.661) 1.888 21.468 ( -1.293 -3.245 -0.686) 3.560 27.852 ( -0.488 -6.743 -0.440) 6.775 27.951 ( -1.389 -7.915 -2.968) 8.567 37.584 ( -4.848 8.404 -0.146) 9.703 37.723 ( 6.902 9.412 -1.603) 11.781 37.784 ( 3.559 -0.473 2.495) 4.372 38.753 ( -1.639 -17.195 -13.607) 21.989 ======================= Grid point 333 (168/318) ======================= q-point: (-0.38 0.30 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.150 ( -10.435 -1.393 -11.426) 15.537 2.673 ( -9.688 -1.438 -5.945) 11.458 2.908 ( 6.892 -3.885 0.224) 7.915 3.347 ( 9.730 -6.375 -14.295) 18.430 4.140 ( 1.974 11.229 -8.921) 14.476 4.366 ( 1.711 -0.826 -3.551) 4.027 4.514 ( -2.730 -11.228 -2.722) 11.871 4.844 ( 0.135 -0.963 6.574) 6.645 5.123 ( -7.796 -3.719 -2.655) 9.036 5.470 ( -0.497 -0.653 -9.418) 9.454 6.160 ( -1.645 8.469 8.927) 12.414 6.766 ( -4.060 -5.516 14.517) 16.052 7.554 ( 2.192 27.475 2.842) 27.709 7.678 ( 7.785 -0.401 -8.117) 11.254 7.927 ( 6.443 28.154 -0.179) 28.882 8.519 ( 9.668 -8.314 -8.345) 15.240 9.555 ( -1.316 11.977 -1.489) 12.140 10.618 ( 1.749 -14.385 6.709) 15.969 17.019 ( -1.677 5.013 -0.657) 5.327 17.083 ( -2.284 -5.329 0.932) 5.872 17.624 ( -1.694 16.696 2.896) 17.029 17.910 ( 1.211 2.193 6.537) 7.001 21.363 ( 0.937 -1.620 2.224) 2.907 21.441 ( -1.122 -2.641 -0.659) 2.944 27.841 ( -0.577 -6.546 0.115) 6.572 27.910 ( -1.178 -7.618 -2.740) 8.181 37.508 ( -4.038 7.390 1.895) 8.632 37.842 ( 3.776 2.265 -1.421) 4.627 37.880 ( 8.113 7.556 2.915) 11.464 38.659 ( 1.353 -13.512 -16.810) 21.610 ======================= Grid point 334 (169/318) ======================= q-point: (-0.31 0.30 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.825 ( -14.043 6.573 -6.030) 16.637 2.498 ( -7.535 6.811 -0.688) 10.180 3.166 ( 16.604 -4.842 6.930) 18.632 3.359 ( 1.715 -6.842 -17.824) 19.169 4.069 ( -3.246 17.727 -9.596) 20.417 4.225 ( -16.182 -1.984 -4.001) 16.787 4.380 ( -8.731 1.872 0.697) 8.957 4.995 ( -0.463 1.911 5.960) 6.276 5.152 ( 18.202 -3.495 9.162) 20.675 5.437 ( 6.394 -4.193 -13.052) 15.127 6.228 ( 0.893 1.988 12.173) 12.367 6.766 ( -5.801 -8.002 15.938) 18.754 7.615 ( 2.943 29.544 2.382) 29.786 7.790 ( 11.005 5.725 -14.789) 19.303 8.058 ( 6.703 21.324 3.207) 22.581 8.671 ( 12.011 -7.270 -10.110) 17.301 9.532 ( -0.224 12.575 0.806) 12.602 10.664 ( -0.355 -14.280 3.541) 14.717 16.944 ( -4.642 3.323 -1.621) 5.935 17.063 ( -1.048 -3.388 1.180) 3.738 17.579 ( -3.982 13.760 0.179) 14.326 17.940 ( -1.549 -2.286 3.457) 4.425 21.394 ( 0.783 -2.363 1.468) 2.890 21.422 ( -0.701 -2.514 0.916) 2.766 27.828 ( -0.955 -5.710 -0.294) 5.797 27.883 ( -0.375 -7.320 -0.936) 7.389 37.442 ( -4.964 4.778 2.712) 7.404 37.864 ( -1.313 -1.952 1.004) 2.558 38.093 ( 12.692 12.343 2.387) 17.864 38.620 ( 7.004 -4.575 -20.293) 21.950 ======================= Grid point 335 (170/318) ======================= q-point: (-0.23 0.30 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.713 ( 0.362 18.999 14.123) 23.676 2.366 ( -7.431 15.068 4.430) 17.375 3.202 ( -6.402 -8.649 -15.590) 18.943 3.536 ( 14.782 3.032 5.408) 16.029 3.788 ( -20.724 10.045 -12.282) 26.101 3.915 ( -10.612 4.564 0.037) 11.552 4.249 ( -3.665 18.235 -1.718) 18.679 5.139 ( 9.863 4.785 2.452) 11.233 5.363 ( 2.215 3.550 10.632) 11.425 5.702 ( 21.786 -14.372 -5.781) 26.732 6.318 ( 0.811 -1.649 12.996) 13.126 6.755 ( -4.643 -9.777 16.835) 20.014 7.696 ( 4.134 28.749 2.366) 29.141 7.864 ( 4.627 18.424 -13.122) 23.088 8.216 ( 9.752 5.421 -0.586) 11.173 8.838 ( 12.556 -4.064 -10.133) 16.638 9.588 ( 5.274 11.897 4.684) 13.831 10.632 ( -4.585 -12.298 -0.054) 13.125 16.853 ( -3.880 2.258 -1.062) 4.613 17.055 ( -0.253 -1.248 0.879) 1.547 17.482 ( -5.601 9.460 -2.962) 11.385 17.886 ( -5.311 -6.868 -0.660) 8.707 21.393 ( -0.397 -1.377 -1.063) 1.784 21.435 ( -0.328 -4.333 3.909) 5.845 27.806 ( -0.759 -4.687 -0.989) 4.850 27.884 ( 0.103 -6.824 1.388) 6.964 37.345 ( -6.733 1.740 0.905) 7.013 37.796 ( -6.223 -6.101 -0.125) 8.716 38.366 ( 13.556 14.283 5.477) 20.439 38.707 ( 16.233 9.494 -20.696) 27.964 ======================= Grid point 336 (171/318) ======================= q-point: (-0.15 0.30 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.899 ( 2.118 17.135 23.066) 28.812 2.332 ( 0.434 24.878 12.498) 27.845 2.954 ( -10.974 -2.385 -11.166) 15.837 3.309 ( -16.580 9.454 -12.096) 22.596 3.583 ( -10.902 10.084 -3.653) 15.293 3.969 ( 9.876 5.087 11.095) 15.701 4.223 ( 2.626 23.683 -5.076) 24.363 5.188 ( -1.895 3.032 -10.185) 10.794 5.595 ( 10.292 3.790 16.821) 20.081 5.955 ( 9.558 -11.530 -3.580) 15.398 6.391 ( -1.538 -0.677 11.259) 11.384 6.858 ( 4.609 -8.591 19.363) 21.679 7.770 ( -1.162 36.121 1.812) 36.185 7.820 ( 1.087 10.903 -5.176) 12.118 8.414 ( 14.413 -1.046 -8.632) 16.833 9.003 ( 10.350 -1.440 -8.621) 13.547 9.806 ( 13.466 6.991 10.226) 18.297 10.482 ( -10.583 -7.321 -3.175) 13.254 16.801 ( -1.337 2.697 0.143) 3.013 17.068 ( 1.156 0.035 0.499) 1.260 17.342 ( -6.359 4.535 -5.842) 9.754 17.740 ( -8.343 -10.522 -4.695) 14.225 21.378 ( -0.607 -1.171 -0.838) 1.562 21.437 ( -1.851 -4.814 3.526) 6.248 27.798 ( 0.565 -3.818 -0.544) 3.898 27.895 ( -0.220 -6.217 2.407) 6.670 37.211 ( -6.877 0.120 -1.981) 7.158 37.651 ( -8.261 -7.832 -1.585) 11.493 38.620 ( 9.699 15.860 5.567) 19.407 38.990 ( 25.252 18.443 -15.360) 34.839 ======================= Grid point 337 (172/318) ======================= q-point: (-0.08 0.30 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.966 ( -6.017 12.612 17.637) 22.502 2.389 ( -8.232 24.100 7.304) 26.493 2.816 ( 2.394 2.996 2.658) 4.666 3.063 ( -2.910 7.767 -6.481) 10.526 3.421 ( -2.394 15.414 0.787) 15.619 4.099 ( 1.008 19.415 -3.207) 19.704 4.324 ( 7.281 13.687 5.773) 16.543 5.003 ( -9.166 1.125 -16.081) 18.544 5.724 ( -3.663 -0.417 6.587) 7.548 6.149 ( 9.508 -6.003 4.222) 12.011 6.433 ( 0.153 5.114 14.041) 14.944 7.068 ( 3.658 -3.806 17.975) 18.734 7.680 ( -4.242 31.836 -0.935) 32.131 7.895 ( 4.657 9.522 3.392) 11.129 8.640 ( 15.978 -0.068 -11.207) 19.516 9.096 ( 5.098 0.979 -8.772) 10.192 10.066 ( -5.774 -2.213 5.570) 8.323 10.309 ( 5.631 -1.844 2.811) 6.558 16.801 ( 0.570 3.305 1.337) 3.611 17.092 ( 0.439 0.358 -0.627) 0.845 17.198 ( -3.545 0.059 -7.286) 8.103 17.543 ( -8.254 -12.051 -7.483) 16.412 21.355 ( -1.785 -1.471 0.170) 2.319 21.417 ( -1.616 -3.368 2.178) 4.324 27.823 ( 2.230 -3.515 0.211) 4.168 27.901 ( -0.822 -5.538 2.513) 6.136 37.094 ( -3.584 0.165 -2.871) 4.595 37.491 ( -7.303 -7.858 -2.287) 10.968 38.791 ( 5.529 20.351 4.479) 21.559 39.400 ( 25.457 14.714 -10.904) 31.360 ======================= Grid point 338 (173/318) ======================= q-point: ( 0.00 0.40 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 522 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.231 ( -0.337 12.474 10.029) 16.009 2.520 ( -3.333 4.437 0.320) 5.559 2.844 ( -2.236 3.872 1.357) 4.673 3.106 ( -1.740 -1.060 2.299) 3.072 3.906 ( 10.526 10.856 -3.526) 15.527 4.194 ( -5.282 -1.831 -9.061) 10.647 4.706 ( 3.026 10.712 2.518) 11.413 4.810 ( -5.900 6.467 -5.222) 10.194 5.736 ( -1.075 5.271 4.900) 7.277 6.073 ( -0.026 -9.616 6.257) 11.472 6.754 ( -2.486 11.380 16.277) 20.016 7.118 ( -1.877 -5.420 14.986) 16.046 8.077 ( 2.673 12.058 2.017) 12.515 8.181 ( 5.590 6.688 4.117) 9.640 8.946 ( 11.652 8.465 -8.011) 16.481 9.171 ( 4.355 1.361 -5.802) 7.381 9.891 ( -13.714 8.636 1.057) 16.242 10.313 ( 1.422 -12.364 4.283) 13.162 16.854 ( -3.850 2.111 -0.920) 4.486 16.999 ( -5.156 -2.293 -3.191) 6.483 17.169 ( 3.229 -2.344 -6.760) 7.850 17.196 ( 1.150 -4.897 -6.305) 8.065 21.318 ( -1.056 0.664 0.687) 1.424 21.373 ( 0.291 -1.921 0.377) 1.979 27.809 ( 0.928 -2.276 1.252) 2.758 27.822 ( 0.821 -2.902 1.745) 3.484 37.072 ( 0.125 1.530 -1.336) 2.035 37.227 ( -3.055 -6.341 -2.201) 7.374 39.299 ( 2.315 19.234 2.536) 19.538 39.762 ( 8.473 -3.257 -5.203) 10.463 ======================= Grid point 339 (174/318) ======================= q-point: ( 0.08 0.40 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 522 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.327 ( 5.006 13.527 7.884) 16.438 2.532 ( 2.830 7.160 5.142) 9.258 2.872 ( 3.398 -1.057 3.394) 4.918 3.155 ( 6.284 -4.105 2.534) 7.922 3.942 ( -4.533 -0.286 -16.271) 16.894 4.024 ( -2.071 -1.069 -12.229) 12.449 4.750 ( 1.265 13.244 4.717) 14.116 4.811 ( 3.207 8.704 9.040) 12.952 5.767 ( 1.503 6.157 4.907) 8.016 6.111 ( 0.406 -8.022 5.950) 9.996 6.660 ( -16.331 11.519 14.245) 24.542 7.069 ( -11.220 -7.252 11.286) 17.489 8.133 ( 1.724 15.545 1.300) 15.695 8.335 ( 5.584 4.833 4.650) 8.727 9.057 ( 5.142 7.540 -10.859) 14.185 9.205 ( 2.697 1.994 -5.670) 6.588 9.660 ( -10.568 15.207 5.311) 19.265 10.289 ( -6.107 -16.188 1.429) 17.361 16.792 ( -1.213 -1.675 -0.344) 2.097 16.906 ( -2.360 -5.373 -2.843) 6.521 17.203 ( 4.487 -0.841 -5.940) 7.492 17.236 ( 5.416 -0.089 -5.941) 8.040 21.310 ( -0.291 1.373 0.667) 1.554 21.386 ( 0.811 -2.423 0.461) 2.597 27.811 ( -0.696 -1.564 1.051) 2.009 27.863 ( 1.835 -3.910 1.468) 4.562 37.094 ( 2.443 1.045 -1.188) 2.911 37.208 ( 2.554 -5.131 -1.776) 6.000 39.279 ( -5.855 19.687 1.653) 20.606 39.785 ( -2.523 -6.155 -5.370) 8.549 ======================= Grid point 340 (175/318) ======================= q-point: ( 0.15 0.40 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 522 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.489 ( 7.074 11.782 6.740) 15.306 2.658 ( 6.194 5.237 4.757) 9.404 3.014 ( 8.582 1.014 7.381) 11.365 3.372 ( 14.645 -7.282 3.004) 16.630 3.729 ( -4.461 1.455 -15.877) 16.556 3.878 ( -5.951 -3.340 -13.104) 14.774 4.770 ( -2.908 11.728 4.874) 13.030 5.002 ( 9.756 3.554 8.475) 13.403 5.842 ( 2.407 6.481 5.136) 8.613 6.149 ( -0.837 -2.283 4.818) 5.397 6.379 ( -19.404 8.373 11.658) 24.136 6.864 ( -16.353 -11.244 8.164) 21.459 8.139 ( -1.771 16.650 -0.021) 16.744 8.379 ( -3.190 6.336 1.474) 7.246 8.990 ( -4.858 8.164 -13.541) 16.541 9.138 ( -5.645 0.347 -5.279) 7.736 9.662 ( 4.496 13.018 11.017) 17.637 10.124 ( -10.657 -11.399 -1.147) 15.647 16.809 ( 2.012 -3.143 1.392) 3.983 16.886 ( 1.254 -5.598 -0.768) 5.788 17.256 ( 5.121 2.827 -5.229) 7.846 17.319 ( 7.222 -0.176 -5.579) 9.128 21.313 ( 0.194 1.711 0.637) 1.836 21.406 ( 0.923 -3.011 0.627) 3.211 27.802 ( -0.686 -0.824 0.527) 1.195 27.899 ( 1.153 -5.281 1.109) 5.518 37.147 ( 4.457 2.142 -1.279) 5.108 37.290 ( 6.317 -4.694 -0.504) 7.886 39.109 ( -12.606 18.735 -0.125) 22.582 39.620 ( -10.974 -8.152 -6.070) 14.958 ======================= Grid point 341 (176/318) ======================= q-point: ( 0.23 0.40 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 522 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.653 ( 6.871 9.422 4.179) 12.388 2.775 ( 3.751 4.192 2.459) 6.139 3.188 ( 3.051 5.446 3.092) 6.966 3.602 ( -4.491 -1.277 -10.005) 11.041 3.717 ( 17.669 -5.853 1.229) 18.654 3.766 ( 9.421 -2.984 -5.758) 11.437 4.696 ( -6.802 11.542 0.283) 13.400 5.200 ( 6.659 -6.482 2.434) 9.607 5.780 ( -17.152 14.672 5.992) 23.353 6.106 ( 0.538 5.863 3.770) 6.991 6.270 ( -0.759 -6.055 7.614) 9.758 6.587 ( -17.002 -14.612 5.862) 23.172 8.063 ( -6.035 16.419 -1.258) 17.538 8.260 ( -8.735 9.494 -0.931) 12.935 8.755 ( -11.302 6.675 -9.043) 15.939 8.966 ( -9.645 -3.481 -6.780) 12.292 9.848 ( 6.666 6.396 9.518) 13.264 9.937 ( -7.278 -0.599 -0.437) 7.316 16.853 ( 1.650 -2.157 0.773) 2.824 16.937 ( 3.348 -5.372 1.699) 6.554 17.343 ( 7.275 5.582 -3.571) 9.841 17.442 ( 8.768 0.567 -2.531) 9.144 21.322 ( 0.252 1.751 0.635) 1.880 21.424 ( 0.603 -3.514 0.680) 3.630 27.794 ( -0.374 -0.678 0.067) 0.777 27.917 ( 0.207 -6.278 0.360) 6.292 37.248 ( 6.866 3.405 -0.504) 7.681 37.415 ( 6.830 -3.837 0.227) 7.837 38.829 ( -16.303 16.919 -2.158) 23.594 39.335 ( -14.876 -10.145 -7.020) 19.326 ======================= Grid point 342 (177/318) ======================= q-point: ( 0.31 0.40 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 522 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.775 ( 3.196 7.412 1.594) 8.228 2.821 ( 1.790 3.601 -2.047) 4.512 3.199 ( 0.508 5.080 -2.516) 5.691 3.383 ( -9.481 1.351 -9.352) 13.385 4.029 ( 16.061 5.035 -5.614) 17.743 4.111 ( 19.709 -7.929 5.266) 21.888 4.542 ( -6.291 5.231 -4.689) 9.430 5.210 ( -7.460 -17.787 -5.843) 20.154 5.455 ( -15.217 21.423 4.198) 26.611 6.144 ( -5.824 -3.569 -2.485) 7.269 6.296 ( 0.640 -5.655 8.823) 10.499 6.414 ( -2.287 -10.005 8.637) 13.414 7.908 ( -8.932 14.614 -2.226) 17.271 8.072 ( -10.480 9.241 -1.142) 14.019 8.507 ( -10.733 8.072 -4.454) 14.149 8.719 ( -11.082 -5.761 -7.248) 14.441 9.830 ( -2.317 8.442 -1.389) 8.863 10.026 ( 4.487 -0.292 9.944) 10.913 16.884 ( 1.471 -0.325 0.584) 1.615 17.006 ( 2.677 -5.550 1.737) 6.402 17.483 ( 8.841 8.441 -0.220) 12.225 17.608 ( 9.036 2.315 1.405) 9.433 21.329 ( 0.057 1.585 0.603) 1.697 21.434 ( 0.057 -3.787 0.507) 3.821 27.788 ( -0.173 -1.163 -0.404) 1.244 27.911 ( -0.699 -6.687 -0.653) 6.755 37.388 ( 8.015 3.826 0.486) 8.894 37.536 ( 5.924 -2.111 0.462) 6.306 38.503 ( -16.397 14.891 -3.706) 22.458 39.014 ( -14.279 -12.622 -7.847) 20.610 ======================= Grid point 343 (178/318) ======================= q-point: ( 0.38 0.40 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 522 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.758 ( -3.186 4.309 -1.451) 5.552 2.845 ( 0.777 0.997 -4.087) 4.278 3.150 ( -5.199 3.126 -8.696) 10.603 3.211 ( 0.488 6.154 -12.496) 13.938 4.104 ( -1.489 13.995 -10.894) 17.798 4.436 ( 11.377 -5.496 3.478) 13.105 4.584 ( 12.466 -9.221 -1.354) 15.565 4.878 ( -17.866 -16.051 -12.393) 27.026 5.299 ( -6.100 14.398 0.201) 15.638 5.904 ( -13.570 -7.795 -3.042) 15.942 6.432 ( 3.736 -2.395 9.262) 10.270 6.478 ( 2.439 -6.079 7.900) 10.262 7.739 ( -7.039 9.915 -2.082) 12.337 7.879 ( -9.295 5.984 0.632) 11.073 8.316 ( -7.411 12.797 -2.141) 14.943 8.513 ( -6.635 -3.505 -6.022) 9.621 9.809 ( 0.197 11.448 -0.310) 11.454 10.143 ( 2.440 -5.045 8.544) 10.218 16.919 ( 1.782 0.519 1.353) 2.297 17.054 ( 1.632 -5.290 1.224) 5.670 17.653 ( 8.154 10.649 2.971) 13.737 17.777 ( 7.039 4.633 4.234) 9.431 21.331 ( -0.158 1.278 0.524) 1.390 21.432 ( -0.455 -3.775 0.149) 3.805 27.781 ( -0.307 -2.004 -0.882) 2.211 27.885 ( -1.271 -6.627 -1.657) 6.948 37.540 ( 7.688 3.477 0.985) 8.495 37.636 ( 4.627 -0.136 0.261) 4.636 38.199 ( -13.363 13.275 -4.217) 19.302 38.733 ( -10.526 -15.168 -8.290) 20.238 ======================= Grid point 344 (179/318) ======================= q-point: (-0.54 0.40 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 522 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.626 ( -9.445 5.411 -7.651) 13.305 2.805 ( -0.594 -2.494 -5.370) 5.951 3.024 ( -0.229 4.944 -13.842) 14.700 3.141 ( 0.940 0.215 -16.805) 16.833 4.050 ( 3.802 4.756 -8.159) 10.181 4.439 ( -13.909 -11.104 -15.005) 23.279 4.603 ( 2.794 -4.019 0.461) 4.917 4.805 ( 7.636 -12.112 -3.224) 14.677 5.213 ( -2.642 12.495 -0.255) 12.774 5.658 ( -10.797 -5.991 -2.066) 12.520 6.455 ( -4.452 2.166 6.758) 8.378 6.600 ( 2.494 -4.676 9.329) 10.730 7.635 ( -2.723 4.700 -2.145) 5.840 7.780 ( -1.950 3.391 3.154) 5.025 8.222 ( -1.299 15.582 -1.682) 15.727 8.399 ( -2.255 0.021 -5.021) 5.504 9.821 ( 0.759 12.467 0.423) 12.498 10.226 ( 1.650 -8.406 7.541) 11.413 16.963 ( 1.607 0.262 2.259) 2.785 17.081 ( 0.489 -4.567 0.950) 4.690 17.804 ( 5.372 11.553 4.797) 13.614 17.907 ( 3.695 6.462 5.534) 9.275 21.330 ( -0.173 0.864 0.499) 1.013 21.420 ( -0.745 -3.506 -0.216) 3.591 27.766 ( -0.575 -2.811 -1.167) 3.098 27.848 ( -1.368 -6.361 -2.355) 6.920 37.675 ( 5.877 2.894 0.649) 6.583 37.712 ( 3.406 0.820 0.171) 3.508 37.977 ( -7.482 12.601 -3.688) 15.112 38.534 ( -5.527 -16.589 -8.669) 19.516 ======================= Grid point 345 (180/318) ======================= q-point: (-0.46 0.40 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 522 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.374 ( -8.298 5.876 -13.718) 17.075 2.748 ( -4.072 -7.539 -8.780) 12.268 2.913 ( -2.044 1.789 -13.714) 13.980 3.119 ( 8.224 -5.033 -15.166) 17.971 4.139 ( 9.476 -1.079 -7.014) 11.838 4.208 ( 0.572 -5.959 -12.503) 13.862 4.592 ( -4.290 1.462 0.011) 4.532 4.836 ( -0.816 -6.124 -3.252) 6.981 5.181 ( -2.781 4.868 1.500) 5.804 5.489 ( -5.788 -5.751 -3.084) 8.723 6.386 ( -6.663 7.532 7.225) 12.383 6.649 ( -3.501 -5.695 10.876) 12.767 7.629 ( 4.157 4.144 -3.937) 7.068 7.821 ( 3.459 2.889 2.721) 5.265 8.247 ( 4.785 14.498 -1.636) 15.354 8.369 ( 2.082 2.531 -4.728) 5.753 9.834 ( 0.107 13.548 0.814) 13.573 10.298 ( 1.635 -10.552 6.697) 12.604 16.998 ( 0.508 -0.749 2.592) 2.745 17.079 ( -1.220 -3.358 0.501) 3.608 17.897 ( 1.235 11.271 4.848) 12.332 17.977 ( 0.322 6.579 5.633) 8.667 21.332 ( 0.096 0.337 0.665) 0.752 21.404 ( -0.748 -3.025 -0.396) 3.141 27.748 ( -0.557 -3.346 -1.004) 3.538 27.810 ( -1.132 -5.985 -2.584) 6.616 37.708 ( -2.977 4.449 0.579) 5.384 37.781 ( 3.124 -0.028 1.518) 3.473 37.925 ( 5.011 10.722 -3.633) 12.380 38.425 ( -0.177 -15.489 -10.055) 18.467 ======================= Grid point 346 (181/318) ======================= q-point: (-0.38 0.40 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 522 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.178 ( -5.982 4.752 -12.907) 14.998 2.559 ( -4.271 -10.094 -5.805) 12.402 2.906 ( 6.022 4.340 -7.143) 10.302 3.207 ( 9.463 -7.705 -15.608) 19.812 4.238 ( 7.902 -0.240 -6.618) 10.310 4.312 ( 6.077 -6.538 -3.955) 9.762 4.491 ( -2.386 9.843 -1.425) 10.227 4.810 ( 3.208 -4.139 -4.221) 6.726 5.101 ( -6.935 3.104 4.374) 8.767 5.396 ( -2.415 -6.525 -4.006) 8.029 6.312 ( -6.323 7.190 9.136) 13.234 6.618 ( -6.864 -8.470 12.596) 16.659 7.731 ( 9.936 5.658 -7.414) 13.627 7.916 ( 5.562 6.196 0.885) 8.373 8.351 ( 5.598 13.873 -1.100) 15.000 8.425 ( 8.074 0.792 -5.850) 10.002 9.833 ( -0.833 15.225 1.343) 15.307 10.364 ( 1.392 -11.832 5.645) 13.183 17.004 ( -1.843 -2.033 1.920) 3.349 17.046 ( -2.073 -1.632 0.284) 2.654 17.899 ( -3.470 10.434 2.929) 11.379 17.987 ( -2.575 4.221 4.708) 6.828 21.343 ( 0.456 -0.313 1.000) 1.143 21.390 ( -0.565 -2.389 -0.311) 2.474 27.737 ( -0.189 -3.593 -0.391) 3.619 27.777 ( -0.719 -5.386 -2.308) 5.904 37.631 ( -5.466 5.538 1.872) 8.003 37.818 ( -0.994 -2.835 2.944) 4.206 38.072 ( 12.218 9.251 -3.762) 15.780 38.419 ( 7.162 -10.450 -12.511) 17.805 ======================= Grid point 347 (182/318) ======================= q-point: (-0.31 0.40 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 522 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.032 ( -1.881 14.036 -1.790) 14.274 2.580 ( 4.000 -2.599 1.544) 5.014 3.005 ( 5.492 -4.252 -0.924) 7.007 3.267 ( 7.508 -5.998 -11.550) 15.025 4.181 ( -11.563 1.238 -2.427) 11.879 4.294 ( -1.061 2.744 -10.165) 10.583 4.549 ( 5.975 13.422 -5.904) 15.833 5.009 ( 17.836 -7.452 -3.141) 19.584 5.071 ( 4.168 3.544 10.488) 11.829 5.348 ( -1.150 -5.767 -0.552) 5.906 6.268 ( -4.662 2.921 11.155) 12.438 6.556 ( -7.778 -11.383 13.433) 19.249 7.879 ( 10.191 7.499 -9.131) 15.604 8.048 ( 9.436 7.725 -1.683) 12.310 8.407 ( 1.713 13.048 -2.246) 13.350 8.590 ( 12.307 -0.326 -6.177) 13.774 9.829 ( -0.469 16.609 2.595) 16.817 10.410 ( 0.158 -12.211 4.205) 12.916 16.948 ( -4.065 -0.447 0.291) 4.100 17.024 ( -0.958 -2.247 1.206) 2.724 17.808 ( -7.135 8.814 -0.063) 11.341 17.929 ( -6.046 0.504 2.100) 6.420 21.359 ( 0.521 -0.990 1.155) 1.608 21.380 ( -0.447 -1.752 0.076) 1.810 27.734 ( -0.074 -3.396 -0.165) 3.400 27.760 ( 0.109 -4.734 -1.028) 4.845 37.528 ( -6.982 4.552 1.884) 8.545 37.769 ( -5.954 -6.634 2.501) 9.258 38.319 ( 16.114 9.885 -2.290) 19.043 38.555 ( 15.663 -2.884 -13.094) 20.618 ======================= Grid point 348 (183/318) ======================= q-point: (-0.23 0.40 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 522 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.110 ( 4.699 20.425 11.559) 23.935 2.647 ( 2.064 9.343 4.924) 10.761 2.983 ( -4.899 -8.186 -6.747) 11.685 3.433 ( 7.292 -12.487 8.263) 16.654 3.952 ( -6.826 9.968 -6.978) 13.951 4.090 ( -11.074 7.010 -12.201) 17.907 4.616 ( 6.037 18.052 -9.023) 21.065 5.236 ( 5.772 0.899 -1.987) 6.170 5.345 ( 12.828 -6.969 2.882) 14.880 5.464 ( 14.854 -4.400 11.597) 19.352 6.285 ( -0.635 -0.623 12.612) 12.643 6.518 ( -4.129 -12.218 15.475) 20.145 7.975 ( 5.403 9.340 -6.987) 12.855 8.231 ( 10.060 -0.202 -5.345) 11.394 8.400 ( 1.146 20.655 -3.008) 20.905 8.785 ( 12.424 -2.283 -6.362) 14.144 9.863 ( 2.221 15.476 4.542) 16.281 10.411 ( -2.375 -10.983 2.497) 11.511 16.882 ( -2.714 1.875 0.318) 3.314 17.023 ( 0.128 -2.981 1.230) 3.227 17.641 ( -9.570 6.346 -3.560) 12.022 17.786 ( -9.512 -3.291 -1.708) 10.209 21.368 ( -0.068 -0.977 -0.359) 1.043 21.376 ( -0.467 -1.782 1.845) 2.607 27.732 ( 0.155 -2.524 -0.416) 2.563 27.770 ( 0.713 -4.474 0.893) 4.617 37.393 ( -8.174 3.494 0.374) 8.898 37.641 ( -8.491 -8.406 0.926) 11.984 38.624 ( 17.030 11.423 -0.211) 20.507 38.833 ( 21.571 2.393 -11.091) 24.373 ======================= Grid point 349 (184/318) ======================= q-point: (-0.15 0.40 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 522 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.216 ( -2.217 15.336 11.995) 19.595 2.758 ( 1.827 -1.919 3.667) 4.524 2.836 ( -3.776 12.220 3.221) 13.189 3.390 ( -12.853 -3.310 1.388) 13.344 3.811 ( -7.699 12.282 -8.617) 16.863 4.032 ( 11.315 1.628 2.364) 11.673 4.654 ( 4.087 18.811 -10.518) 21.936 5.181 ( -3.118 -5.297 -12.488) 13.918 5.661 ( 6.188 2.300 14.566) 15.992 5.766 ( 14.638 -5.836 4.900) 16.503 6.382 ( 2.744 1.089 12.662) 13.002 6.659 ( 8.455 -10.686 19.643) 23.907 8.007 ( 1.820 8.932 -3.755) 9.858 8.230 ( -4.431 3.209 -2.332) 5.947 8.536 ( 13.763 17.684 -6.616) 23.365 8.964 ( 10.681 -3.259 -6.248) 12.796 9.967 ( 5.160 9.638 6.543) 12.741 10.346 ( -5.676 -7.278 0.819) 9.266 16.861 ( 0.068 3.873 0.813) 3.958 17.047 ( 1.695 -2.912 0.992) 3.512 17.421 ( -10.451 3.334 -6.794) 12.903 17.567 ( -11.339 -6.472 -5.564) 14.192 21.358 ( -0.835 -0.693 -0.001) 1.086 21.375 ( -0.676 -1.824 1.366) 2.377 27.741 ( 0.978 -1.739 0.168) 2.003 27.790 ( 0.565 -4.204 1.766) 4.595 37.241 ( -7.507 3.021 -1.283) 8.193 37.481 ( -8.555 -8.533 -0.382) 12.089 38.927 ( 14.833 14.179 1.231) 20.557 39.196 ( 22.802 3.219 -8.024) 24.385 ======================= Grid point 350 (185/318) ======================= q-point: (-0.08 0.40 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 522 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.212 ( -4.119 12.302 11.410) 17.277 2.631 ( -6.578 -4.574 -4.410) 9.145 2.904 ( -3.327 13.228 7.098) 15.377 3.176 ( -7.780 2.203 0.859) 8.131 3.746 ( 4.926 16.702 -1.614) 17.488 4.227 ( 5.448 -3.538 0.728) 6.537 4.656 ( 2.598 16.273 -6.042) 17.552 5.004 ( -7.174 -1.874 -12.954) 14.926 5.734 ( -1.520 2.455 6.163) 6.806 6.005 ( 4.837 -8.384 6.998) 11.945 6.577 ( 8.211 9.358 16.484) 20.657 6.956 ( 8.259 -7.570 18.318) 21.472 8.023 ( 1.740 8.335 0.467) 8.528 8.145 ( -2.740 7.992 0.469) 8.462 8.753 ( 13.775 12.099 -7.627) 19.857 9.098 ( 7.527 -1.792 -5.966) 9.771 10.066 ( -2.962 2.465 4.952) 6.275 10.252 ( -1.389 -4.017 1.940) 4.672 16.882 ( 0.761 5.017 0.965) 5.165 17.083 ( 0.443 -1.954 0.221) 2.016 17.202 ( -6.343 0.364 -8.355) 10.497 17.328 ( -8.929 -8.787 -8.377) 15.071 21.338 ( -1.380 -0.210 0.523) 1.491 21.371 ( -0.357 -1.686 0.623) 1.833 27.770 ( 1.785 -1.678 0.825) 2.586 27.808 ( 0.136 -3.626 2.016) 4.151 37.119 ( -4.214 2.569 -1.794) 5.252 37.332 ( -6.705 -7.765 -1.465) 10.363 39.170 ( 9.765 17.225 2.284) 19.932 39.543 ( 18.087 0.494 -5.934) 19.042 ======================= Grid point 351 (186/318) ======================= q-point: ( 0.00 -0.50 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 312 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.442 ( 0.935 -8.779 4.054) 9.715 2.442 ( 0.935 8.779 4.054) 9.715 3.009 ( -5.551 -8.529 2.652) 10.517 3.009 ( -5.551 8.529 2.652) 10.517 4.084 ( 1.071 -7.658 -9.938) 12.592 4.084 ( 1.071 7.658 -9.938) 12.592 4.851 ( -0.393 -2.894 0.573) 2.976 4.851 ( -0.393 2.894 0.573) 2.976 5.881 ( -0.050 -9.145 5.847) 10.855 5.881 ( -0.050 9.145 5.847) 10.855 6.966 ( -2.010 -9.618 15.386) 18.255 6.966 ( -2.010 9.618 15.386) 18.255 8.215 ( 5.003 -3.094 2.922) 6.568 8.215 ( 5.003 3.094 2.922) 6.568 9.119 ( 7.280 -6.738 -5.237) 11.217 9.119 ( 7.280 6.738 -5.237) 11.217 10.084 ( -5.963 -10.775 2.369) 12.541 10.084 ( -5.963 10.775 2.369) 12.541 16.920 ( -6.824 -4.516 -3.573) 8.929 16.920 ( -6.824 4.516 -3.573) 8.929 17.151 ( 4.234 -1.274 -5.385) 6.968 17.151 ( 4.234 1.274 -5.385) 6.968 21.339 ( -0.202 -1.422 0.326) 1.473 21.339 ( -0.202 1.422 0.326) 1.473 27.789 ( 0.825 -0.358 1.559) 1.800 27.789 ( 0.825 0.358 1.559) 1.800 37.125 ( -1.407 -3.914 -1.611) 4.460 37.125 ( -1.407 3.914 -1.611) 4.460 39.611 ( 4.634 -11.952 -0.646) 12.835 39.611 ( 4.634 11.952 -0.646) 12.835 ======================= Grid point 353 (187/318) ======================= q-point: ( 0.08 -0.50 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 312 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.526 ( 4.849 -6.528 4.712) 9.398 2.526 ( 4.849 6.528 4.712) 9.398 2.993 ( 2.134 -10.494 5.090) 11.857 2.993 ( 2.134 10.494 5.090) 11.857 3.974 ( -3.560 -2.987 -16.403) 17.049 3.974 ( -3.560 2.987 -16.403) 17.049 4.892 ( 1.473 -1.196 7.247) 7.491 4.892 ( 1.473 1.196 7.247) 7.491 5.928 ( 1.807 -9.557 5.378) 11.114 5.928 ( 1.807 9.557 5.378) 11.114 6.887 ( -14.610 -10.780 12.666) 22.138 6.887 ( -14.610 10.780 12.666) 22.138 8.330 ( 4.126 -5.134 2.706) 7.121 8.330 ( 4.126 5.134 2.706) 7.121 9.185 ( 2.785 -4.195 -6.472) 8.200 9.185 ( 2.785 4.195 -6.472) 8.200 9.975 ( -6.721 -15.961 2.931) 17.564 9.975 ( -6.721 15.961 2.931) 17.564 16.809 ( -2.420 -3.397 -2.577) 4.902 16.809 ( -2.420 3.397 -2.577) 4.902 17.219 ( 5.824 -1.474 -5.289) 8.004 17.219 ( 5.824 1.474 -5.289) 8.004 21.343 ( 0.305 -1.934 0.359) 1.990 21.343 ( 0.305 1.934 0.359) 1.990 27.809 ( 0.415 -1.394 1.331) 1.971 27.809 ( 0.415 1.394 1.331) 1.971 37.129 ( 2.732 -2.802 -1.354) 4.140 37.129 ( 2.732 2.802 -1.354) 4.140 39.601 ( -5.082 -12.763 -1.159) 13.786 39.601 ( -5.082 12.763 -1.159) 13.786 ======================= Grid point 355 (188/318) ======================= q-point: ( 0.15 -0.50 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 312 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.657 ( 5.762 -4.868 4.884) 8.986 2.657 ( 5.762 4.868 4.884) 8.986 3.157 ( 10.912 -11.751 7.513) 17.709 3.157 ( 10.912 11.751 7.513) 17.709 3.797 ( -4.170 -4.372 -15.913) 17.021 3.797 ( -4.170 4.372 -15.913) 17.021 4.960 ( 0.781 -6.811 6.485) 9.437 4.960 ( 0.781 6.811 6.485) 9.437 6.010 ( 3.520 -9.248 4.481) 10.863 6.010 ( 3.520 9.248 4.481) 10.863 6.616 ( -20.648 -13.163 9.911) 26.416 6.616 ( -20.648 13.163 9.911) 26.416 8.366 ( -1.518 -6.528 0.654) 6.734 8.366 ( -1.518 6.528 0.654) 6.734 9.110 ( -6.444 -3.646 -8.658) 11.392 9.110 ( -6.444 3.646 -8.658) 11.392 9.909 ( -2.250 -11.309 4.950) 12.548 9.909 ( -2.250 11.309 4.950) 12.548 16.800 ( 1.778 -2.308 0.114) 2.916 16.800 ( 1.778 2.308 0.114) 2.916 17.303 ( 6.996 -1.715 -5.358) 8.977 17.303 ( 6.996 1.715 -5.358) 8.977 21.353 ( 0.511 -2.324 0.429) 2.418 21.353 ( 0.511 2.324 0.429) 2.418 27.820 ( 0.001 -2.578 0.885) 2.726 27.820 ( 0.001 2.578 0.885) 2.726 37.204 ( 5.844 -3.715 -0.764) 6.967 37.204 ( 5.844 3.715 -0.764) 6.967 39.419 ( -12.879 -12.690 -2.464) 18.248 39.419 ( -12.879 12.690 -2.464) 18.248 ======================= Grid point 357 (189/318) ======================= q-point: ( 0.23 -0.50 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 312 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.784 ( 5.169 -3.366 2.552) 6.675 2.784 ( 5.169 3.366 2.552) 6.675 3.381 ( 3.290 -13.297 3.750) 14.202 3.381 ( 3.290 13.297 3.750) 14.202 3.725 ( 9.662 -3.041 -7.626) 12.679 3.725 ( 9.662 3.041 -7.626) 12.679 4.968 ( -3.225 -14.562 1.018) 14.949 4.968 ( -3.225 14.562 1.018) 14.949 6.075 ( -1.943 -11.866 2.655) 12.314 6.075 ( -1.943 11.866 2.655) 12.314 6.303 ( -14.866 -11.690 8.188) 20.608 6.303 ( -14.866 11.690 8.188) 20.608 8.285 ( -6.939 -5.815 -1.095) 9.119 8.285 ( -6.939 5.815 -1.095) 9.119 8.874 ( -11.999 -5.441 -8.299) 15.572 8.874 ( -11.999 5.441 -8.299) 15.572 9.934 ( 0.752 -1.599 5.332) 5.617 9.934 ( 0.752 1.599 5.332) 5.617 16.853 ( 2.903 -2.371 1.541) 4.052 16.853 ( 2.903 2.371 1.541) 4.052 17.426 ( 9.211 -2.563 -3.324) 10.122 17.426 ( 9.211 2.563 -3.324) 10.122 21.364 ( 0.353 -2.576 0.465) 2.641 21.364 ( 0.353 2.576 0.465) 2.641 27.820 ( -0.350 -3.263 0.262) 3.292 27.820 ( -0.350 3.263 0.262) 3.292 37.327 ( 7.425 -4.534 -0.053) 8.700 37.327 ( 7.425 4.534 -0.053) 8.700 39.117 ( -16.924 -12.425 -4.047) 21.382 39.117 ( -16.924 12.425 -4.047) 21.382 ======================= Grid point 359 (190/318) ======================= q-point: ( 0.31 -0.50 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 312 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.858 ( 1.905 -0.689 -1.393) 2.458 2.858 ( 1.905 0.689 -1.393) 2.458 3.320 ( -4.451 -6.534 -4.753) 9.224 3.320 ( -4.451 6.534 -4.753) 9.224 4.040 ( 20.272 -1.915 1.815) 20.443 4.040 ( 20.272 1.915 1.815) 20.443 4.822 ( -10.966 -19.662 -7.024) 23.584 4.822 ( -10.966 19.662 -7.024) 23.584 5.877 ( -14.556 -20.012 1.447) 24.788 5.877 ( -14.556 20.012 1.447) 24.789 6.291 ( 3.067 -3.540 7.712) 9.022 6.291 ( 3.067 3.540 7.712) 9.022 8.103 ( -11.230 -5.030 -2.360) 12.529 8.103 ( -11.230 5.030 -2.360) 12.529 8.625 ( -9.542 -4.460 -5.311) 11.796 8.625 ( -9.542 4.460 -5.311) 11.796 9.979 ( 0.688 -5.211 4.703) 7.053 9.979 ( 0.688 5.211 4.703) 7.053 16.912 ( 2.362 -3.330 1.572) 4.375 16.912 ( 2.362 3.330 1.572) 4.375 17.602 ( 10.367 -3.233 0.272) 10.863 17.602 ( 10.367 3.233 0.272) 10.863 21.370 ( 0.001 -2.669 0.384) 2.696 21.370 ( 0.001 2.669 0.384) 2.696 27.810 ( -0.686 -3.282 -0.510) 3.391 27.810 ( -0.686 3.282 -0.510) 3.391 37.469 ( 7.547 -4.173 0.470) 8.637 37.469 ( 7.547 4.173 0.470) 8.637 38.771 ( -16.770 -12.514 -5.315) 21.589 38.771 ( -16.770 12.514 -5.315) 21.589 ======================= Grid point 361 (191/318) ======================= q-point: ( 0.38 -0.50 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 312 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.829 ( -3.118 -2.537 -3.207) 5.142 2.829 ( -3.118 2.537 -3.207) 5.142 3.226 ( -1.007 -3.621 -11.047) 11.669 3.226 ( -1.007 3.621 -11.047) 11.669 4.379 ( 11.750 -8.759 -2.924) 14.944 4.379 ( 11.750 8.759 -2.924) 14.945 4.522 ( -10.847 -12.944 -8.669) 18.983 4.522 ( -10.847 12.944 -8.669) 18.983 5.648 ( -10.536 -17.182 -0.548) 20.163 5.648 ( -10.536 17.182 -0.548) 20.163 6.412 ( 3.942 -0.798 8.938) 9.801 6.412 ( 3.942 0.799 8.938) 9.801 7.877 ( -10.428 -4.506 -2.096) 11.552 7.877 ( -10.428 4.506 -2.096) 11.552 8.469 ( -4.977 -3.312 -2.681) 6.551 8.469 ( -4.977 3.312 -2.681) 6.551 10.015 ( 0.443 -8.514 4.200) 9.504 10.015 ( 0.443 8.514 4.200) 9.504 16.960 ( 1.808 -3.672 1.625) 4.404 16.960 ( 1.808 3.672 1.625) 4.404 17.794 ( 8.766 -3.246 3.307) 9.915 17.794 ( 8.766 3.246 3.307) 9.915 21.369 ( -0.329 -2.593 0.193) 2.620 21.369 ( -0.329 2.593 0.193) 2.620 27.789 ( -0.979 -2.823 -1.289) 3.254 27.789 ( -0.979 2.823 -1.289) 3.254 37.605 ( 6.567 -2.795 0.510) 7.155 37.605 ( 6.567 2.795 0.510) 7.155 38.457 ( -13.079 -13.131 -5.836) 19.430 38.457 ( -13.079 13.131 -5.836) 19.430 ======================= Grid point 363 (192/318) ======================= q-point: (-0.54 -0.50 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 312 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.729 ( -4.853 -4.831 -5.568) 8.826 2.729 ( -4.854 4.831 -5.568) 8.826 3.113 ( -1.775 -3.430 -19.213) 19.598 3.113 ( -1.775 3.430 -19.213) 19.598 4.193 ( -6.386 -10.881 -13.080) 18.173 4.193 ( -6.386 10.881 -13.080) 18.173 4.632 ( 7.063 -5.887 0.613) 9.215 4.632 ( 7.063 5.887 0.613) 9.215 5.473 ( -7.819 -12.256 -1.607) 14.626 5.473 ( -7.819 12.256 -1.607) 14.626 6.515 ( 0.471 -3.829 9.449) 10.206 6.515 ( 0.471 3.829 9.449) 10.206 7.733 ( -3.375 -5.103 -1.086) 6.214 7.733 ( -3.375 5.103 -1.086) 6.214 8.401 ( -1.034 -2.996 -1.673) 3.584 8.401 ( -1.034 2.996 -1.673) 3.584 10.049 ( 0.658 -10.131 3.943) 10.891 10.049 ( 0.658 10.131 3.943) 10.891 16.997 ( 1.010 -3.285 1.862) 3.908 16.997 ( 1.010 3.285 1.862) 3.908 17.949 ( 5.032 -2.671 4.890) 7.508 17.949 ( 5.032 2.671 4.890) 7.508 21.362 ( -0.448 -2.338 0.016) 2.381 21.362 ( -0.448 2.338 0.016) 2.381 27.760 ( -1.066 -2.229 -1.808) 3.062 27.760 ( -1.066 2.229 -1.808) 3.062 37.712 ( 4.634 -0.962 0.264) 4.740 37.712 ( 4.634 0.962 0.264) 4.740 38.234 ( -6.839 -13.838 -5.814) 16.494 38.234 ( -6.839 13.838 -5.814) 16.494 ======================= Grid point 365 (193/318) ======================= q-point: (-0.46 -0.50 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 312 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.547 ( -8.704 -10.776 -13.924) 19.641 2.547 ( -8.704 10.776 -13.924) 19.641 3.005 ( 3.664 -6.043 -16.012) 17.502 3.005 ( 3.664 6.043 -16.012) 17.502 4.128 ( 5.514 -1.508 -8.413) 10.172 4.128 ( 5.514 1.508 -8.413) 10.172 4.693 ( 0.455 -7.337 -1.577) 7.519 4.693 ( 0.455 7.337 -1.577) 7.519 5.336 ( -6.150 -8.993 -0.897) 10.932 5.336 ( -6.150 8.993 -0.897) 10.932 6.527 ( -5.113 -6.640 9.584) 12.731 6.527 ( -5.113 6.640 9.584) 12.731 7.743 ( 4.950 -6.762 -1.807) 8.573 7.743 ( 4.950 6.762 -1.807) 8.573 8.408 ( 2.739 -2.217 -1.552) 3.851 8.408 ( 2.739 2.217 -1.552) 3.851 10.086 ( 0.822 -11.565 3.773) 12.193 10.086 ( 0.822 11.565 3.773) 12.193 17.015 ( -0.396 -2.434 1.810) 3.059 17.015 ( -0.396 2.434 1.810) 3.059 18.030 ( 0.408 -1.925 4.960) 5.336 18.030 ( 0.408 1.925 4.960) 5.336 21.354 ( -0.287 -1.892 0.007) 1.914 21.354 ( -0.287 1.892 0.007) 1.914 27.731 ( -0.808 -1.677 -1.841) 2.618 27.731 ( -0.808 1.677 -1.841) 2.618 37.767 ( 0.444 -1.680 1.119) 2.067 37.767 ( 0.444 1.680 1.119) 2.067 38.150 ( 2.212 -12.396 -6.686) 14.257 38.150 ( 2.212 12.396 -6.686) 14.257 ======================= Grid point 367 (194/318) ======================= q-point: (-0.38 -0.50 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 312 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.337 ( -3.253 -10.744 -10.225) 15.184 2.337 ( -3.253 10.744 -10.225) 15.184 3.043 ( 7.568 -8.473 -11.875) 16.434 3.043 ( 7.568 8.473 -11.875) 16.434 4.237 ( 7.716 -1.376 -4.027) 8.812 4.237 ( 7.716 1.376 -4.027) 8.812 4.678 ( 2.478 -8.470 -5.338) 10.314 4.678 ( 2.478 8.470 -5.338) 10.314 5.235 ( -4.924 -8.844 1.955) 10.309 5.235 ( -4.924 8.844 1.955) 10.309 6.456 ( -8.178 -7.686 10.144) 15.128 6.456 ( -8.178 7.686 10.144) 15.128 7.867 ( 9.616 -7.006 -4.197) 12.616 7.867 ( 9.616 7.006 -4.197) 12.616 8.476 ( 5.425 -0.342 -1.996) 5.791 8.476 ( 5.425 0.342 -1.996) 5.791 10.121 ( 0.539 -13.383 3.658) 13.885 10.121 ( 0.539 13.383 3.658) 13.885 17.003 ( -1.879 -1.697 1.424) 2.905 17.003 ( -1.879 1.697 1.424) 2.905 18.021 ( -4.161 -1.821 3.534) 5.755 18.021 ( -4.161 1.821 3.534) 5.755 21.352 ( 0.001 -1.276 0.194) 1.291 21.352 ( 0.001 1.276 0.194) 1.291 27.711 ( -0.272 -1.099 -1.368) 1.775 27.711 ( -0.272 1.099 -1.368) 1.775 37.737 ( -4.615 -5.086 2.307) 7.245 37.737 ( -4.615 5.086 2.307) 7.245 38.240 ( 11.699 -8.191 -7.694) 16.222 38.240 ( 11.699 8.191 -7.694) 16.222 ======================= Grid point 369 (195/318) ======================= q-point: (-0.31 -0.50 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 312 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.348 ( 6.224 -16.634 1.786) 17.850 2.348 ( 6.224 16.634 1.786) 17.850 3.098 ( 3.818 -9.595 -6.488) 12.196 3.098 ( 3.818 9.595 -6.488) 12.196 4.257 ( -2.960 -4.742 -5.930) 8.149 4.257 ( -2.960 4.742 -5.930) 8.149 4.807 ( 15.168 -11.875 -9.950) 21.682 4.807 ( 15.168 11.875 -9.950) 21.682 5.204 ( -0.454 -8.132 9.481) 12.499 5.204 ( -0.454 8.132 9.481) 12.499 6.366 ( -7.778 -7.298 11.185) 15.456 6.366 ( -7.778 7.298 11.185) 15.456 8.025 ( 10.102 -6.348 -6.383) 13.531 8.025 ( 10.102 6.348 -6.383) 13.531 8.575 ( 6.644 -3.787 -2.876) 8.170 8.575 ( 6.644 3.787 -2.876) 8.170 10.148 ( 0.004 -14.856 3.686) 15.306 10.148 ( 0.004 14.856 3.686) 15.306 16.969 ( -2.258 -2.528 1.104) 3.565 16.969 ( -2.258 2.528 1.104) 3.565 17.919 ( -8.166 -2.533 0.741) 8.582 17.919 ( -8.166 2.533 0.741) 8.582 21.356 ( 0.102 -0.605 0.428) 0.748 21.356 ( 0.102 0.605 0.428) 0.748 27.706 ( 0.308 -0.643 -0.579) 0.918 27.706 ( 0.308 0.643 -0.579) 0.918 37.635 ( -7.450 -6.350 1.890) 9.970 37.635 ( -7.450 6.350 1.890) 9.970 38.474 ( 17.734 -5.775 -6.852) 19.869 38.474 ( 17.734 5.775 -6.852) 19.869 ======================= Grid point 371 (196/318) ======================= q-point: (-0.23 -0.50 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 312 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.494 ( 4.203 -17.680 4.872) 18.814 2.494 ( 4.203 17.680 4.872) 18.814 3.133 ( 1.538 -16.059 5.353) 16.997 3.133 ( 1.538 16.059 5.353) 16.997 4.114 ( -5.606 -4.590 -10.110) 12.438 4.114 ( -5.606 4.590 -10.110) 12.438 4.970 ( 8.493 -17.916 -14.783) 24.732 4.970 ( 8.493 17.916 -14.783) 24.732 5.399 ( 12.160 -4.614 16.198) 20.773 5.399 ( 12.160 4.614 16.198) 20.773 6.331 ( -2.645 -5.903 13.136) 14.642 6.331 ( -2.645 5.903 13.136) 14.642 8.140 ( 5.860 -7.106 -6.636) 11.353 8.140 ( 5.860 7.106 -6.636) 11.353 8.692 ( 8.354 -8.584 -3.950) 12.612 8.692 ( 8.354 8.584 -3.950) 12.612 10.166 ( -0.477 -14.247 3.797) 14.752 10.166 ( -0.477 14.247 3.797) 14.752 16.944 ( -0.858 -4.173 1.080) 4.395 16.944 ( -0.858 4.173 1.080) 4.395 17.731 ( -11.220 -3.076 -2.914) 11.993 17.731 ( -11.220 3.076 -2.914) 11.993 21.359 ( -0.163 -0.090 0.527) 0.559 21.359 ( -0.163 0.090 0.527) 0.559 27.715 ( 0.748 -0.956 0.280) 1.246 27.715 ( 0.748 0.956 0.280) 1.246 37.491 ( -8.682 -6.432 0.646) 10.824 37.491 ( -8.682 6.432 0.646) 10.824 38.798 ( 20.397 -5.668 -4.903) 21.730 38.798 ( 20.397 5.668 -4.903) 21.730 ======================= Grid point 373 (197/318) ======================= q-point: (-0.15 -0.50 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 312 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.510 ( -3.675 -14.414 2.386) 15.065 2.510 ( -3.675 14.414 2.386) 15.065 3.196 ( -2.190 -15.299 9.927) 18.369 3.196 ( -2.190 15.299 9.927) 18.369 4.001 ( 0.502 -5.687 -6.645) 8.761 4.001 ( 0.502 5.687 -6.645) 8.761 4.976 ( 1.847 -14.083 -13.405) 19.531 4.976 ( 1.847 14.083 -13.405) 19.531 5.701 ( 8.634 -2.385 11.457) 14.543 5.701 ( 8.634 2.385 11.457) 14.543 6.469 ( 8.567 -7.706 16.462) 20.094 6.469 ( 8.567 7.706 16.462) 20.094 8.162 ( 0.635 -6.564 -4.057) 7.742 8.162 ( 0.635 6.564 -4.057) 7.742 8.838 ( 10.046 -10.416 -4.862) 15.266 8.838 ( 10.046 10.416 -4.862) 15.266 10.173 ( -1.296 -10.237 3.675) 10.954 10.173 ( -1.296 10.237 3.675) 10.954 16.956 ( 1.455 -5.427 1.081) 5.722 16.956 ( 1.455 5.427 1.081) 5.722 17.480 ( -12.451 -3.023 -6.475) 14.356 17.480 ( -12.451 3.023 -6.475) 14.356 21.355 ( -0.558 -0.401 0.466) 0.830 21.355 ( -0.558 0.401 0.466) 0.830 27.735 ( 1.006 -1.269 1.013) 1.911 27.735 ( 1.006 1.269 1.013) 1.911 37.333 ( -8.066 -6.236 -0.599) 10.212 37.333 ( -8.066 6.236 -0.599) 10.212 39.147 ( 19.090 -7.456 -2.774) 20.681 39.147 ( 19.090 7.456 -2.774) 20.681 ======================= Grid point 375 (198/318) ======================= q-point: (-0.08 -0.50 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 312 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.448 ( -3.595 -11.320 3.172) 12.293 2.448 ( -3.595 11.320 3.172) 12.293 3.129 ( -8.009 -7.221 3.584) 11.364 3.129 ( -8.009 7.221 3.584) 11.364 4.049 ( 5.326 -13.189 -2.399) 14.424 4.049 ( 5.326 13.189 -2.399) 14.424 4.903 ( -1.566 -8.668 -9.219) 12.750 4.903 ( -1.566 8.668 -9.219) 12.750 5.838 ( 1.377 -7.682 7.258) 10.658 5.838 ( 1.377 7.682 7.258) 10.658 6.777 ( 10.565 -10.132 17.481) 22.800 6.777 ( 10.565 10.132 17.481) 22.800 8.152 ( 0.691 -4.444 -0.022) 4.498 8.152 ( 0.691 4.444 -0.022) 4.498 8.993 ( 9.460 -9.340 -5.097) 14.238 8.993 ( 9.460 9.340 -5.097) 14.238 10.153 ( -3.199 -5.558 3.083) 7.116 10.153 ( -3.199 5.558 3.083) 7.116 16.997 ( 1.118 -6.111 0.706) 6.253 16.997 ( 1.118 6.111 0.706) 6.253 17.223 ( -8.799 -2.287 -8.753) 12.620 17.223 ( -8.799 2.287 -8.753) 12.620 21.345 ( -0.615 -0.863 0.366) 1.121 21.345 ( -0.615 0.863 0.366) 1.121 27.762 ( 1.049 -0.982 1.469) 2.055 27.762 ( 1.049 0.982 1.469) 2.055 37.199 ( -5.429 -5.493 -1.389) 7.847 37.199 ( -5.429 5.493 -1.389) 7.847 39.444 ( 13.501 -9.977 -1.205) 16.831 39.444 ( 13.501 9.977 -1.205) 16.831 ======================= Grid point 429 (199/318) ======================= q-point: ( 0.00 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 312 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.217 ( 3.610 0.000 14.380) 14.826 1.271 ( 2.714 0.000 11.503) 11.819 1.834 ( -0.874 0.000 -9.734) 9.773 2.702 ( -2.512 0.000 -2.717) 3.700 3.167 ( 11.140 0.000 33.398) 35.207 3.583 ( 20.931 0.000 18.406) 27.873 4.015 ( 0.270 0.000 -6.042) 6.048 4.359 ( -16.136 0.000 -18.433) 24.498 5.753 ( -5.509 0.000 0.680) 5.550 6.059 ( 0.333 0.000 -0.218) 0.398 6.114 ( 1.345 0.000 1.767) 2.221 6.584 ( -1.826 0.000 6.805) 7.046 7.436 ( -3.768 0.000 12.483) 13.040 8.020 ( 5.129 0.000 13.931) 14.845 8.635 ( 13.669 0.000 -9.694) 16.757 9.038 ( 0.805 0.000 -9.903) 9.936 9.112 ( -26.777 0.000 -10.069) 28.607 11.219 ( 13.161 0.000 -3.232) 13.552 16.778 ( 3.247 0.000 4.091) 5.224 16.974 ( -2.991 0.000 -3.666) 4.732 17.250 ( 2.289 0.000 -1.629) 2.809 17.735 ( -2.499 0.000 -4.859) 5.464 21.406 ( -0.716 0.000 -0.398) 0.819 21.658 ( -6.195 0.000 0.434) 6.210 28.061 ( 2.133 0.000 0.195) 2.141 28.185 ( -2.032 0.000 1.086) 2.304 36.794 ( -0.042 0.000 2.008) 2.009 37.519 ( -0.019 0.000 -2.592) 2.592 37.938 ( -0.523 0.000 3.084) 3.128 39.105 ( 28.958 0.000 -1.676) 29.007 ======================= Grid point 430 (200/318) ======================= q-point: ( 0.08 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 312 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.487 ( 16.391 0.000 8.925) 18.663 1.614 ( 23.544 0.000 8.654) 25.084 1.886 ( 11.981 0.000 -8.103) 14.464 2.638 ( 0.372 0.000 -2.023) 2.057 3.687 ( 24.115 0.000 20.885) 31.902 3.869 ( -20.258 0.000 -15.183) 25.316 4.007 ( 4.699 0.000 -11.623) 12.537 4.103 ( 19.572 0.000 10.756) 22.333 5.765 ( 4.910 0.000 4.818) 6.879 6.012 ( -4.899 0.000 -0.222) 4.904 6.135 ( 0.295 0.000 -0.091) 0.308 6.388 ( -22.909 0.000 7.490) 24.102 7.439 ( -4.174 0.000 12.625) 13.297 7.936 ( -17.877 0.000 4.786) 18.506 8.622 ( -4.809 0.000 -13.963) 14.768 8.973 ( -1.914 0.000 -8.248) 8.467 9.118 ( 21.378 0.000 10.682) 23.898 11.180 ( -10.564 0.000 -12.409) 16.297 16.833 ( -0.995 0.000 0.107) 1.001 16.896 ( -1.921 0.000 -0.033) 1.921 17.268 ( 0.857 0.000 -3.462) 3.567 17.727 ( 3.140 0.000 -1.523) 3.490 21.355 ( -3.747 0.000 1.187) 3.930 21.649 ( 2.201 0.000 4.161) 4.708 28.062 ( -0.910 0.000 -0.877) 1.264 28.220 ( 3.804 0.000 1.705) 4.169 36.822 ( 1.923 0.000 1.659) 2.540 37.499 ( -0.662 0.000 -2.032) 2.137 37.793 ( -12.473 0.000 -0.148) 12.474 39.545 ( 22.464 0.000 -20.809) 30.621 ======================= Grid point 431 (201/318) ======================= q-point: ( 0.15 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 312 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.867 ( 20.160 0.000 1.401) 20.208 2.103 ( 19.409 0.000 13.683) 23.747 2.146 ( 18.369 0.000 -4.430) 18.896 2.722 ( 12.123 0.000 -10.654) 16.139 3.324 ( -24.771 0.000 -17.006) 30.047 4.049 ( 9.955 0.000 -13.505) 16.777 4.270 ( 27.868 0.000 6.844) 28.696 4.537 ( 17.718 0.000 10.250) 20.469 5.863 ( -23.178 0.000 6.466) 24.063 5.905 ( -5.679 0.000 0.435) 5.696 6.005 ( 2.924 0.000 8.604) 9.087 6.125 ( -0.763 0.000 -1.747) 1.907 7.415 ( -6.605 0.000 11.339) 13.122 7.563 ( -20.986 0.000 -2.798) 21.172 8.481 ( -4.907 0.000 -7.667) 9.102 8.877 ( -3.648 0.000 -6.223) 7.213 9.614 ( 20.703 0.000 14.895) 25.504 10.787 ( -19.244 0.000 -15.879) 24.949 16.737 ( -5.345 0.000 -4.004) 6.679 16.913 ( -0.093 0.000 3.779) 3.780 17.244 ( -0.476 0.000 -4.059) 4.087 17.798 ( 3.220 0.000 2.563) 4.115 21.314 ( -1.641 0.000 2.205) 2.749 21.731 ( 2.561 0.000 5.502) 6.069 28.050 ( 0.367 0.000 -0.990) 1.056 28.302 ( 3.601 0.000 0.942) 3.723 36.884 ( 3.737 0.000 1.215) 3.930 37.470 ( -1.427 0.000 -1.347) 1.962 37.562 ( -9.113 0.000 -5.199) 10.492 39.688 ( 9.055 0.000 -25.329) 26.899 ======================= Grid point 432 (202/318) ======================= q-point: ( 0.23 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 312 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.194 ( 13.418 0.000 -10.394) 16.974 2.410 ( 9.292 0.000 -0.629) 9.313 2.454 ( 8.966 0.000 17.069) 19.280 2.893 ( -8.103 0.000 -2.915) 8.611 2.894 ( 13.847 0.000 -19.825) 24.182 4.238 ( 20.740 0.000 -15.936) 26.155 4.793 ( 25.693 0.000 -0.615) 25.701 4.848 ( 10.563 0.000 4.535) 11.495 5.342 ( -29.388 0.000 5.585) 29.914 5.842 ( -1.137 0.000 1.915) 2.227 6.092 ( -1.152 0.000 -2.621) 2.863 6.250 ( 10.319 0.000 6.003) 11.938 7.160 ( -19.215 0.000 -3.889) 19.604 7.311 ( -10.985 0.000 7.699) 13.414 8.323 ( -8.834 0.000 -3.442) 9.481 8.769 ( -4.468 0.000 -4.343) 6.231 9.889 ( -1.913 0.000 -3.568) 4.048 10.497 ( 0.792 0.000 2.142) 2.284 16.619 ( -4.802 0.000 -3.080) 5.705 16.915 ( -1.772 0.000 2.828) 3.337 17.221 ( 0.307 0.000 -1.933) 1.957 17.855 ( 0.069 0.000 5.993) 5.993 21.315 ( 0.034 0.000 2.478) 2.478 21.786 ( -0.331 0.000 4.957) 4.968 28.063 ( 1.677 0.000 -1.130) 2.022 28.352 ( 1.369 0.000 -0.184) 1.381 36.972 ( 5.165 0.000 0.563) 5.196 37.429 ( -2.331 0.000 -0.493) 2.383 37.438 ( -0.092 0.000 -5.865) 5.866 39.631 ( 1.739 0.000 -24.090) 24.153 ======================= Grid point 433 (203/318) ======================= q-point: ( 0.31 0.00 -0.62) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 312 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.118 ( -5.222 0.000 -4.110) 6.646 2.658 ( 15.358 0.000 3.190) 15.686 2.660 ( 3.643 0.000 14.441) 14.893 2.973 ( 9.660 0.000 -23.135) 25.071 2.984 ( 9.210 0.000 3.016) 9.692 4.588 ( 22.853 0.000 -16.369) 28.111 4.885 ( -19.620 0.000 7.395) 20.968 4.984 ( 3.619 0.000 -0.406) 3.642 5.210 ( 20.039 0.000 -6.974) 21.218 5.885 ( 2.992 0.000 3.190) 4.373 6.061 ( -0.157 0.000 -2.494) 2.499 6.293 ( -8.553 0.000 -9.206) 12.566 6.925 ( -3.596 0.000 7.012) 7.880 7.095 ( -15.195 0.000 1.816) 15.304 8.123 ( -11.182 0.000 0.518) 11.194 8.666 ( -4.237 0.000 -2.857) 5.110 9.635 ( -10.585 0.000 -18.781) 21.559 10.737 ( 11.561 0.000 16.592) 20.222 16.532 ( -2.951 0.000 -1.581) 3.348 16.882 ( -3.088 0.000 1.561) 3.460 17.243 ( 2.332 0.000 1.464) 2.753 17.877 ( -2.030 0.000 8.390) 8.632 21.338 ( 0.686 0.000 2.628) 2.716 21.774 ( -3.222 0.000 2.731) 4.224 28.093 ( 2.127 0.000 -1.257) 2.471 28.350 ( -0.877 0.000 -1.432) 1.679 37.078 ( 6.022 0.000 -0.437) 6.038 37.377 ( -3.313 0.000 0.625) 3.371 37.486 ( 7.041 0.000 -1.911) 7.295 39.497 ( -1.061 0.000 -21.821) 21.847 ======================= Grid point 434 (204/318) ======================= q-point: ( 0.38 0.00 -0.62) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 312 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.190 ( 9.836 0.000 14.418) 17.454 2.726 ( -4.765 0.000 6.946) 8.423 2.946 ( 13.351 0.000 2.574) 13.597 3.082 ( 18.321 0.000 -18.145) 25.786 3.129 ( 3.725 0.000 2.916) 4.730 4.478 ( -13.436 0.000 -4.915) 14.307 5.019 ( 2.237 0.000 -2.841) 3.616 5.031 ( 18.219 0.000 -3.649) 18.581 5.450 ( 8.472 0.000 -6.559) 10.714 5.912 ( -3.286 0.000 1.078) 3.458 5.932 ( -16.297 0.000 -17.922) 24.224 6.089 ( 4.416 0.000 0.033) 4.417 6.789 ( -16.144 0.000 -4.147) 16.668 7.011 ( 3.129 0.000 10.667) 11.117 7.941 ( -9.001 0.000 3.371) 9.612 8.586 ( -2.552 0.000 -2.066) 3.283 9.369 ( -6.081 0.000 -17.809) 18.819 11.022 ( 8.782 0.000 14.511) 16.961 16.494 ( -0.526 0.000 -0.161) 0.550 16.825 ( -3.552 0.000 0.406) 3.576 17.320 ( 3.838 0.000 4.214) 5.700 17.891 ( -1.730 0.000 9.183) 9.345 21.369 ( 0.958 0.000 2.915) 3.069 21.710 ( -4.363 0.000 0.269) 4.372 28.123 ( 1.743 0.000 -1.208) 2.121 28.311 ( -1.918 0.000 -2.171) 2.897 37.184 ( 5.951 0.000 -2.216) 6.351 37.317 ( -3.975 0.000 2.428) 4.658 37.643 ( 8.796 0.000 2.697) 9.200 39.344 ( -2.045 0.000 -19.862) 19.967 ======================= Grid point 435 (205/318) ======================= q-point: ( 0.46 0.00 -0.62) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 312 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.554 ( 15.148 0.000 17.385) 23.058 2.617 ( -6.158 0.000 -2.940) 6.823 3.142 ( 0.684 0.000 -0.408) 0.796 3.187 ( 6.090 0.000 7.432) 9.609 3.422 ( 23.825 0.000 -7.470) 24.969 4.248 ( -7.205 0.000 -6.189) 9.498 5.054 ( 3.632 0.000 -4.438) 5.735 5.199 ( -3.774 0.000 -8.411) 9.219 5.380 ( -4.934 0.000 -2.483) 5.523 5.672 ( -2.399 0.000 -12.578) 12.805 5.778 ( -10.164 0.000 -0.523) 10.177 6.188 ( 5.066 0.000 1.608) 5.315 6.496 ( -11.303 0.000 -5.839) 12.722 7.107 ( 0.697 0.000 9.301) 9.328 7.847 ( -3.435 0.000 4.155) 5.391 8.554 ( 0.546 0.000 -2.235) 2.301 9.201 ( -1.646 0.000 -14.649) 14.742 11.229 ( 5.900 0.000 9.502) 11.184 16.505 ( 1.351 0.000 0.428) 1.418 16.765 ( -2.650 0.000 -0.118) 2.652 17.417 ( 3.112 0.000 4.743) 5.673 17.929 ( 0.488 0.000 8.014) 8.029 21.411 ( 1.584 0.000 3.458) 3.803 21.628 ( -3.887 0.000 -1.287) 4.095 28.139 ( 0.681 0.000 -0.948) 1.168 28.263 ( -1.715 0.000 -2.022) 2.652 37.216 ( -2.585 0.000 -1.170) 2.837 37.312 ( 3.404 0.000 1.318) 3.650 37.814 ( 6.529 0.000 4.980) 8.211 39.187 ( -2.887 0.000 -17.992) 18.222 ======================= Grid point 436 (206/318) ======================= q-point: (-0.46 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 312 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.496 ( -6.033 0.000 -1.765) 6.286 2.784 ( -1.179 0.000 4.503) 4.655 3.119 ( -0.832 0.000 3.287) 3.391 3.332 ( 3.082 0.000 5.524) 6.325 3.657 ( 1.184 0.000 -10.455) 10.522 4.249 ( 14.772 0.000 -10.266) 17.989 4.959 ( -6.901 0.000 -1.700) 7.107 5.038 ( -3.164 0.000 -8.562) 9.128 5.311 ( -8.802 0.000 1.018) 8.860 5.524 ( -9.020 0.000 -4.125) 9.918 5.655 ( -0.659 0.000 5.733) 5.771 6.277 ( -0.964 0.000 -0.967) 1.366 6.322 ( -0.436 0.000 0.134) 0.456 7.157 ( -0.443 0.000 8.065) 8.077 7.860 ( 2.176 0.000 3.291) 3.945 8.581 ( 4.132 0.000 -3.226) 5.242 9.130 ( 2.028 0.000 -11.541) 11.718 11.355 ( 3.475 0.000 3.627) 5.023 16.531 ( 0.952 0.000 -0.613) 1.132 16.744 ( 0.649 0.000 0.749) 0.991 17.472 ( 0.066 0.000 2.769) 2.770 18.004 ( 3.198 0.000 5.198) 6.103 21.471 ( 2.396 0.000 3.422) 4.177 21.560 ( -2.140 0.000 -0.947) 2.341 28.134 ( -0.831 0.000 -0.743) 1.115 28.230 ( -0.747 0.000 -0.854) 1.135 37.141 ( -5.007 0.000 1.528) 5.235 37.390 ( 4.513 0.000 -1.513) 4.760 37.926 ( 2.488 0.000 3.481) 4.278 39.023 ( -4.373 0.000 -14.727) 15.363 ======================= Grid point 437 (207/318) ======================= q-point: (-0.38 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 312 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.306 ( -17.281 0.000 5.988) 18.289 2.601 ( -16.317 0.000 -2.232) 16.469 3.097 ( -4.627 0.000 -1.463) 4.853 3.322 ( -5.351 0.000 -2.446) 5.883 3.518 ( -0.909 0.000 -18.854) 18.876 4.339 ( -5.292 0.000 -6.062) 8.046 4.907 ( -3.531 0.000 -4.159) 5.456 5.014 ( -10.557 0.000 0.095) 10.557 5.194 ( 16.446 0.000 12.981) 20.951 5.306 ( -11.972 0.000 -0.926) 12.008 5.780 ( 5.351 0.000 8.753) 10.259 6.155 ( -6.131 0.000 -2.770) 6.728 6.488 ( 11.781 0.000 7.384) 13.904 7.195 ( 0.087 0.000 5.499) 5.500 7.957 ( 6.192 0.000 2.887) 6.833 8.663 ( 7.073 0.000 -4.666) 8.474 9.127 ( 3.811 0.000 -8.284) 9.118 11.395 ( 0.321 0.000 -2.732) 2.751 16.529 ( -0.077 0.000 -1.690) 1.692 16.799 ( 4.106 0.000 1.588) 4.403 17.449 ( -3.085 0.000 -0.324) 3.102 18.097 ( 4.210 0.000 1.441) 4.450 21.479 ( -1.463 0.000 -1.926) 2.419 21.603 ( 4.883 0.000 5.227) 7.153 28.100 ( -2.244 0.000 -0.603) 2.323 28.229 ( 0.471 0.000 1.050) 1.151 37.056 ( -5.450 0.000 2.480) 5.988 37.455 ( 3.780 0.000 -2.648) 4.615 37.926 ( -3.081 0.000 -3.781) 4.877 38.859 ( -6.062 0.000 -6.595) 8.958 ======================= Grid point 438 (208/318) ======================= q-point: (-0.31 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 312 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.972 ( -22.608 0.000 16.318) 27.882 2.218 ( -22.025 0.000 -3.129) 22.246 2.914 ( -11.150 0.000 -7.754) 13.581 3.143 ( -10.458 0.000 -4.895) 11.547 3.411 ( -3.162 0.000 -17.139) 17.428 4.028 ( -23.864 0.000 4.355) 24.258 4.741 ( -20.367 0.000 9.568) 22.502 4.895 ( 2.449 0.000 0.579) 2.517 5.179 ( 2.905 0.000 0.484) 2.945 5.741 ( 28.602 0.000 6.855) 29.412 5.886 ( 1.603 0.000 6.342) 6.541 6.030 ( -5.461 0.000 -2.610) 6.053 6.814 ( 15.520 0.000 11.864) 19.535 7.212 ( -0.251 0.000 -0.635) 0.683 8.121 ( 9.399 0.000 3.116) 9.902 8.780 ( 8.794 0.000 -6.347) 10.845 9.179 ( 5.781 0.000 -1.883) 6.079 11.319 ( -5.265 0.000 -9.516) 10.876 16.524 ( 0.712 0.000 -1.223) 1.415 16.894 ( 4.870 0.000 1.052) 4.982 17.367 ( -4.407 0.000 -2.545) 5.089 18.161 ( 2.717 0.000 -2.441) 3.653 21.440 ( -1.305 0.000 -2.125) 2.494 21.752 ( 7.399 0.000 5.126) 9.001 28.052 ( -2.566 0.000 -0.033) 2.566 28.256 ( 1.096 0.000 2.627) 2.846 36.971 ( -5.309 0.000 2.868) 6.034 37.499 ( 2.855 0.000 -3.243) 4.321 37.746 ( -10.723 0.000 -13.868) 17.530 38.741 ( -6.425 0.000 6.943) 9.460 ======================= Grid point 439 (209/318) ======================= q-point: (-0.23 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 312 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.773 ( -12.071 0.000 29.111) 31.515 1.798 ( -22.206 0.000 3.078) 22.418 2.641 ( -12.389 0.000 -9.173) 15.416 2.919 ( -9.508 0.000 -2.120) 9.741 3.025 ( -31.420 0.000 -2.179) 31.496 3.706 ( -11.547 0.000 -2.419) 11.798 4.394 ( -22.145 0.000 14.240) 26.328 4.950 ( 2.238 0.000 -1.551) 2.723 5.409 ( 17.381 0.000 5.647) 18.275 5.927 ( -1.245 0.000 -0.579) 1.373 5.951 ( 0.093 0.000 3.468) 3.469 6.230 ( 18.641 0.000 1.481) 18.700 7.140 ( 10.687 0.000 12.796) 16.671 7.189 ( 1.776 0.000 -5.538) 5.815 8.314 ( 9.536 0.000 -1.121) 9.601 8.904 ( 8.997 0.000 -8.168) 12.152 9.382 ( 15.547 0.000 11.069) 19.085 11.065 ( -14.745 0.000 -15.457) 21.362 16.546 ( 2.128 0.000 0.169) 2.135 16.980 ( 3.893 0.000 -0.138) 3.895 17.276 ( -3.215 0.000 -2.964) 4.373 18.155 ( -1.078 0.000 -5.657) 5.759 21.408 ( -0.759 0.000 -1.948) 2.091 21.912 ( 6.816 0.000 1.350) 6.948 28.011 ( -1.831 0.000 0.621) 1.934 28.292 ( 0.726 0.000 2.940) 3.028 36.895 ( -4.652 0.000 2.879) 5.470 37.420 ( -13.196 0.000 -11.569) 17.549 37.523 ( 1.978 0.000 -3.444) 3.972 38.697 ( -6.511 0.000 17.030) 18.232 ======================= Grid point 440 (210/318) ======================= q-point: (-0.15 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 312 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.449 ( -20.148 0.000 11.936) 23.418 1.782 ( -13.025 0.000 26.977) 29.957 2.333 ( -15.122 0.000 -8.743) 17.468 2.461 ( -23.340 0.000 14.063) 27.249 2.864 ( 4.124 0.000 5.466) 6.848 3.441 ( -17.217 0.000 -0.038) 17.217 4.159 ( -10.864 0.000 9.917) 14.710 4.911 ( -4.157 0.000 -7.594) 8.657 5.808 ( 17.789 0.000 9.690) 20.257 5.929 ( 3.049 0.000 -0.783) 3.148 6.006 ( 1.995 0.000 4.365) 4.799 6.349 ( -1.587 0.000 -8.796) 8.938 7.331 ( 15.337 0.000 2.171) 15.490 7.344 ( 3.307 0.000 12.362) 12.797 8.434 ( 6.296 0.000 -6.364) 8.952 9.005 ( 7.346 0.000 -9.775) 12.228 9.914 ( 30.239 0.000 15.532) 33.995 10.588 ( -25.216 0.000 -14.552) 29.114 16.604 ( 3.347 0.000 1.909) 3.853 17.030 ( 1.874 0.000 -1.544) 2.428 17.224 ( -0.577 0.000 -2.330) 2.400 18.049 ( -6.059 0.000 -7.320) 9.502 21.391 ( 0.170 0.000 -1.623) 1.631 21.973 ( -0.295 0.000 -4.985) 4.994 27.995 ( -0.361 0.000 1.000) 1.063 28.301 ( -1.528 0.000 1.341) 2.033 36.836 ( -3.498 0.000 2.657) 4.393 37.278 ( 4.343 0.000 4.555) 6.294 37.533 ( 1.222 0.000 -3.346) 3.562 38.688 ( -6.749 0.000 21.436) 22.474 ======================= Grid point 441 (211/318) ======================= q-point: (-0.08 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 312 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.215 ( -12.650 0.000 15.838) 20.269 1.444 ( -26.786 0.000 15.063) 30.731 2.017 ( -11.787 0.000 -9.347) 15.043 2.529 ( 10.930 0.000 19.235) 22.124 3.126 ( 16.336 0.000 14.702) 21.977 3.128 ( -18.302 0.000 14.425) 23.303 4.064 ( -3.741 0.000 0.529) 3.779 4.706 ( -10.858 0.000 -13.620) 17.418 5.922 ( -9.387 0.000 -0.330) 9.393 6.008 ( 4.576 0.000 0.012) 4.576 6.067 ( 2.059 0.000 3.239) 3.837 6.413 ( 13.301 0.000 2.644) 13.561 7.423 ( -2.046 0.000 12.147) 12.318 7.696 ( 18.007 0.000 9.747) 20.476 8.506 ( 6.867 0.000 -7.964) 10.515 9.053 ( 4.219 0.000 -10.499) 11.315 9.810 ( -33.619 0.000 -18.318) 38.285 10.740 ( 32.274 0.000 12.479) 34.603 16.688 ( 3.837 0.000 3.409) 5.132 17.028 ( -0.641 0.000 -2.856) 2.927 17.222 ( 1.424 0.000 -1.663) 2.190 17.870 ( -7.588 0.000 -6.639) 10.083 21.397 ( 1.188 0.000 -1.035) 1.575 21.840 ( -9.182 0.000 -5.566) 10.738 28.013 ( 1.726 0.000 1.065) 2.028 28.249 ( -4.070 0.000 0.224) 4.076 36.800 ( -1.916 0.000 2.340) 3.024 37.530 ( 0.578 0.000 -3.039) 3.094 37.647 ( 25.297 0.000 7.253) 26.317 38.737 ( 1.789 0.000 19.903) 19.984 ======================= Grid point 442 (212/318) ======================= q-point: ( 0.00 0.10 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.400 ( -0.427 12.827 10.318) 16.467 1.692 ( 0.888 34.021 9.121) 35.234 2.266 ( 2.002 34.867 -5.087) 35.293 2.732 ( -1.573 3.283 -2.979) 4.704 3.237 ( 11.619 8.460 30.124) 33.377 3.612 ( 19.403 2.710 14.661) 24.470 4.048 ( -1.813 4.687 -3.474) 6.109 4.340 ( -14.838 -1.543 -18.265) 23.583 5.733 ( -4.832 -1.254 1.556) 5.229 6.203 ( -0.066 13.117 0.984) 13.154 6.346 ( 0.517 20.875 0.742) 20.895 6.581 ( -0.618 0.584 6.397) 6.454 7.433 ( -4.669 -0.198 12.697) 13.530 8.038 ( 6.140 1.860 12.704) 14.232 8.632 ( 12.373 -0.911 -11.779) 17.107 8.843 ( -8.333 -7.507 -9.032) 14.401 9.345 ( -15.825 12.306 -7.635) 21.452 11.133 ( 11.747 -8.279 -1.900) 14.496 16.801 ( 3.134 2.065 3.938) 5.440 16.990 ( -2.192 1.554 -4.140) 4.935 17.206 ( 1.849 -4.239 -1.225) 4.784 17.653 ( -3.019 -7.966 -5.169) 9.965 21.390 ( -1.077 -1.470 -0.269) 1.842 21.611 ( -4.448 -4.207 1.228) 6.244 28.032 ( 2.142 -2.775 0.160) 3.509 28.142 ( -1.605 -4.019 1.306) 4.520 36.868 ( -0.387 6.122 0.215) 6.138 37.521 ( -0.905 -1.431 -2.804) 3.275 38.075 ( -1.303 14.622 3.141) 15.012 39.175 ( 26.153 6.905 -3.266) 27.245 ======================= Grid point 443 (213/318) ======================= q-point: ( 0.08 0.10 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.659 ( 18.519 9.561 9.037) 22.716 1.846 ( 10.458 23.349 6.698) 26.446 2.333 ( 8.422 36.008 -5.152) 37.337 2.696 ( 1.898 6.223 -2.874) 7.113 3.685 ( 15.576 -1.199 9.564) 18.317 3.840 ( -13.643 0.156 -8.784) 16.227 4.095 ( 7.987 2.871 -6.713) 10.821 4.108 ( 16.741 6.368 9.576) 20.310 5.754 ( 4.981 -0.755 4.806) 6.962 6.127 ( -9.709 9.522 1.878) 13.728 6.337 ( -3.691 15.921 1.318) 16.396 6.475 ( -10.986 12.547 3.610) 17.063 7.410 ( -5.737 -2.450 12.859) 14.292 7.972 ( -17.724 3.752 4.499) 18.667 8.552 ( -1.946 -5.213 -14.044) 15.106 8.945 ( 8.695 -0.830 -5.776) 10.471 9.241 ( 7.469 9.072 8.278) 14.374 11.089 ( -10.905 -8.761 -10.673) 17.595 16.869 ( 0.883 3.019 1.689) 3.570 16.908 ( -2.964 1.456 -2.447) 4.110 17.224 ( 0.955 -4.219 -2.873) 5.193 17.639 ( 3.181 -8.500 -1.303) 9.169 21.344 ( -3.206 -1.001 1.310) 3.605 21.617 ( 2.249 -3.087 3.529) 5.200 28.030 ( -1.145 -3.128 -0.870) 3.443 28.183 ( 3.872 -3.571 1.511) 5.480 36.884 ( 1.653 5.380 0.744) 5.677 37.477 ( -2.249 -2.381 -1.582) 3.637 37.964 ( -9.738 16.575 0.516) 19.231 39.543 ( 18.736 0.131 -19.432) 26.994 ======================= Grid point 444 (214/318) ======================= q-point: ( 0.15 0.10 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.038 ( 16.440 13.029 3.700) 21.301 2.152 ( 14.978 6.026 11.769) 19.979 2.498 ( 11.239 29.435 -5.313) 31.953 2.789 ( 12.228 6.797 -10.599) 17.552 3.317 ( -21.147 -1.057 -15.709) 26.364 4.118 ( 9.407 5.361 -14.705) 18.261 4.200 ( 20.829 -3.608 10.429) 23.572 4.594 ( 21.516 4.833 8.373) 23.588 5.818 ( -25.317 0.711 4.928) 25.802 5.943 ( 9.890 -0.336 6.707) 11.954 6.195 ( -7.600 16.941 2.929) 18.797 6.386 ( -1.163 24.867 -1.848) 24.963 7.368 ( -7.224 -4.426 11.581) 14.349 7.596 ( -21.068 3.493 -2.641) 21.518 8.455 ( -3.061 -1.624 -8.897) 9.548 8.912 ( -3.351 2.812 -6.062) 7.476 9.622 ( 18.071 0.953 15.437) 23.786 10.700 ( -19.735 -8.348 -14.263) 25.741 16.783 ( -4.634 4.326 -4.451) 7.746 16.930 ( 0.720 1.759 3.610) 4.080 17.208 ( -0.186 -3.506 -3.623) 5.045 17.720 ( 3.945 -7.574 3.002) 9.053 21.311 ( -1.349 -0.265 2.108) 2.517 21.692 ( 2.493 -3.730 4.557) 6.395 28.013 ( 0.158 -3.511 -1.004) 3.655 28.262 ( 3.439 -3.907 0.610) 5.241 36.938 ( 3.693 4.737 0.999) 6.089 37.427 ( -1.899 -1.336 -1.089) 2.565 37.774 ( -8.835 17.761 -3.612) 20.163 39.643 ( 7.013 -4.106 -23.762) 25.113 ======================= Grid point 445 (215/318) ======================= q-point: ( 0.23 0.10 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.319 ( 11.655 9.712 -4.762) 15.900 2.444 ( 8.356 2.134 9.459) 12.800 2.565 ( -1.662 11.926 -3.904) 12.658 2.979 ( 8.407 8.396 -6.928) 13.754 2.985 ( 2.037 8.045 -10.268) 13.203 4.274 ( 17.981 3.295 -14.794) 23.516 4.613 ( 18.026 -10.382 3.315) 21.065 4.961 ( 12.996 4.679 1.528) 13.897 5.361 ( -22.782 3.067 3.737) 23.289 6.043 ( -1.149 15.084 2.002) 15.259 6.257 ( 8.764 3.087 5.830) 10.970 6.354 ( -1.202 24.981 -2.363) 25.122 7.180 ( -18.789 1.873 -3.182) 19.148 7.277 ( -11.169 -2.792 7.805) 13.909 8.309 ( -8.296 -0.591 -5.041) 9.726 8.807 ( -4.417 3.197 -4.187) 6.874 9.858 ( -4.126 -2.820 -4.141) 6.490 10.414 ( 1.101 -7.665 4.229) 8.823 16.681 ( -3.721 5.756 -3.317) 7.614 16.951 ( -0.560 3.500 2.769) 4.498 17.192 ( 0.538 -2.758 -1.667) 3.268 17.796 ( 1.057 -5.760 6.310) 8.609 21.314 ( 0.087 -0.079 2.320) 2.323 21.743 ( -0.032 -4.084 4.086) 5.777 28.023 ( 1.557 -3.828 -1.078) 4.271 28.307 ( 1.275 -4.374 -0.570) 4.591 37.034 ( 5.594 5.259 1.887) 7.906 37.410 ( 1.208 0.825 -1.092) 1.825 37.611 ( -5.989 14.350 -4.771) 16.265 39.566 ( 0.629 -6.227 -22.958) 23.796 ======================= Grid point 446 (216/318) ======================= q-point: ( 0.31 0.10 -0.62) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.231 ( -6.218 10.579 -6.704) 13.983 2.648 ( 12.036 -0.287 -0.538) 12.051 2.668 ( 4.000 0.721 12.468) 13.114 3.020 ( 5.977 6.307 -4.391) 9.735 3.125 ( 9.303 10.240 -9.778) 16.942 4.581 ( 21.364 -0.876 -14.819) 26.015 4.812 ( -8.152 -4.028 1.645) 9.240 4.933 ( 0.071 -5.507 4.665) 7.218 5.306 ( 12.240 6.826 -7.230) 15.770 6.038 ( -1.821 10.499 -1.253) 10.729 6.313 ( -1.679 21.976 -2.143) 22.144 6.339 ( -3.008 9.867 -4.419) 11.222 6.928 ( -5.514 0.884 6.468) 8.545 7.080 ( -13.748 -1.510 3.044) 14.161 8.101 ( -11.454 -1.386 -1.219) 11.602 8.703 ( -4.396 2.943 -3.311) 6.241 9.586 ( -10.632 -4.267 -17.218) 20.682 10.656 ( 10.952 -7.512 16.556) 21.224 16.613 ( -1.821 7.586 -1.805) 8.008 16.943 ( -1.662 5.947 1.673) 6.398 17.218 ( 2.377 -2.365 1.582) 3.708 17.836 ( -1.164 -3.870 8.550) 9.457 21.336 ( 0.636 -0.200 2.448) 2.537 21.736 ( -2.647 -3.704 2.191) 5.052 28.052 ( 2.065 -3.979 -1.126) 4.622 28.303 ( -0.823 -4.616 -1.746) 5.003 37.155 ( 5.640 6.770 2.208) 9.084 37.459 ( 0.438 5.136 1.974) 5.520 37.505 ( 0.925 5.191 -4.874) 7.180 39.422 ( -1.688 -7.321 -20.962) 22.268 ======================= Grid point 447 (217/318) ======================= q-point: ( 0.38 0.10 -0.62) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.232 ( 6.438 4.115 7.330) 10.588 2.739 ( -2.985 1.026 6.226) 6.981 2.865 ( 12.934 -5.019 -2.646) 14.123 3.111 ( 4.047 0.910 -0.860) 4.236 3.261 ( 12.915 11.609 -6.437) 18.520 4.491 ( -12.859 1.809 -4.956) 13.899 4.920 ( 12.770 -5.718 -5.184) 14.921 5.045 ( 6.977 -3.483 0.316) 7.805 5.476 ( 9.187 2.167 -8.059) 12.411 5.807 ( -16.123 -5.581 -15.022) 22.733 6.197 ( -8.170 20.595 -2.747) 22.326 6.332 ( 4.056 22.923 0.291) 23.281 6.826 ( -12.962 4.174 -1.216) 13.671 6.992 ( 2.701 -1.634 10.723) 11.178 7.901 ( -9.431 -3.293 1.378) 10.084 8.609 ( -3.406 1.277 -3.434) 5.003 9.345 ( -4.964 -1.562 -15.090) 15.962 10.928 ( 8.209 -8.851 14.128) 18.583 16.592 ( 0.223 9.120 -0.514) 9.137 16.912 ( -2.213 8.517 0.648) 8.823 17.295 ( 3.732 -2.317 4.280) 6.133 17.864 ( -1.218 -2.509 9.215) 9.628 21.365 ( 0.852 -0.462 2.704) 2.872 21.680 ( -3.778 -2.869 0.064) 4.744 28.081 ( 1.686 -4.043 -1.037) 4.501 28.264 ( -1.812 -4.625 -2.394) 5.514 37.258 ( 4.816 6.833 -0.113) 8.360 37.385 ( -4.797 6.915 0.651) 8.441 37.634 ( 8.484 -0.849 2.524) 8.892 39.265 ( -2.364 -7.761 -19.074) 20.728 ======================= Grid point 448 (218/318) ======================= q-point: ( 0.46 0.10 -0.62) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.451 ( 6.595 -5.982 6.244) 10.875 2.704 ( 0.525 4.101 3.500) 5.417 3.102 ( 11.903 -5.709 0.064) 13.202 3.128 ( -0.898 -2.581 2.377) 3.622 3.535 ( 17.515 9.512 -2.824) 20.130 4.253 ( -8.610 0.614 -7.297) 11.303 5.049 ( 3.355 -1.493 -1.716) 4.053 5.095 ( -2.649 -8.415 -9.099) 12.674 5.418 ( -7.530 3.039 -4.874) 9.471 5.571 ( 0.324 -8.034 -10.195) 12.984 5.973 ( -13.182 15.535 -2.467) 20.523 6.425 ( 4.725 22.371 0.910) 22.883 6.621 ( -7.755 13.272 -2.224) 15.532 7.093 ( 1.202 -1.290 10.063) 10.217 7.788 ( -3.651 -5.324 1.748) 6.688 8.547 ( -0.525 -1.446 -4.018) 4.303 9.216 ( -0.770 2.188 -11.425) 11.658 11.124 ( 5.391 -10.019 9.359) 14.732 16.608 ( 1.333 9.608 -0.076) 9.700 16.877 ( -1.593 10.712 0.154) 10.831 17.389 ( 2.891 -2.491 4.873) 6.189 17.908 ( 0.633 -1.918 7.969) 8.221 21.402 ( 1.386 -0.866 3.179) 3.575 21.607 ( -3.454 -2.012 -1.275) 4.195 28.099 ( 0.677 -4.035 -0.747) 4.159 28.216 ( -1.676 -4.612 -2.228) 5.389 37.284 ( -3.041 6.564 -1.349) 7.359 37.360 ( 3.069 4.715 1.369) 5.790 37.799 ( 6.398 -1.345 4.801) 8.111 39.109 ( -2.975 -7.686 -17.196) 19.069 ======================= Grid point 449 (219/318) ======================= q-point: (-0.46 0.10 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.445 ( -5.331 -4.941 -1.596) 7.442 2.775 ( -2.043 -1.105 2.701) 3.562 3.100 ( -0.659 -2.121 1.709) 2.803 3.306 ( 5.449 -3.341 2.793) 6.975 3.714 ( -0.438 6.041 -7.391) 9.556 4.196 ( 12.498 -4.528 -10.723) 17.079 4.862 ( -5.878 -8.171 -2.373) 10.342 5.128 ( 0.121 7.153 -5.728) 9.164 5.285 ( -9.771 -2.366 0.136) 10.054 5.452 ( -8.162 -6.503 -4.405) 11.328 5.807 ( -1.865 13.014 5.751) 14.350 6.463 ( -3.530 18.158 -1.165) 18.534 6.546 ( 2.705 21.573 1.345) 21.783 7.162 ( 0.536 0.781 8.741) 8.793 7.782 ( 1.983 -7.372 0.780) 7.674 8.553 ( 3.988 -3.214 -4.515) 6.828 9.167 ( 1.516 4.115 -8.681) 9.726 11.240 ( 2.975 -10.884 3.915) 11.943 16.626 ( 0.500 9.001 -0.794) 9.049 16.869 ( 0.823 11.771 0.466) 11.809 17.440 ( -0.224 -2.793 3.081) 4.165 17.983 ( 3.064 -1.964 5.138) 6.296 21.455 ( 2.081 -1.531 3.094) 4.031 21.546 ( -1.961 -1.381 -0.878) 2.554 28.095 ( -0.717 -3.814 -0.547) 3.919 28.181 ( -0.835 -4.790 -1.067) 4.978 37.213 ( -4.041 6.919 1.264) 8.112 37.433 ( 4.298 4.197 -1.362) 6.159 37.910 ( 2.613 -1.491 3.319) 4.479 38.949 ( -4.251 -7.205 -14.014) 16.321 ======================= Grid point 450 (220/318) ======================= q-point: (-0.38 0.10 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.241 ( -17.987 -6.020 2.846) 19.180 2.602 ( -14.717 0.009 -1.899) 14.839 3.105 ( -0.990 -0.650 0.523) 1.294 3.338 ( 1.442 -0.185 -5.865) 6.043 3.545 ( -7.420 4.845 -14.883) 17.321 4.321 ( -1.368 -1.316 -3.943) 4.376 4.875 ( -10.727 -4.231 -3.854) 12.158 5.054 ( 7.803 1.139 -0.767) 7.923 5.159 ( 2.686 -0.634 11.198) 11.533 5.257 ( -9.678 -3.432 -0.673) 10.290 5.947 ( 7.612 13.898 10.656) 19.095 6.371 ( -4.530 20.905 -1.272) 21.428 6.657 ( 7.106 16.801 4.433) 18.773 7.221 ( 1.434 3.172 5.058) 6.140 7.866 ( 6.500 -8.593 1.509) 10.880 8.634 ( 7.461 -3.453 -5.431) 9.853 9.161 ( 2.546 3.860 -6.145) 7.690 11.276 ( -0.014 -11.302 -1.917) 11.463 16.616 ( -0.510 8.319 -1.460) 8.461 16.911 ( 3.028 10.442 0.597) 10.889 17.415 ( -3.289 -2.969 0.215) 4.436 18.070 ( 3.794 -2.524 1.397) 4.766 21.467 ( -1.171 -1.226 -1.723) 2.418 21.577 ( 3.924 -2.488 4.724) 6.626 28.064 ( -2.133 -3.520 -0.593) 4.158 28.177 ( 0.327 -5.061 0.954) 5.161 37.156 ( -3.280 9.373 2.600) 10.265 37.498 ( 3.924 4.256 -2.704) 6.390 37.918 ( -2.284 -0.708 -3.697) 4.403 38.793 ( -5.742 -6.455 -6.235) 10.654 ======================= Grid point 451 (221/318) ======================= q-point: (-0.31 0.10 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.884 ( -21.218 -5.847 11.921) 25.030 2.284 ( -18.161 5.082 1.252) 18.900 3.039 ( -5.675 8.829 -3.908) 11.200 3.210 ( -11.969 7.955 -7.898) 16.399 3.392 ( 0.393 -1.873 -15.608) 15.725 4.069 ( -22.626 3.954 4.195) 23.348 4.639 ( -15.370 -6.372 6.708) 17.940 4.968 ( -4.588 2.384 1.959) 5.529 5.202 ( 5.130 3.352 -0.059) 6.129 5.648 ( 26.918 -6.837 7.692) 28.818 6.108 ( 3.013 18.635 8.177) 20.572 6.294 ( -2.180 24.336 -1.419) 24.475 6.863 ( 9.705 5.241 9.327) 14.445 7.266 ( 2.397 5.560 -2.132) 6.419 8.041 ( 10.504 -7.245 3.364) 13.196 8.749 ( 8.466 -3.618 -6.379) 11.201 9.203 ( 5.310 3.157 -1.045) 6.265 11.204 ( -5.088 -10.799 -8.081) 14.415 16.601 ( -0.035 7.304 -1.119) 7.389 16.973 ( 3.227 7.362 -0.037) 8.038 17.335 ( -4.397 -2.698 -1.877) 5.489 18.124 ( 2.041 -3.608 -2.492) 4.837 21.432 ( -1.178 -0.795 -2.023) 2.472 21.701 ( 5.825 -4.770 4.890) 8.978 28.017 ( -2.498 -3.369 -0.159) 4.197 28.199 ( 0.781 -5.390 2.580) 6.027 37.129 ( -1.240 14.121 3.539) 14.610 37.538 ( 1.928 3.840 -4.260) 6.051 37.767 ( -7.931 2.612 -13.602) 15.961 38.684 ( -5.864 -5.524 6.968) 10.652 ======================= Grid point 452 (222/318) ======================= q-point: (-0.23 0.10 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.712 ( -8.482 2.034 24.782) 26.272 1.988 ( -15.764 11.522 9.731) 21.816 2.809 ( -13.329 15.068 -9.728) 22.346 2.978 ( -13.101 3.061 -3.797) 13.979 3.143 ( -16.729 11.512 -5.024) 20.920 3.747 ( -12.869 4.780 1.087) 13.771 4.346 ( -19.622 -3.987 13.508) 24.154 4.966 ( 0.933 1.510 -1.650) 2.424 5.418 ( 15.629 1.308 4.808) 16.404 6.029 ( 8.065 1.921 1.013) 8.352 6.174 ( 0.459 19.802 5.626) 20.590 6.345 ( 8.952 18.116 -0.244) 20.209 7.068 ( 6.595 -2.405 7.497) 10.271 7.314 ( 5.473 7.830 -1.998) 9.760 8.258 ( 10.507 -5.036 -0.698) 11.672 8.867 ( 8.265 -3.712 -6.264) 11.015 9.405 ( 15.844 2.673 9.353) 18.592 10.972 ( -13.548 -8.656 -13.517) 21.005 16.608 ( 1.216 5.758 0.033) 5.885 17.022 ( 2.132 3.713 -0.870) 4.369 17.249 ( -3.072 -2.072 -2.493) 4.466 18.104 ( -1.807 -5.023 -5.748) 7.844 21.402 ( -0.707 -0.569 -1.866) 2.076 21.826 ( 4.582 -7.809 2.157) 9.307 27.977 ( -1.815 -3.345 0.438) 3.831 28.228 ( 0.236 -5.897 3.139) 6.685 37.165 ( 3.260 22.699 2.602) 23.079 37.393 ( -12.252 -0.360 -12.586) 17.568 37.626 ( 1.219 9.142 -5.410) 10.693 38.655 ( -5.336 -3.834 17.052) 18.274 ======================= Grid point 453 (223/318) ======================= q-point: (-0.15 0.10 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.696 ( -10.848 20.491 16.044) 28.195 1.918 ( -5.186 12.002 24.258) 27.557 2.449 ( -21.043 11.421 0.725) 23.954 2.605 ( -13.260 11.677 -0.854) 17.689 3.032 ( 1.963 14.931 0.711) 15.076 3.483 ( -17.613 5.431 3.527) 18.766 4.157 ( -8.584 0.592 10.045) 13.226 4.907 ( -4.941 -0.095 -7.987) 9.393 5.776 ( 15.739 0.237 9.211) 18.238 6.083 ( 0.279 6.794 -1.328) 6.928 6.216 ( 2.605 16.861 3.159) 17.351 6.422 ( -0.078 13.621 -5.597) 14.727 7.275 ( 10.158 -1.649 9.718) 14.154 7.446 ( 8.253 6.308 3.897) 11.094 8.396 ( 7.361 -3.605 -6.596) 10.520 8.965 ( 6.091 -3.462 -7.460) 10.235 9.926 ( 30.262 1.210 14.108) 33.411 10.540 ( -23.092 -4.502 -13.548) 27.149 16.648 ( 2.549 4.095 1.647) 5.097 17.041 ( 0.791 0.982 -1.618) 2.051 17.199 ( -0.759 -2.032 -2.343) 3.193 17.986 ( -6.503 -6.234 -7.526) 11.738 21.386 ( 0.100 -0.531 -1.583) 1.673 21.861 ( -1.572 -9.857 -2.129) 10.206 27.960 ( -0.253 -3.287 0.868) 3.409 28.233 ( -1.612 -6.038 2.225) 6.634 37.063 ( -9.274 11.476 -10.055) 17.855 37.368 ( 11.352 13.247 5.615) 18.327 37.651 ( 4.271 13.873 -1.439) 14.587 38.678 ( -4.283 -0.360 21.329) 21.758 ======================= Grid point 454 (224/318) ======================= q-point: (-0.08 0.10 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.545 ( -16.158 17.320 12.571) 26.816 1.738 ( -14.972 30.941 11.311) 36.187 2.308 ( -2.739 24.769 -2.636) 25.059 2.600 ( 9.323 6.575 12.985) 17.285 3.107 ( -5.571 2.580 12.131) 13.596 3.284 ( 1.418 12.130 13.010) 17.844 4.093 ( -3.235 4.130 2.259) 5.712 4.688 ( -11.293 -1.667 -14.263) 18.268 5.879 ( -9.076 -2.002 2.141) 9.537 6.132 ( 6.766 10.249 0.157) 12.282 6.317 ( 2.768 19.277 2.135) 19.592 6.448 ( 7.869 6.700 2.204) 10.568 7.419 ( -1.250 -0.248 12.488) 12.553 7.730 ( 16.498 3.427 8.540) 18.891 8.490 ( 8.544 -1.622 -8.822) 12.388 8.985 ( 0.519 -5.125 -8.904) 10.286 9.873 ( -28.489 5.127 -16.542) 33.340 10.686 ( 30.474 -5.109 11.765) 33.063 16.718 ( 3.333 2.804 3.157) 5.379 17.032 ( -0.386 0.411 -2.744) 2.801 17.189 ( 0.805 -3.087 -1.753) 3.640 17.799 ( -7.917 -7.002 -7.090) 12.726 21.388 ( 0.901 -0.820 -1.058) 1.614 21.748 ( -7.885 -8.046 -2.518) 11.543 27.981 ( 1.953 -3.000 1.001) 3.718 28.193 ( -3.481 -5.073 1.121) 6.254 36.908 ( -3.784 7.390 -2.365) 8.633 37.530 ( 2.887 0.281 -3.358) 4.438 37.889 ( 18.116 22.679 3.310) 29.215 38.791 ( 6.502 6.015 18.041) 20.098 ======================= Grid point 455 (225/318) ======================= q-point: ( 0.00 0.20 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.721 ( -3.079 18.313 7.522) 20.036 2.228 ( -2.523 18.403 6.373) 19.638 2.755 ( 7.916 8.333 0.395) 11.501 2.885 ( -3.119 12.823 -1.509) 13.283 3.565 ( 21.142 17.908 18.907) 33.544 3.704 ( 4.888 12.298 5.411) 14.297 4.223 ( -13.483 9.778 -5.759) 17.623 4.348 ( -2.617 6.179 -8.245) 10.631 5.715 ( -3.686 -0.360 1.613) 4.039 6.469 ( -6.219 2.519 5.904) 8.937 6.528 ( 4.996 9.475 3.824) 11.373 6.975 ( 0.605 34.763 1.752) 34.812 7.434 ( -5.246 0.214 11.695) 12.820 8.093 ( 8.064 3.716 9.717) 13.163 8.585 ( 5.847 -2.267 -14.852) 16.122 8.824 ( -0.517 4.561 -4.871) 6.693 9.555 ( -14.953 9.010 -4.548) 18.040 10.917 ( 8.465 -12.948 0.190) 15.470 16.846 ( 2.363 2.172 3.689) 4.889 17.031 ( -0.036 2.418 -4.774) 5.351 17.097 ( 0.424 -6.229 -0.872) 6.304 17.446 ( -3.784 -12.195 -6.159) 14.177 21.357 ( -1.468 -1.655 0.105) 2.215 21.519 ( -1.597 -4.627 1.590) 5.146 27.962 ( 1.938 -4.020 0.161) 4.465 28.044 ( -0.843 -5.543 1.474) 5.797 36.979 ( 0.230 4.253 -0.716) 4.319 37.441 ( -2.321 -6.065 -2.780) 7.064 38.478 ( -2.092 24.043 3.240) 24.350 39.359 ( 19.002 10.841 -6.018) 22.690 ======================= Grid point 456 (226/318) ======================= q-point: ( 0.08 0.20 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.887 ( 13.804 13.423 8.909) 21.216 2.254 ( 2.194 15.606 4.729) 16.454 2.856 ( 2.939 12.585 -4.386) 13.648 2.933 ( 9.660 14.159 0.554) 17.149 3.687 ( -11.904 1.517 -15.680) 19.745 3.903 ( 2.146 6.033 7.013) 9.497 4.146 ( 18.442 8.000 6.480) 21.121 4.378 ( 7.180 17.279 1.226) 18.751 5.743 ( 4.731 -0.150 3.958) 6.170 6.292 ( -17.259 5.916 5.915) 19.179 6.560 ( -2.301 8.777 2.615) 9.443 6.999 ( 0.539 34.035 1.418) 34.069 7.371 ( -7.861 -0.721 9.891) 12.655 8.093 ( -15.389 8.805 4.122) 18.203 8.484 ( 2.655 -0.681 -15.445) 15.687 8.956 ( 9.069 1.946 -5.355) 10.710 9.419 ( 0.503 8.653 9.408) 12.792 10.860 ( -11.368 -13.670 -7.074) 19.135 16.908 ( 1.842 0.996 3.156) 3.787 16.973 ( -2.267 4.172 -5.204) 7.044 17.115 ( 1.387 -6.130 -1.617) 6.489 17.422 ( 3.530 -12.486 -1.459) 13.057 21.323 ( -2.048 -0.846 1.343) 2.591 21.541 ( 2.093 -4.258 2.120) 5.197 27.951 ( -1.563 -4.391 -0.719) 4.716 28.091 ( 3.699 -5.416 1.082) 6.648 36.990 ( 1.297 4.469 -0.495) 4.680 37.406 ( -0.342 -4.659 -0.529) 4.701 38.391 ( -8.374 24.944 1.585) 26.360 39.566 ( 9.958 2.387 -15.997) 18.994 ======================= Grid point 457 (227/318) ======================= q-point: ( 0.15 0.20 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.231 ( 14.289 8.012 10.614) 19.520 2.364 ( 6.759 12.436 3.169) 14.505 2.962 ( 12.458 10.684 -8.236) 18.362 3.067 ( 3.839 21.998 -4.529) 22.785 3.283 ( -15.300 -0.997 -14.768) 21.288 4.098 ( 11.869 -3.557 6.288) 13.895 4.301 ( 4.432 9.098 -6.295) 11.919 4.738 ( 21.232 10.058 5.086) 24.038 5.870 ( -11.580 1.893 5.207) 12.838 5.958 ( -4.132 4.436 4.944) 7.823 6.517 ( -3.276 11.521 2.977) 12.343 7.001 ( -1.049 33.376 0.315) 33.394 7.274 ( -8.337 -3.216 7.722) 11.810 7.737 ( -20.132 12.469 -2.255) 23.788 8.454 ( -0.084 1.917 -10.752) 10.922 8.963 ( -2.186 2.049 -6.208) 6.893 9.663 ( 12.420 3.453 16.527) 20.960 10.488 ( -20.180 -12.114 -10.424) 25.742 16.876 ( -2.886 3.964 -4.440) 6.615 16.982 ( 2.422 3.346 2.833) 5.009 17.121 ( 0.854 -4.619 -2.604) 5.371 17.525 ( 5.835 -11.195 3.448) 13.087 21.307 ( -0.745 -0.062 1.773) 1.924 21.599 ( 2.208 -5.262 2.617) 6.278 27.926 ( -0.371 -4.747 -0.956) 4.857 28.159 ( 2.894 -6.209 0.041) 6.850 37.031 ( 3.606 3.858 0.044) 5.281 37.417 ( 1.100 -0.323 1.051) 1.556 38.205 ( -11.188 24.437 -1.723) 26.932 39.555 ( 1.207 -4.063 -19.785) 20.234 ======================= Grid point 458 (228/318) ======================= q-point: ( 0.23 0.20 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.490 ( 7.048 5.753 8.580) 12.506 2.517 ( 7.933 6.957 1.236) 10.623 2.846 ( -12.407 14.096 -14.913) 23.980 3.162 ( -0.374 9.357 1.343) 9.460 3.189 ( 15.143 11.622 -11.460) 22.265 4.342 ( 12.194 1.645 -9.592) 15.601 4.416 ( 12.730 -8.564 3.625) 15.765 5.051 ( 7.263 5.571 0.147) 9.155 5.474 ( -17.692 7.657 0.659) 19.290 6.133 ( 6.987 -1.911 2.755) 7.750 6.502 ( 0.109 12.520 4.663) 13.361 6.952 ( -5.236 26.465 0.881) 26.992 7.153 ( -7.661 0.468 3.255) 8.337 7.374 ( -17.087 16.000 -1.264) 23.443 8.331 ( -7.274 3.225 -7.436) 10.891 8.864 ( -4.444 1.880 -5.223) 7.111 9.800 ( -9.916 -2.196 -4.771) 11.221 10.240 ( 3.256 -8.632 9.296) 13.097 16.809 ( -1.540 6.024 -3.472) 7.121 17.047 ( 2.627 5.985 2.855) 7.133 17.127 ( 1.269 -3.256 -1.117) 3.669 17.649 ( 3.845 -8.372 6.689) 11.385 21.313 ( 0.168 0.073 1.882) 1.891 21.640 ( 0.491 -5.854 2.297) 6.307 27.928 ( 1.059 -5.356 -0.982) 5.547 28.191 ( 0.930 -6.962 -1.183) 7.123 37.133 ( 6.701 4.055 2.227) 8.143 37.451 ( 1.850 2.897 1.251) 3.657 37.976 ( -11.137 21.320 -4.046) 24.391 39.412 ( -3.048 -8.497 -19.971) 21.917 ======================= Grid point 459 (229/318) ======================= q-point: ( 0.31 0.20 -0.62) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.493 ( -6.838 14.655 -9.174) 18.593 2.666 ( 6.772 2.326 -4.244) 8.324 2.694 ( 2.094 2.300 7.576) 8.190 3.142 ( -1.420 4.623 -0.749) 4.894 3.364 ( 9.954 13.564 -7.482) 18.414 4.541 ( 16.072 -3.272 -10.349) 19.394 4.694 ( 13.138 -10.031 2.106) 16.664 4.900 ( -16.935 5.459 2.411) 17.955 5.392 ( 5.125 0.665 -8.868) 10.264 6.103 ( -9.593 -1.221 -8.338) 12.769 6.602 ( 6.104 8.630 6.528) 12.424 6.829 ( -8.159 14.397 1.939) 16.661 7.056 ( -5.616 15.751 4.120) 17.222 7.119 ( -8.360 16.985 0.034) 18.931 8.110 ( -12.428 3.166 -3.817) 13.381 8.734 ( -5.895 -0.961 -6.352) 8.719 9.517 ( -9.336 -1.030 -11.149) 14.578 10.482 ( 9.213 -8.972 15.677) 20.277 16.783 ( 0.442 8.070 -1.881) 8.298 17.099 ( 1.553 8.149 0.234) 8.299 17.171 ( 3.038 -0.720 3.496) 4.687 17.743 ( 1.495 -4.864 8.677) 10.059 21.331 ( 0.468 -0.200 1.955) 2.020 21.641 ( -1.452 -5.499 1.080) 5.789 27.949 ( 1.673 -5.977 -0.920) 6.275 28.181 ( -0.839 -7.371 -2.257) 7.754 37.288 ( 6.888 5.530 4.906) 10.104 37.505 ( 3.812 2.676 0.617) 4.698 37.759 ( -9.403 16.679 -4.347) 19.634 39.230 ( -3.901 -11.411 -18.675) 22.230 ======================= Grid point 460 (230/318) ======================= q-point: ( 0.38 0.20 -0.62) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.352 ( -1.583 8.124 -5.733) 10.068 2.753 ( 0.958 -0.058 -0.370) 1.029 2.788 ( 7.458 -2.246 1.003) 7.853 3.104 ( -1.723 -1.707 -2.077) 3.193 3.522 ( 11.155 13.505 -1.976) 17.627 4.569 ( -12.935 6.117 -6.157) 15.577 4.799 ( 12.391 -6.822 -3.854) 14.660 4.920 ( 7.347 -7.538 2.570) 10.836 5.392 ( 0.660 -11.957 -14.297) 18.650 5.778 ( -14.388 2.941 -10.947) 18.317 6.574 ( -14.132 11.461 -4.384) 18.716 6.793 ( 4.456 9.251 9.460) 13.962 7.037 ( 1.020 21.213 4.266) 21.662 7.055 ( -1.764 18.425 3.198) 18.783 7.859 ( -11.725 0.517 -2.119) 11.926 8.583 ( -5.421 -4.705 -7.508) 10.387 9.362 ( -2.054 4.633 -7.624) 9.155 10.714 ( 6.525 -11.798 12.727) 18.540 16.799 ( 1.856 10.081 -0.618) 10.269 17.114 ( 0.511 8.170 -0.588) 8.207 17.268 ( 4.048 3.067 5.791) 7.702 17.812 ( 0.426 -2.062 9.076) 9.317 21.353 ( 0.555 -0.683 2.123) 2.298 21.605 ( -2.479 -4.472 -0.324) 5.123 27.973 ( 1.376 -6.486 -0.748) 6.672 28.140 ( -1.670 -7.475 -2.797) 8.154 37.411 ( 3.371 7.650 3.691) 9.139 37.583 ( -6.907 12.203 -3.539) 14.462 37.618 ( 6.958 -0.126 2.949) 7.558 39.055 ( -3.468 -12.850 -16.960) 21.559 ======================= Grid point 461 (231/318) ======================= q-point: ( 0.46 0.20 -0.62) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.348 ( 1.375 -4.110 -1.856) 4.714 2.745 ( -0.195 0.164 0.426) 0.496 2.976 ( 12.232 -6.432 -0.909) 13.850 3.062 ( -0.960 -4.443 -2.205) 5.052 3.739 ( 11.664 9.692 0.107) 15.166 4.279 ( -12.796 2.034 -10.209) 16.495 4.873 ( -5.851 -11.784 -9.282) 16.101 5.039 ( 8.296 -0.481 2.080) 8.567 5.281 ( -1.030 -14.460 -7.062) 16.125 5.561 ( -5.786 4.228 -7.427) 10.320 6.263 ( -14.978 12.390 -2.076) 19.549 6.911 ( 2.089 14.011 5.081) 15.049 7.030 ( -1.355 26.107 3.022) 26.316 7.131 ( 4.081 15.525 6.535) 17.332 7.680 ( -5.638 -3.985 -3.199) 7.609 8.467 ( -1.866 -6.697 -6.966) 9.842 9.317 ( 0.527 8.411 -5.110) 9.856 10.874 ( 4.065 -14.092 8.662) 17.033 16.833 ( 1.692 11.493 -0.289) 11.620 17.116 ( 0.148 9.001 -0.551) 9.019 17.371 ( 2.755 4.437 5.756) 7.773 17.873 ( 1.049 -0.867 7.702) 7.821 21.379 ( 0.900 -1.353 2.429) 2.922 21.553 ( -2.444 -3.312 -1.171) 4.279 27.988 ( 0.578 -6.774 -0.356) 6.808 28.093 ( -1.615 -7.493 -2.658) 8.113 37.456 ( -3.530 10.083 -2.071) 10.882 37.482 ( 1.807 7.262 1.557) 7.644 37.767 ( 5.970 -1.662 4.367) 7.581 38.899 ( -3.262 -12.980 -15.047) 20.138 ======================= Grid point 462 (232/318) ======================= q-point: (-0.46 0.20 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.313 ( -4.729 -7.976 -2.793) 9.684 2.739 ( -2.432 -2.410 -0.225) 3.431 3.027 ( -0.806 -5.404 -1.513) 5.670 3.183 ( 7.498 -8.910 -2.428) 11.896 3.876 ( -1.265 9.053 -3.718) 9.868 4.104 ( 9.720 -4.327 -10.868) 15.210 4.694 ( -4.575 -7.712 -3.069) 9.477 5.145 ( -3.090 -7.896 4.991) 9.839 5.277 ( 2.527 -1.044 -0.791) 2.846 5.351 ( -11.984 1.277 -10.647) 16.081 6.088 ( -3.081 14.261 6.465) 15.958 6.912 ( -2.897 20.192 3.071) 20.628 7.056 ( 0.816 25.000 3.822) 25.304 7.264 ( 5.784 16.720 5.998) 18.681 7.606 ( 0.384 -9.028 -5.308) 10.479 8.446 ( 3.754 -7.398 -5.957) 10.213 9.304 ( 0.603 9.740 -3.916) 10.515 10.969 ( 2.008 -15.416 4.299) 16.130 16.846 ( -0.139 11.844 -0.773) 11.870 17.118 ( 0.445 8.540 -0.615) 8.574 17.422 ( -0.566 4.943 3.939) 6.345 17.945 ( 2.532 -1.179 4.935) 5.670 21.416 ( 1.391 -2.286 2.269) 3.508 21.508 ( -1.522 -2.416 -0.683) 2.936 27.990 ( -0.383 -6.566 -0.007) 6.577 28.054 ( -1.042 -7.702 -1.653) 7.946 37.390 ( -2.408 10.188 0.670) 10.490 37.544 ( 4.096 6.706 -1.167) 7.944 37.875 ( 3.074 -1.880 2.915) 4.635 38.753 ( -3.871 -12.159 -12.115) 17.595 ======================= Grid point 463 (233/318) ======================= q-point: (-0.38 0.20 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.103 ( -16.456 -6.963 -0.575) 17.878 2.600 ( -10.671 -0.157 -1.569) 10.787 3.053 ( 4.276 -4.098 1.212) 6.045 3.254 ( 6.736 -7.837 -10.227) 14.539 3.735 ( -8.258 12.192 -8.161) 16.836 4.312 ( 5.180 0.867 0.014) 5.252 4.712 ( -0.688 -11.344 0.664) 11.384 5.036 ( 2.126 -4.542 0.381) 5.029 5.086 ( -9.549 -3.457 -4.062) 10.938 5.309 ( -0.436 6.243 5.610) 8.405 6.212 ( 7.706 11.504 12.648) 18.753 6.888 ( -1.092 25.756 2.649) 25.915 7.069 ( -1.905 21.786 3.508) 22.148 7.373 ( 3.888 13.150 -2.812) 13.999 7.672 ( 9.254 -7.017 1.153) 11.671 8.521 ( 7.569 -7.565 -6.182) 12.358 9.294 ( 0.718 9.592 -2.694) 9.989 10.997 ( -0.358 -15.598 -0.296) 15.605 16.820 ( -1.788 11.020 -1.239) 11.233 17.120 ( 0.099 5.916 -0.928) 5.989 17.400 ( -3.138 5.512 1.153) 6.447 18.013 ( 2.375 -2.632 1.299) 3.776 21.433 ( -0.388 -2.148 -1.073) 2.432 21.515 ( 1.858 -3.429 3.337) 5.133 27.968 ( -1.776 -5.958 -0.561) 6.242 28.043 ( 0.202 -7.989 0.771) 8.028 37.375 ( -0.468 11.337 3.085) 11.759 37.614 ( 4.631 7.224 -3.341) 9.208 37.910 ( 0.713 0.313 -3.105) 3.201 38.619 ( -4.644 -10.654 -5.343) 12.792 ======================= Grid point 464 (234/318) ======================= q-point: (-0.31 0.20 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.828 ( -12.615 1.350 13.119) 18.250 2.393 ( -11.434 5.917 2.829) 13.181 3.117 ( 1.397 -0.234 -5.171) 5.362 3.325 ( 4.792 -3.168 -10.753) 12.191 3.501 ( -9.184 17.091 -8.442) 21.159 4.169 ( -18.395 5.512 3.706) 19.557 4.522 ( -15.522 -5.735 6.783) 17.884 4.971 ( 0.477 -0.032 -0.628) 0.789 5.273 ( 9.068 0.293 -6.236) 11.010 5.518 ( 21.033 -4.243 15.459) 26.445 6.422 ( 4.883 9.265 12.398) 16.229 6.905 ( 1.451 32.764 1.329) 32.824 7.046 ( -2.174 13.866 4.843) 14.847 7.405 ( 4.786 6.307 -9.553) 12.407 7.921 ( 13.455 -0.358 5.666) 14.604 8.635 ( 8.510 -7.355 -6.069) 12.781 9.322 ( 4.144 8.832 0.080) 9.756 10.943 ( -4.169 -14.288 -5.123) 15.741 16.775 ( -2.026 9.115 -1.119) 9.404 17.105 ( -1.036 2.346 -1.005) 2.754 17.333 ( -3.639 5.941 -1.516) 7.130 18.033 ( -0.115 -5.097 -2.594) 5.721 21.410 ( -0.804 -1.334 -1.699) 2.305 21.588 ( 2.927 -6.063 4.074) 7.869 27.927 ( -2.149 -5.498 -0.420) 5.918 28.062 ( 0.580 -7.933 2.524) 8.345 37.395 ( -0.949 9.031 4.791) 10.267 37.656 ( 2.533 8.316 -7.692) 11.608 37.880 ( 2.060 9.516 -10.892) 14.610 38.542 ( -3.553 -8.117 6.970) 11.273 ======================= Grid point 465 (235/318) ======================= q-point: (-0.23 0.20 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.877 ( 3.702 13.691 29.045) 32.323 2.224 ( -9.836 12.502 7.984) 17.798 2.995 ( -8.918 -1.537 -10.604) 13.941 3.148 ( -15.202 17.292 -10.940) 25.490 3.379 ( -2.148 10.925 -5.623) 12.474 3.919 ( -10.379 12.212 5.153) 16.834 4.257 ( -15.387 -4.918 12.159) 20.218 5.014 ( 0.901 3.633 -2.008) 4.248 5.460 ( 14.778 2.487 3.212) 15.326 5.949 ( 13.887 -7.420 6.159) 16.906 6.506 ( -1.634 9.371 7.133) 11.890 6.951 ( 2.927 37.611 -0.098) 37.724 7.089 ( 3.440 4.281 7.987) 9.693 7.461 ( 6.866 7.245 -6.590) 11.960 8.171 ( 10.303 -1.764 0.549) 10.467 8.773 ( 9.339 -5.150 -3.583) 11.250 9.499 ( 14.646 6.925 6.217) 17.352 10.767 ( -10.409 -10.860 -9.589) 17.839 16.741 ( -1.022 6.686 -0.191) 6.767 17.077 ( -1.215 0.503 -0.640) 1.463 17.254 ( -3.248 4.234 -3.471) 6.366 17.970 ( -4.022 -8.060 -5.949) 10.795 21.387 ( -0.553 -0.890 -1.601) 1.914 21.652 ( 1.262 -8.775 2.871) 9.319 27.891 ( -1.474 -4.994 0.115) 5.208 28.087 ( 0.040 -7.807 3.272) 8.465 37.331 ( -8.085 -0.525 -1.574) 8.254 37.625 ( 1.438 11.963 -10.528) 16.001 37.935 ( 10.416 23.770 -7.057) 26.894 38.576 ( -0.525 -2.956 16.718) 16.985 ======================= Grid point 466 (236/318) ======================= q-point: (-0.15 0.20 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.116 ( -9.495 15.345 11.908) 21.620 2.188 ( 5.629 19.995 27.047) 34.103 2.718 ( -12.489 10.711 0.150) 16.453 2.816 ( -8.722 11.245 -10.597) 17.743 3.314 ( -3.074 11.099 -4.403) 12.330 3.722 ( -12.704 18.810 6.466) 23.601 4.200 ( -0.421 3.243 10.097) 10.613 4.925 ( -7.188 2.146 -8.475) 11.318 5.823 ( 15.875 4.066 10.832) 19.644 6.058 ( 0.419 -6.267 -3.377) 7.131 6.498 ( -1.538 9.796 4.276) 10.798 6.978 ( 0.117 35.725 -0.846) 35.735 7.269 ( 7.628 1.012 11.353) 13.715 7.592 ( 9.655 9.175 0.507) 13.329 8.316 ( 8.255 -3.549 -5.649) 10.614 8.900 ( 5.886 -2.426 -4.225) 7.641 9.957 ( 27.565 1.808 11.258) 29.830 10.437 ( -18.158 -5.060 -11.616) 22.142 16.741 ( 0.738 4.665 1.432) 4.935 17.058 ( -0.405 0.551 -0.898) 1.129 17.175 ( -2.626 0.281 -4.075) 4.855 17.817 ( -7.790 -10.441 -7.961) 15.267 21.372 ( -0.068 -0.775 -1.407) 1.608 21.653 ( -2.586 -9.875 1.156) 10.273 27.880 ( 0.213 -4.437 0.634) 4.487 28.096 ( -1.228 -7.379 2.953) 8.042 37.137 ( -8.169 0.546 -5.600) 9.919 37.584 ( -0.842 4.429 -6.797) 8.157 38.166 ( 16.559 31.703 -3.931) 35.983 38.716 ( 4.454 5.411 19.208) 20.446 ======================= Grid point 467 (237/318) ======================= q-point: (-0.08 0.20 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.901 ( -18.029 18.322 7.150) 26.681 2.248 ( -4.978 18.639 11.389) 22.403 2.684 ( 0.385 6.115 -5.535) 8.257 2.842 ( 10.228 19.585 11.957) 25.123 3.231 ( -0.782 9.066 6.525) 11.197 3.631 ( -1.831 22.839 7.917) 24.241 4.260 ( 0.795 11.788 5.512) 13.037 4.659 ( -13.450 -0.355 -14.567) 19.830 5.842 ( -9.467 -1.992 1.468) 9.785 6.290 ( 16.745 3.479 4.709) 17.739 6.503 ( -1.462 8.051 4.899) 9.537 6.968 ( -0.468 35.615 0.288) 35.620 7.414 ( 0.052 -0.278 12.294) 12.297 7.831 ( 12.922 6.832 6.553) 16.019 8.449 ( 11.232 -1.918 -9.155) 14.617 8.921 ( -0.840 -0.509 -5.962) 6.042 9.970 ( -21.935 4.143 -12.277) 25.477 10.556 ( 25.643 -7.577 9.260) 28.297 16.783 ( 2.117 3.341 2.981) 4.953 17.046 ( 0.101 0.954 -2.437) 2.619 17.118 ( -1.142 -3.593 -2.959) 4.793 17.610 ( -8.458 -11.529 -8.034) 16.401 21.368 ( 0.227 -1.129 -0.969) 1.505 21.581 ( -5.003 -7.786 0.857) 9.294 27.909 ( 2.352 -4.007 0.866) 4.726 28.075 ( -2.467 -6.448 1.958) 7.176 37.008 ( -2.958 2.805 -2.727) 4.905 37.514 ( -2.729 -2.636 -4.753) 6.082 38.411 ( 8.908 26.573 -0.072) 28.027 38.995 ( 16.354 14.306 9.764) 23.821 ======================= Grid point 468 (238/318) ======================= q-point: ( 0.00 0.30 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.081 ( -3.740 17.305 4.892) 18.368 2.465 ( -2.101 7.226 2.628) 7.971 2.845 ( 5.737 3.552 6.413) 9.309 3.073 ( -2.464 6.562 -0.556) 7.031 3.660 ( 12.704 0.978 -5.818) 14.007 4.058 ( -4.457 6.153 2.108) 7.885 4.419 ( -5.070 17.672 -3.874) 18.789 4.628 ( 1.978 16.178 5.851) 17.317 5.733 ( -2.084 2.532 1.904) 3.792 6.367 ( -0.863 -7.814 4.674) 9.146 6.794 ( -0.970 12.557 8.101) 14.974 7.426 ( -3.852 -1.652 9.146) 10.060 7.672 ( -0.617 32.537 2.896) 32.672 8.183 ( 8.557 5.300 6.782) 12.137 8.601 ( 6.929 4.635 -11.693) 14.360 8.961 ( 1.931 7.889 -3.714) 8.931 9.717 ( -13.295 8.072 -2.020) 15.685 10.644 ( 4.662 -14.324 1.072) 15.102 16.871 ( 0.241 -0.513 2.810) 2.866 16.990 ( -1.285 -3.487 -1.297) 3.936 17.068 ( 2.169 0.586 -5.082) 5.557 17.208 ( -3.287 -10.656 -6.534) 12.925 21.332 ( -1.206 -0.750 0.353) 1.463 21.438 ( -0.138 -3.476 0.924) 3.599 27.885 ( 1.394 -3.571 0.367) 3.851 27.937 ( -0.164 -4.971 1.404) 5.168 37.032 ( 0.992 1.420 -0.331) 1.763 37.307 ( -3.017 -7.000 -2.610) 8.057 38.956 ( -0.918 23.078 3.628) 23.380 39.561 ( 11.454 8.584 -6.299) 15.638 ======================= Grid point 469 (239/318) ======================= q-point: ( 0.08 0.30 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.170 ( 8.598 14.643 6.717) 18.261 2.484 ( 2.672 8.556 2.218) 9.233 3.003 ( 4.659 0.806 5.020) 6.896 3.098 ( 8.277 8.533 -1.402) 11.970 3.644 ( -6.962 -4.599 -17.641) 19.515 3.979 ( -2.915 -1.136 4.562) 5.532 4.474 ( 6.842 21.133 2.777) 22.386 4.724 ( 6.381 16.117 4.184) 17.832 5.763 ( 3.626 2.556 3.062) 5.390 6.331 ( -6.604 -2.593 4.164) 8.227 6.710 ( -11.163 7.747 7.046) 15.306 7.335 ( -10.474 -1.894 7.971) 13.297 7.689 ( 0.433 30.643 0.259) 30.647 8.300 ( -4.270 10.017 5.181) 12.059 8.551 ( 2.328 8.333 -17.707) 19.708 9.020 ( 4.346 4.234 -5.096) 7.924 9.592 ( -1.254 9.444 10.255) 13.998 10.576 ( -10.650 -14.607 -3.601) 18.432 16.898 ( 0.867 -3.149 2.454) 4.085 16.968 ( -0.194 -4.473 -0.794) 4.547 17.080 ( 1.765 2.787 -4.708) 5.749 17.194 ( 4.883 -8.994 -2.452) 10.524 21.315 ( -0.968 -0.013 1.036) 1.418 21.459 ( 1.591 -3.799 0.887) 4.213 27.871 ( -1.629 -3.489 -0.354) 3.867 27.981 ( 2.882 -5.449 0.711) 6.206 37.049 ( 1.196 1.659 -1.005) 2.279 37.300 ( 2.949 -5.728 0.335) 6.451 38.887 ( -8.164 23.940 1.798) 25.358 39.626 ( 1.384 3.028 -11.529) 12.000 ======================= Grid point 470 (240/318) ======================= q-point: ( 0.15 0.30 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.402 ( 9.822 9.358 7.424) 15.465 2.581 ( 5.823 9.248 1.513) 11.032 3.124 ( 7.417 4.199 1.403) 8.638 3.256 ( 4.761 5.824 -5.668) 9.418 3.403 ( -2.808 6.619 -12.835) 14.711 3.990 ( 1.126 -8.069 7.317) 10.950 4.520 ( -1.088 13.185 -4.544) 13.988 4.956 ( 14.400 10.374 1.514) 17.812 5.875 ( 3.321 0.389 4.001) 5.214 6.120 ( -16.324 9.336 2.350) 18.952 6.579 ( -5.555 -2.900 6.714) 9.184 7.150 ( -13.612 -6.002 5.696) 15.930 7.674 ( -1.659 28.298 -1.901) 28.411 8.104 ( -13.501 21.763 -1.476) 25.653 8.527 ( 1.746 5.358 -13.020) 14.187 8.993 ( -2.713 1.125 -6.514) 7.145 9.766 ( 8.091 6.956 16.316) 19.495 10.260 ( -18.008 -10.098 -5.678) 21.412 16.900 ( -0.912 -1.877 -1.622) 2.643 17.000 ( 2.938 -2.841 2.541) 4.812 17.102 ( 3.339 3.559 -2.659) 5.557 17.323 ( 8.360 -7.980 1.891) 11.711 21.311 ( -0.209 0.498 1.239) 1.352 21.498 ( 1.688 -4.741 1.054) 5.142 27.842 ( -0.874 -3.408 -0.762) 3.600 28.029 ( 1.934 -6.642 -0.292) 6.924 37.086 ( 3.936 2.150 -0.505) 4.513 37.389 ( 4.914 -2.881 2.283) 6.137 38.685 ( -13.402 23.060 -0.917) 26.688 39.497 ( -6.155 -1.974 -14.609) 15.975 ======================= Grid point 471 (241/318) ======================= q-point: ( 0.23 0.30 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.594 ( 6.672 5.651 6.495) 10.892 2.669 ( 2.892 7.238 -1.166) 7.882 3.064 ( -7.512 8.258 -6.976) 13.164 3.342 ( -3.181 8.331 -1.143) 8.990 3.428 ( 15.626 12.279 -9.331) 21.955 4.155 ( 11.956 -13.726 6.747) 19.413 4.446 ( -0.963 5.405 -7.864) 9.591 5.177 ( 8.122 5.181 -3.025) 10.097 5.630 ( -22.587 7.983 -1.052) 23.980 6.100 ( 5.347 -0.150 1.569) 5.574 6.558 ( -1.852 -4.660 5.944) 7.776 6.921 ( -13.172 -10.098 5.652) 17.534 7.604 ( -4.251 24.952 -2.882) 25.475 7.856 ( -11.531 27.116 -1.805) 29.521 8.428 ( -5.129 6.058 -8.882) 11.912 8.865 ( -6.854 -1.841 -7.542) 10.356 9.803 ( -13.113 3.072 -2.831) 13.762 10.120 ( 6.315 -2.897 13.015) 14.754 16.875 ( -0.123 0.487 -1.897) 1.962 17.070 ( 2.561 -2.641 1.550) 3.992 17.183 ( 6.120 7.017 0.986) 9.363 17.503 ( 8.217 -5.390 5.575) 11.298 21.319 ( 0.186 0.516 1.279) 1.392 21.527 ( 0.719 -5.365 0.865) 5.482 27.831 ( 0.212 -3.963 -0.917) 4.073 28.045 ( 0.326 -7.542 -1.444) 7.686 37.195 ( 7.370 2.717 1.510) 7.999 37.489 ( 4.002 0.097 2.828) 4.902 38.401 ( -15.357 20.533 -3.241) 25.844 39.258 ( -9.059 -6.739 -15.758) 19.386 ======================= Grid point 472 (242/318) ======================= q-point: ( 0.31 0.30 -0.62) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.682 ( 0.872 3.959 -3.982) 5.683 2.729 ( 3.081 3.363 6.001) 7.538 2.863 ( -7.681 14.612 -14.414) 21.915 3.202 ( -8.237 2.217 -1.517) 8.664 3.636 ( 9.502 13.710 -5.339) 17.515 4.452 ( 11.677 -9.365 2.157) 15.123 4.469 ( 12.213 -7.638 -4.061) 14.966 5.118 ( -16.430 15.516 -0.687) 22.609 5.299 ( -5.371 -10.333 -11.454) 16.334 6.077 ( -7.600 -1.008 -7.770) 10.915 6.596 ( 3.184 -5.157 7.971) 10.013 6.785 ( -6.987 -8.484 7.873) 13.520 7.499 ( -4.584 21.553 -1.715) 22.102 7.675 ( -6.641 27.636 -1.557) 28.466 8.240 ( -11.078 9.462 -3.875) 15.076 8.655 ( -9.381 -5.984 -9.387) 14.558 9.594 ( -5.581 8.976 -3.235) 11.054 10.333 ( 6.260 -5.857 13.129) 15.680 16.883 ( 1.751 1.913 -0.445) 2.632 17.112 ( 1.766 -2.182 -0.159) 2.812 17.328 ( 7.350 10.892 4.360) 13.844 17.678 ( 6.201 -1.096 7.591) 9.863 21.330 ( 0.200 0.168 1.282) 1.308 21.532 ( -0.510 -5.277 0.221) 5.306 27.836 ( 0.770 -4.939 -0.922) 5.083 28.026 ( -1.040 -7.969 -2.430) 8.396 37.363 ( 8.566 2.755 3.745) 9.747 37.566 ( 2.686 2.389 2.253) 4.242 38.101 ( -14.029 16.984 -4.169) 22.420 39.001 ( -8.176 -11.040 -15.425) 20.656 ======================= Grid point 473 (243/318) ======================= q-point: ( 0.38 0.30 -0.62) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.547 ( -10.101 10.849 -12.720) 19.532 2.743 ( 3.191 0.601 -8.977) 9.546 2.780 ( 0.687 0.306 2.434) 2.548 3.053 ( -5.698 -2.975 -4.348) 7.761 3.754 ( 6.703 9.645 -1.328) 11.821 4.613 ( 8.970 -7.619 -4.427) 12.574 4.700 ( -11.000 -1.587 -1.474) 11.211 4.807 ( 6.058 -4.121 -4.048) 8.370 5.132 ( -6.569 -7.951 -10.118) 14.448 5.830 ( -10.509 0.828 -9.206) 13.995 6.655 ( -8.953 -0.279 0.822) 8.995 6.758 ( 4.411 -5.147 12.920) 14.590 7.452 ( -0.035 15.929 -0.849) 15.952 7.597 ( -1.090 25.039 0.390) 25.066 7.990 ( -13.117 13.672 -1.445) 19.002 8.449 ( -6.555 -7.019 -8.750) 12.992 9.537 ( -0.018 12.534 -1.756) 12.656 10.495 ( 3.834 -9.993 10.219) 14.798 16.931 ( 3.002 2.834 1.054) 4.261 17.137 ( 1.126 -1.948 -0.492) 2.303 17.490 ( 6.610 14.295 5.453) 16.667 17.816 ( 3.666 2.825 7.796) 9.066 21.341 ( 0.145 -0.399 1.327) 1.393 21.513 ( -1.299 -4.599 -0.528) 4.808 27.845 ( 0.635 -5.975 -0.766) 6.057 27.983 ( -1.643 -8.047 -2.928) 8.720 37.530 ( 5.690 3.920 4.715) 8.365 37.627 ( 3.720 1.812 0.776) 4.210 37.850 ( -10.391 13.492 -3.158) 17.320 38.785 ( -5.723 -13.878 -14.050) 20.561 ======================= Grid point 474 (244/318) ======================= q-point: ( 0.46 0.30 -0.62) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.308 ( -7.107 0.578 -10.150) 12.404 2.727 ( -0.893 -1.499 -3.137) 3.589 2.858 ( 8.235 -5.272 -4.491) 10.760 2.951 ( -1.941 -6.801 -6.518) 9.618 3.877 ( 7.231 4.083 -1.434) 8.427 4.284 ( -17.878 -3.968 -14.169) 23.154 4.675 ( -0.629 -6.524 -4.774) 8.109 4.980 ( 0.984 -13.174 -3.499) 13.666 5.073 ( 8.692 3.277 3.556) 9.946 5.610 ( -8.388 0.180 -7.803) 11.457 6.464 ( -10.554 8.390 2.300) 13.677 6.911 ( 3.139 -4.379 12.248) 13.381 7.450 ( 1.098 9.107 -4.129) 10.059 7.630 ( 1.693 21.626 3.240) 21.933 7.785 ( -6.274 20.197 -2.038) 21.247 8.317 ( -2.413 -6.687 -6.976) 9.960 9.542 ( 0.899 13.864 -1.156) 13.941 10.602 ( 2.318 -12.993 7.178) 15.024 16.994 ( 2.594 3.714 1.506) 4.774 17.144 ( -0.139 -2.042 -0.469) 2.100 17.624 ( 4.106 16.322 4.802) 17.502 17.908 ( 1.858 4.720 6.521) 8.262 21.353 ( 0.348 -1.112 1.449) 1.859 21.482 ( -1.437 -3.697 -0.903) 4.068 27.850 ( 0.222 -6.743 -0.310) 6.754 27.936 ( -1.541 -7.964 -2.828) 8.591 37.612 ( 2.068 6.069 1.238) 6.530 37.667 ( -3.465 8.915 -2.999) 10.024 37.750 ( 3.479 1.314 3.961) 5.434 38.620 ( -3.842 -14.630 -12.110) 19.377 ======================= Grid point 475 (245/318) ======================= q-point: (-0.46 0.30 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.163 ( -4.887 -6.027 -5.599) 9.568 2.691 ( -1.618 -2.194 -2.871) 3.959 2.874 ( -2.801 -10.942 -2.987) 11.683 2.986 ( 8.702 -9.486 -8.918) 15.660 4.009 ( -1.688 2.605 -6.739) 7.419 4.034 ( 12.408 -2.178 -7.005) 14.414 4.592 ( -4.845 -2.130 -1.377) 5.469 4.948 ( -3.531 -10.133 0.619) 10.748 5.224 ( 0.918 -1.856 2.956) 3.609 5.416 ( -5.642 2.087 -7.035) 9.256 6.349 ( -4.008 11.919 7.361) 14.571 7.013 ( -0.141 -3.528 13.348) 13.807 7.438 ( 1.595 1.502 -8.800) 9.069 7.625 ( -2.323 21.455 2.282) 21.701 7.793 ( 6.292 27.252 -1.308) 27.999 8.289 ( 3.432 -7.040 -5.520) 9.582 9.545 ( 0.020 14.406 -1.016) 14.441 10.669 ( 1.357 -14.363 4.135) 15.008 17.029 ( 0.197 5.357 0.307) 5.369 17.127 ( -1.400 -3.381 0.074) 3.660 17.684 ( -0.127 16.834 2.528) 17.023 17.968 ( 1.204 3.941 4.262) 5.928 21.372 ( 0.753 -1.927 1.317) 2.453 21.454 ( -1.014 -2.921 -0.425) 3.121 27.851 ( -0.035 -6.964 0.393) 6.975 27.895 ( -1.133 -7.838 -2.128) 8.201 37.585 ( -2.325 8.861 0.430) 9.171 37.683 ( 4.505 6.972 -1.822) 8.498 37.848 ( 4.124 -0.472 2.532) 4.863 38.492 ( -3.159 -13.660 -9.573) 16.977 ======================= Grid point 476 (246/318) ======================= q-point: (-0.38 0.30 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.007 ( -9.278 -1.719 0.499) 9.449 2.597 ( -5.222 -0.375 -1.402) 5.420 2.954 ( 11.782 -6.361 2.862) 13.692 3.065 ( 6.144 -9.712 -11.058) 15.948 3.948 ( -1.313 8.228 -9.032) 12.288 4.349 ( 15.557 0.467 2.617) 15.782 4.488 ( -6.940 -8.175 0.682) 10.745 4.872 ( -0.815 -9.039 -2.261) 9.353 5.098 ( -6.708 2.492 -3.000) 7.759 5.408 ( 1.493 3.047 5.724) 6.654 6.394 ( 1.579 7.276 11.614) 13.796 7.065 ( -3.031 -5.541 12.839) 14.308 7.422 ( 5.007 3.277 -13.333) 14.615 7.618 ( 0.204 25.196 1.686) 25.253 7.942 ( 9.398 24.286 0.918) 26.057 8.363 ( 7.566 -7.265 -5.627) 11.903 9.535 ( -0.274 14.621 -0.650) 14.638 10.699 ( 0.110 -14.084 0.975) 14.118 16.995 ( -3.277 5.347 -1.521) 6.453 17.104 ( -1.376 -3.495 1.010) 3.890 17.651 ( -3.865 15.512 -0.579) 15.996 17.993 ( -0.545 1.138 1.072) 1.656 21.388 ( 0.324 -2.136 -0.268) 2.177 21.449 ( 0.300 -3.157 1.738) 3.616 27.843 ( -1.153 -6.317 -0.486) 6.440 27.881 ( 0.361 -7.898 0.628) 7.932 37.557 ( -2.584 6.795 2.786) 7.785 37.760 ( 5.091 6.325 -4.493) 9.279 37.948 ( 7.045 3.828 -1.023) 8.083 38.398 ( -1.978 -10.965 -4.356) 11.963 ======================= Grid point 477 (247/318) ======================= q-point: (-0.31 0.30 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.950 ( -0.099 10.601 17.391) 20.367 2.519 ( -3.647 6.797 2.508) 8.111 3.048 ( -0.062 -6.432 -11.349) 13.045 3.275 ( 17.576 -1.499 1.396) 17.695 3.817 ( -6.817 13.855 -11.382) 19.183 4.226 ( -16.471 -1.922 2.748) 16.809 4.437 ( -10.025 -1.039 4.540) 11.054 5.025 ( 10.130 5.265 0.973) 11.458 5.137 ( 16.014 -10.786 -7.415) 20.682 5.530 ( 6.897 2.762 15.727) 17.393 6.495 ( 0.869 0.394 11.772) 11.811 7.046 ( -4.887 -9.314 8.255) 13.371 7.492 ( 9.821 10.445 -11.433) 18.338 7.655 ( 3.241 28.797 1.142) 29.001 8.117 ( 7.087 15.374 2.404) 17.099 8.496 ( 10.649 -5.277 -5.185) 12.966 9.549 ( 2.670 14.133 0.676) 14.398 10.677 ( -2.324 -12.218 -2.373) 12.661 16.911 ( -4.224 3.697 -1.484) 5.806 17.084 ( -1.310 -1.795 0.916) 2.404 17.543 ( -6.215 12.319 -3.576) 14.254 17.948 ( -4.036 -2.926 -2.696) 5.667 21.382 ( -0.261 -1.348 -1.124) 1.774 21.478 ( 0.935 -4.766 2.810) 5.611 27.815 ( -1.301 -5.412 -0.448) 5.584 27.904 ( 0.875 -7.650 2.406) 8.067 37.488 ( -6.661 2.571 1.087) 7.222 37.788 ( 0.832 2.925 -6.759) 7.411 38.121 ( 14.137 12.870 -5.772) 19.971 38.405 ( 3.120 -4.534 6.034) 8.167 ======================= Grid point 478 (248/318) ======================= q-point: (-0.23 0.30 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.178 ( 6.657 14.497 25.732) 30.275 2.506 ( 0.183 16.780 9.394) 19.231 2.923 ( -5.672 -5.137 -10.724) 13.174 3.442 ( -8.995 11.634 -10.672) 18.170 3.589 ( -2.370 11.000 -6.669) 13.080 4.078 ( -1.144 -4.367 10.858) 11.759 4.235 ( -10.244 9.367 0.733) 13.900 5.103 ( -0.585 3.718 -3.537) 5.165 5.483 ( 21.546 -0.497 2.640) 21.713 5.811 ( 9.244 -4.542 12.723) 16.369 6.552 ( -0.753 -2.086 7.965) 8.268 7.036 ( 0.165 -9.641 8.046) 12.559 7.612 ( 8.711 14.798 -8.519) 19.168 7.756 ( 5.981 32.324 2.598) 32.975 8.206 ( 2.512 3.485 0.295) 4.306 8.697 ( 12.524 -1.748 -2.611) 12.912 9.678 ( 10.689 11.096 3.797) 15.868 10.574 ( -6.531 -8.544 -5.735) 12.188 16.838 ( -2.698 2.954 -0.270) 4.010 17.070 ( -0.595 -0.437 0.540) 0.914 17.386 ( -7.521 7.720 -5.761) 12.221 17.811 ( -7.827 -7.366 -6.128) 12.372 21.370 ( -0.329 -0.789 -1.128) 1.415 21.503 ( -0.223 -6.092 2.408) 6.555 27.795 ( -0.578 -4.283 0.146) 4.325 27.935 ( 0.513 -7.310 3.067) 7.944 37.330 ( -9.210 0.841 -2.565) 9.597 37.711 ( -4.267 -1.673 -6.671) 8.094 38.397 ( 18.983 19.512 -7.496) 28.236 38.584 ( 9.505 4.213 13.602) 17.120 ======================= Grid point 479 (249/318) ======================= q-point: (-0.15 0.30 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.315 ( -4.504 8.091 14.702) 17.375 2.643 ( -4.052 18.786 9.664) 21.511 2.792 ( 2.341 3.386 0.941) 4.222 3.107 ( -11.184 15.183 -5.387) 19.612 3.488 ( -6.394 7.584 -5.712) 11.447 4.091 ( -3.305 12.088 1.442) 12.615 4.268 ( 9.199 6.576 7.298) 13.458 4.983 ( -8.429 2.699 -7.451) 11.570 5.906 ( -2.971 -1.881 8.009) 8.747 5.931 ( 20.652 0.425 4.839) 21.215 6.584 ( 0.248 0.373 6.446) 6.462 7.170 ( 7.533 -7.248 9.386) 14.049 7.692 ( 3.471 23.030 -4.031) 23.636 7.878 ( 4.113 25.023 5.948) 26.047 8.277 ( 7.529 -0.468 -3.132) 8.167 8.879 ( 8.135 0.070 -2.894) 8.634 9.995 ( 18.796 2.342 7.562) 20.395 10.361 ( -11.632 -2.602 -8.623) 14.712 16.816 ( -0.087 2.906 1.308) 3.188 17.068 ( 0.253 0.478 -0.439) 0.696 17.208 ( -7.387 2.604 -6.340) 10.077 17.598 ( -10.038 -10.987 -8.281) 17.030 21.358 ( -0.253 -0.599 -1.017) 1.208 21.494 ( -2.050 -6.179 1.732) 6.737 27.800 ( 0.868 -3.383 0.676) 3.557 27.954 ( -0.431 -6.733 2.897) 7.342 37.151 ( -7.332 1.281 -3.295) 8.139 37.572 ( -6.561 -4.678 -5.138) 9.557 38.684 ( 13.984 19.620 -1.824) 24.162 38.909 ( 17.664 12.860 9.066) 23.656 ======================= Grid point 480 (250/318) ======================= q-point: (-0.08 0.30 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.219 ( -11.844 13.067 6.462) 18.783 2.520 ( -5.913 8.478 3.299) 10.849 2.784 ( -2.285 7.320 0.957) 7.728 3.116 ( 0.024 8.474 5.413) 10.055 3.431 ( 7.796 10.804 -1.387) 13.395 4.074 ( -0.712 16.599 3.036) 16.890 4.454 ( 6.511 7.353 2.212) 10.068 4.730 ( -12.832 8.000 -6.377) 16.411 5.809 ( -6.680 -0.629 1.792) 6.945 6.279 ( 9.127 -3.930 6.323) 11.778 6.674 ( 5.370 8.763 8.438) 13.298 7.355 ( 5.092 -3.080 8.819) 10.639 7.692 ( -2.219 30.444 2.071) 30.595 8.001 ( 5.925 10.517 6.758) 13.835 8.447 ( 12.668 2.893 -6.445) 14.505 8.959 ( 2.751 3.507 -3.945) 5.952 10.036 ( -16.099 2.813 -6.987) 17.773 10.406 ( 17.495 -7.177 5.011) 19.563 16.842 ( 1.212 2.596 2.482) 3.791 17.057 ( -4.731 -1.311 -3.953) 6.303 17.070 ( 0.602 0.259 -3.153) 3.220 17.368 ( -8.596 -12.422 -8.503) 17.335 21.348 ( -0.383 -0.777 -0.614) 1.062 21.457 ( -2.415 -4.775 1.325) 5.513 27.835 ( 2.396 -3.147 0.895) 4.055 27.951 ( -1.437 -5.841 2.089) 6.367 37.044 ( -2.428 1.433 -1.579) 3.232 37.421 ( -6.430 -6.383 -4.047) 9.923 38.881 ( 6.593 20.978 3.176) 22.218 39.290 ( 18.730 13.433 0.642) 23.058 ======================= Grid point 481 (251/318) ======================= q-point: ( 0.00 0.40 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.372 ( -1.265 11.474 3.685) 12.118 2.546 ( 0.310 1.368 1.094) 1.779 2.942 ( -1.166 6.578 8.167) 10.552 3.144 ( -1.386 0.220 1.138) 1.807 3.696 ( 3.320 3.614 -13.483) 14.348 3.997 ( -6.075 -8.139 -7.846) 12.834 4.780 ( 2.317 14.801 4.696) 15.700 4.887 ( 1.387 8.997 6.737) 11.326 5.822 ( -0.826 6.476 2.878) 7.135 6.185 ( -0.218 -10.218 3.859) 10.924 7.017 ( -1.723 10.305 8.435) 13.428 7.352 ( -2.362 -5.808 7.324) 9.642 8.146 ( 0.630 14.328 4.260) 14.961 8.284 ( 6.432 3.915 4.794) 8.926 8.786 ( 7.667 13.422 -6.570) 16.795 9.077 ( 3.060 2.567 -3.069) 5.037 9.893 ( -9.508 9.922 -0.587) 13.755 10.364 ( 0.606 -13.730 0.859) 13.770 16.828 ( -3.323 -2.065 -1.107) 4.066 16.929 ( -5.646 -5.601 -3.954) 8.882 17.038 ( 4.124 0.106 -3.617) 5.487 17.106 ( 1.676 -1.381 -3.072) 3.762 21.328 ( -0.633 0.349 0.303) 0.783 21.381 ( 0.123 -2.315 0.356) 2.346 27.830 ( 0.854 -1.817 0.719) 2.133 27.856 ( 0.293 -3.136 1.246) 3.387 37.053 ( 0.511 1.230 -0.447) 1.405 37.180 ( -2.434 -5.538 -2.044) 6.386 39.355 ( 1.028 16.774 2.547) 16.997 39.665 ( 6.289 1.348 -3.739) 7.440 ======================= Grid point 482 (252/318) ======================= q-point: ( 0.08 0.40 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.439 ( 5.861 11.816 3.426) 13.627 2.602 ( 4.710 3.277 1.220) 5.866 3.026 ( 4.035 2.867 9.449) 10.667 3.200 ( 6.967 0.227 1.705) 7.177 3.589 ( -4.632 0.964 -14.888) 15.621 3.873 ( -4.366 -8.492 -1.786) 9.714 4.838 ( 0.767 14.350 2.001) 14.509 4.969 ( 3.986 7.903 4.515) 9.936 5.852 ( 2.210 6.493 2.804) 7.410 6.206 ( 0.314 -8.985 2.897) 9.445 6.887 ( -16.244 9.820 7.221) 20.309 7.245 ( -12.567 -6.808 5.692) 15.384 8.162 ( -0.821 16.593 1.048) 16.646 8.415 ( 3.362 1.668 1.865) 4.191 8.806 ( 0.535 14.900 -11.828) 19.032 9.089 ( 0.035 1.523 -5.194) 5.413 9.803 ( -1.326 11.782 8.085) 14.351 10.297 ( -7.676 -13.423 -0.294) 15.466 16.810 ( 0.763 -3.845 2.082) 4.438 16.863 ( 0.021 -5.870 -0.621) 5.903 17.112 ( 5.421 -0.254 -2.810) 6.112 17.123 ( 3.276 1.105 -4.505) 5.679 21.323 ( -0.188 0.884 0.590) 1.080 21.394 ( 0.981 -2.772 0.294) 2.955 27.823 ( -1.062 -1.168 0.050) 1.579 27.885 ( 1.547 -4.050 0.502) 4.364 37.073 ( 1.912 1.263 -0.783) 2.421 37.192 ( 4.101 -4.975 0.406) 6.460 39.300 ( -7.795 17.356 0.386) 19.030 39.653 ( -4.026 -1.089 -6.839) 8.010 ======================= Grid point 483 (253/318) ======================= q-point: ( 0.15 0.40 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.586 ( 6.782 8.601 2.792) 11.303 2.712 ( 5.586 3.505 0.192) 6.597 3.198 ( 7.243 5.330 8.990) 12.715 3.394 ( 8.928 5.119 -2.623) 10.620 3.446 ( 3.360 0.389 -8.356) 9.015 3.786 ( -5.258 -11.736 3.683) 13.377 4.793 ( -5.466 13.348 -3.125) 14.759 5.085 ( 6.301 1.555 -0.611) 6.519 5.926 ( 3.013 5.325 2.606) 6.650 6.210 ( -2.642 -2.743 0.649) 3.863 6.572 ( -18.663 5.760 6.773) 20.673 6.986 ( -17.575 -10.285 3.849) 20.723 8.120 ( -3.500 16.852 -2.100) 17.339 8.393 ( -5.706 4.522 -0.705) 7.314 8.705 ( -2.874 12.623 -12.844) 18.237 8.998 ( -5.735 -1.305 -7.059) 9.188 9.918 ( 4.975 7.559 12.651) 15.554 10.112 ( -10.685 -4.890 -0.028) 11.751 16.844 ( 1.119 -2.382 1.540) 3.049 16.913 ( 3.377 -5.216 3.655) 7.209 17.174 ( 5.662 2.994 -2.559) 6.897 17.238 ( 9.430 -1.454 -1.672) 9.687 21.328 ( 0.194 1.239 0.684) 1.428 21.416 ( 1.098 -3.439 0.342) 3.626 27.802 ( -0.925 -0.500 -0.537) 1.181 27.907 ( 0.738 -5.385 -0.384) 5.449 37.133 ( 5.045 2.869 -0.002) 5.804 37.306 ( 6.724 -5.103 1.966) 8.667 39.083 ( -14.618 16.700 -2.145) 22.297 39.453 ( -11.669 -3.301 -9.411) 15.350 ======================= Grid point 484 (254/318) ======================= q-point: ( 0.23 0.40 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.705 ( 4.589 5.176 0.974) 6.985 2.777 ( 2.120 3.007 -2.770) 4.605 3.226 ( -4.464 9.388 1.211) 10.465 3.470 ( -5.385 4.074 -1.222) 6.862 3.624 ( 17.589 6.368 -4.705) 19.289 3.871 ( 13.460 -13.868 7.570) 20.756 4.610 ( -9.901 11.687 -7.649) 17.121 5.149 ( 1.556 -8.777 -6.563) 11.069 5.830 ( -17.786 12.636 -1.419) 21.864 6.137 ( -0.131 2.422 -1.329) 2.765 6.432 ( -2.627 -5.491 7.324) 9.524 6.693 ( -14.363 -12.596 5.133) 19.782 8.003 ( -6.889 15.569 -4.616) 17.640 8.233 ( -9.630 8.424 -2.082) 12.963 8.565 ( -5.043 8.026 -8.231) 12.554 8.804 ( -10.114 -3.916 -7.516) 13.196 9.921 ( -7.441 8.025 1.459) 11.041 10.105 ( 4.671 -0.007 11.170) 12.108 16.869 ( 1.055 0.029 0.719) 1.277 16.990 ( 2.459 -5.118 2.829) 6.344 17.313 ( 9.802 5.838 1.032) 11.455 17.443 ( 11.845 -1.534 2.818) 12.272 21.336 ( 0.204 1.287 0.679) 1.470 21.435 ( 0.592 -3.915 0.240) 3.967 27.784 ( -0.526 -0.614 -0.962) 1.256 27.906 ( -0.342 -6.211 -1.363) 6.368 37.257 ( 7.693 3.817 1.513) 8.720 37.446 ( 6.542 -4.168 2.702) 8.214 38.758 ( -17.728 15.200 -4.249) 23.736 39.140 ( -14.767 -5.870 -11.052) 19.356 ======================= Grid point 485 (255/318) ======================= q-point: ( 0.31 0.40 -0.62) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.744 ( 0.486 2.791 -4.569) 5.376 2.787 ( 1.136 1.853 -1.622) 2.712 3.117 ( -7.182 9.813 -6.178) 13.640 3.252 ( -13.638 2.544 -2.798) 14.152 3.897 ( 10.645 11.803 -5.812) 16.924 4.224 ( 18.471 -10.204 4.297) 21.535 4.417 ( -2.896 1.967 -5.338) 6.383 5.001 ( -13.021 -18.733 -12.312) 25.924 5.471 ( -14.922 19.143 -2.461) 24.396 6.034 ( -9.667 -5.076 -8.035) 13.557 6.487 ( 4.168 -4.201 8.743) 10.557 6.605 ( -1.583 -8.593 9.333) 12.784 7.827 ( -8.159 12.379 -5.520) 15.820 8.037 ( -9.525 7.320 -2.479) 12.266 8.429 ( -6.327 8.287 -2.720) 10.775 8.566 ( -9.973 -1.835 -6.344) 11.961 9.837 ( -2.678 14.093 1.444) 14.418 10.234 ( 2.495 -5.149 9.273) 10.896 16.901 ( 2.007 1.093 1.022) 2.504 17.039 ( 1.758 -4.836 1.233) 5.291 17.528 ( 10.933 8.724 4.340) 14.645 17.684 ( 10.800 0.449 5.555) 12.153 21.341 ( -0.037 1.063 0.607) 1.225 21.439 ( -0.140 -4.000 -0.073) 4.003 27.770 ( -0.315 -1.435 -1.228) 1.914 27.880 ( -1.226 -6.411 -2.203) 6.889 37.422 ( 8.334 3.511 2.807) 9.469 37.570 ( 4.948 -2.038 2.798) 6.039 38.404 ( -16.729 13.331 -5.255) 22.027 38.806 ( -13.384 -8.951 -11.532) 19.805 ======================= Grid point 486 (256/318) ======================= q-point: ( 0.38 0.40 -0.62) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.696 ( -4.211 3.354 -5.284) 7.544 2.778 ( -0.853 -0.792 -2.840) 3.070 2.840 ( -10.840 8.747 -19.386) 23.871 3.005 ( -10.051 -1.587 -6.290) 11.963 3.925 ( -0.165 8.875 -4.944) 10.160 4.461 ( 1.314 -8.301 -5.877) 10.255 4.543 ( 7.605 -13.882 -3.930) 16.309 4.610 ( -7.386 -7.738 -4.565) 11.630 5.274 ( -5.962 15.600 -2.309) 16.859 5.781 ( -10.704 -6.225 -8.055) 14.772 6.625 ( 0.042 -1.787 5.383) 5.672 6.662 ( 4.420 -3.986 11.812) 13.227 7.663 ( -5.791 7.835 -5.329) 11.105 7.877 ( -5.931 2.339 -0.905) 6.439 8.290 ( -7.182 12.810 -0.183) 14.687 8.396 ( -4.923 2.407 -4.544) 7.119 9.825 ( 0.006 15.456 1.364) 15.517 10.312 ( 0.987 -9.077 7.108) 11.572 16.954 ( 2.647 0.928 1.892) 3.384 17.074 ( 1.375 -4.181 0.579) 4.440 17.746 ( 8.992 10.788 5.497) 15.082 17.890 ( 7.449 3.157 6.051) 10.103 21.342 ( -0.227 0.643 0.537) 0.868 21.430 ( -0.670 -3.720 -0.424) 3.803 27.757 ( -0.361 -2.558 -1.242) 2.866 27.839 ( -1.576 -6.197 -2.624) 6.912 37.585 ( 6.968 2.478 3.282) 8.091 37.659 ( 3.134 0.387 1.954) 3.714 38.099 ( -12.433 11.609 -4.813) 17.678 38.528 ( -9.126 -11.837 -10.741) 18.405 ======================= Grid point 487 (257/318) ======================= q-point: ( 0.46 0.40 -0.62) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.384 ( -14.754 7.071 -15.100) 22.264 2.699 ( -1.834 -1.534 -4.382) 4.992 2.770 ( 0.824 -4.074 -8.798) 9.730 2.797 ( -3.156 -7.877 -14.181) 16.526 3.920 ( 2.881 1.175 -4.137) 5.177 4.122 ( -12.436 -9.883 -12.853) 20.434 4.611 ( 2.740 -0.899 0.353) 2.905 4.763 ( 5.680 -8.275 -1.153) 10.103 5.215 ( -0.005 9.954 0.665) 9.976 5.562 ( -8.311 -5.028 -6.215) 11.532 6.604 ( -4.414 6.043 5.938) 9.553 6.814 ( 3.068 -5.171 10.747) 12.315 7.550 ( -2.589 5.245 -5.975) 8.362 7.821 ( -0.416 -2.785 0.780) 2.922 8.196 ( -2.112 16.238 -0.629) 16.387 8.313 ( -1.739 6.034 -2.803) 6.877 9.840 ( 0.579 15.480 1.082) 15.529 10.363 ( 0.774 -11.492 5.161) 12.621 17.013 ( 2.017 0.021 2.352) 3.098 17.093 ( 0.256 -3.194 0.111) 3.207 17.910 ( 5.040 11.604 4.777) 13.523 18.023 ( 3.302 5.190 4.985) 7.917 21.342 ( -0.103 0.097 0.554) 0.572 21.413 ( -0.787 -3.223 -0.530) 3.360 27.743 ( -0.366 -3.546 -0.843) 3.664 27.795 ( -1.359 -5.813 -2.475) 6.463 37.702 ( 3.055 2.880 1.797) 4.567 37.723 ( 3.827 0.678 1.000) 4.013 37.903 ( -5.834 10.136 -2.852) 12.038 38.343 ( -4.824 -13.129 -8.938) 16.599 ======================= Grid point 488 (258/318) ======================= q-point: (-0.46 0.40 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.122 ( -5.534 2.738 -8.208) 10.271 2.567 ( -6.351 -14.756 -6.322) 17.264 2.698 ( 3.586 -0.627 -6.097) 7.101 2.837 ( 7.901 -6.059 -10.602) 14.545 3.980 ( 6.473 -1.776 -8.438) 10.782 4.012 ( 7.290 -2.492 -4.835) 9.095 4.601 ( -3.944 2.306 0.904) 4.657 4.779 ( -1.918 -6.889 -2.195) 7.480 5.235 ( -1.231 3.169 2.777) 4.390 5.411 ( -3.843 -2.562 -2.968) 5.490 6.556 ( -4.763 9.196 7.584) 12.836 6.885 ( -2.226 -8.033 10.589) 13.476 7.508 ( 2.419 6.852 -6.935) 10.044 7.846 ( 2.457 -3.359 -0.215) 4.167 8.211 ( 4.326 14.962 -1.417) 15.640 8.299 ( 1.626 8.247 -1.842) 8.606 9.852 ( 0.120 15.955 0.683) 15.970 10.406 ( 1.095 -12.605 3.313) 13.079 17.049 ( 0.262 -1.373 2.064) 2.493 17.079 ( -1.558 -1.674 -0.497) 2.340 17.976 ( -0.449 11.513 2.318) 11.753 18.074 ( -0.354 5.177 3.125) 6.058 21.347 ( 0.296 -0.494 0.567) 0.808 21.397 ( -0.536 -2.670 -0.173) 2.728 27.736 ( -0.041 -4.179 -0.007) 4.179 27.762 ( -0.857 -5.291 -1.820) 5.661 37.723 ( -1.768 5.058 0.869) 5.429 37.787 ( 3.273 2.260 -1.580) 4.280 37.885 ( 4.910 5.203 0.111) 7.155 38.235 ( -1.796 -11.981 -6.883) 13.934 ======================= Grid point 489 (259/318) ======================= q-point: (-0.38 0.40 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.061 ( 0.572 7.369 4.074) 8.439 2.531 ( 3.004 -8.833 2.142) 9.573 2.818 ( 11.553 -3.350 -1.004) 12.071 2.934 ( 9.379 -4.591 -8.977) 13.771 4.055 ( 6.072 3.230 -9.204) 11.489 4.219 ( 11.280 -8.060 -3.382) 14.270 4.504 ( -4.917 4.278 1.343) 6.655 4.709 ( -1.138 -7.192 -4.419) 8.517 5.183 ( -3.034 6.160 2.012) 7.155 5.414 ( 1.998 -2.492 6.187) 6.963 6.522 ( -4.467 6.269 9.531) 12.252 6.862 ( -6.026 -11.503 8.658) 15.607 7.564 ( 7.906 9.735 -6.737) 14.236 7.903 ( 4.512 -0.091 -1.908) 4.900 8.327 ( 8.490 11.764 -1.665) 14.602 8.338 ( 3.417 7.834 -1.630) 8.701 9.854 ( -0.067 17.011 0.516) 17.019 10.440 ( 0.937 -12.616 1.480) 12.737 17.019 ( -3.586 -0.937 -0.580) 3.752 17.059 ( -0.856 -1.645 1.056) 2.134 17.921 ( -5.748 10.763 -1.043) 12.246 18.044 ( -4.166 2.839 0.423) 5.059 21.357 ( 0.467 -0.840 0.148) 0.972 21.393 ( -0.043 -2.404 0.780) 2.528 27.736 ( -0.377 -4.047 -0.294) 4.075 27.750 ( 0.524 -4.952 0.452) 5.000 37.665 ( -5.060 4.800 0.998) 7.045 37.822 ( 0.784 -0.395 -3.009) 3.134 38.045 ( 12.080 5.028 -0.277) 13.088 38.217 ( 4.505 -6.653 -3.538) 8.779 ======================= Grid point 490 (260/318) ======================= q-point: (-0.31 0.40 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.209 ( 7.290 14.438 17.050) 23.501 2.625 ( 5.028 0.748 2.561) 5.692 2.932 ( 2.099 -1.365 -4.119) 4.820 3.226 ( 21.324 -5.044 4.345) 22.339 4.029 ( -4.497 7.059 -11.227) 14.004 4.144 ( -12.080 -3.302 -1.100) 12.571 4.469 ( -1.680 3.611 -2.985) 4.977 4.859 ( 18.092 -13.731 -7.295) 23.856 5.228 ( 6.460 11.395 6.893) 14.802 5.547 ( 6.306 -1.979 13.543) 15.070 6.501 ( -3.832 1.306 9.382) 10.218 6.791 ( -5.557 -13.279 6.790) 15.916 7.701 ( 10.058 10.692 -5.481) 15.669 8.000 ( 7.588 2.333 -2.493) 8.321 8.375 ( 1.265 11.503 -0.560) 11.586 8.503 ( 10.947 4.840 -2.233) 12.176 9.867 ( 1.419 17.354 0.952) 17.438 10.451 ( -0.344 -11.394 -0.382) 11.405 16.943 ( -3.800 1.014 -0.672) 3.990 17.046 ( -0.957 -2.749 0.762) 3.009 17.761 ( -9.547 8.999 -4.283) 13.801 17.919 ( -8.515 -0.640 -3.039) 9.064 21.362 ( 0.160 -0.540 -0.352) 0.664 21.403 ( 0.205 -2.828 1.519) 3.217 27.729 ( -0.135 -2.896 0.086) 2.900 27.775 ( 1.107 -5.151 1.929) 5.611 37.544 ( -7.951 3.662 -0.709) 8.782 37.757 ( -5.164 -5.082 -3.758) 8.162 38.324 ( 18.455 6.983 -2.042) 19.837 38.381 ( 12.808 1.175 2.512) 13.105 ======================= Grid point 491 (261/318) ======================= q-point: (-0.23 0.40 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.414 ( 1.997 9.926 14.313) 17.532 2.737 ( 2.836 -3.787 0.226) 4.736 2.953 ( 2.882 17.556 8.907) 19.896 3.564 ( 3.881 -2.065 -0.977) 4.503 3.790 ( -7.171 8.302 -8.494) 13.874 3.949 ( -5.380 -4.043 1.360) 6.866 4.457 ( 3.474 11.830 -4.988) 13.300 5.023 ( 3.838 -12.393 -7.846) 15.161 5.545 ( 19.586 7.976 10.004) 23.395 5.775 ( 6.955 -1.051 14.567) 16.177 6.504 ( -0.399 -1.109 6.878) 6.978 6.783 ( 1.641 -13.667 7.501) 15.676 7.849 ( 8.267 10.762 -2.851) 13.867 8.145 ( 8.310 -0.591 -1.890) 8.542 8.383 ( 0.383 18.316 0.896) 18.341 8.696 ( 11.012 0.185 -2.154) 11.222 9.933 ( 4.975 14.340 2.055) 15.317 10.415 ( -2.915 -8.417 -2.347) 9.211 16.885 ( -1.932 2.622 -0.060) 3.258 17.040 ( 0.054 -3.199 0.338) 3.217 17.528 ( -11.738 6.215 -6.728) 14.888 17.698 ( -12.093 -4.095 -6.263) 14.221 21.360 ( -0.163 -0.133 -0.448) 0.495 21.412 ( -0.398 -3.263 1.418) 3.580 27.734 ( 0.447 -1.650 0.737) 1.862 27.808 ( 1.007 -5.231 2.511) 5.889 37.372 ( -9.156 3.595 -2.335) 10.110 37.611 ( -7.765 -7.053 -3.497) 11.058 38.664 ( 18.096 8.213 -0.929) 19.894 38.709 ( 20.046 6.337 4.580) 21.517 ======================= Grid point 492 (262/318) ======================= q-point: (-0.15 0.40 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.458 ( -3.917 6.549 10.494) 12.975 2.679 ( -4.964 -4.331 -3.315) 7.375 3.108 ( -0.957 17.485 12.565) 21.553 3.351 ( -11.514 7.655 -3.143) 14.179 3.644 ( -3.237 9.228 -8.260) 12.801 4.074 ( 9.277 -7.972 -1.674) 12.346 4.536 ( 6.236 15.071 1.027) 16.342 4.973 ( -3.836 -4.699 -4.572) 7.596 5.849 ( 1.785 0.708 5.999) 6.299 5.986 ( 10.802 0.034 11.443) 15.736 6.598 ( 7.482 3.166 6.904) 10.662 6.969 ( 11.992 -11.854 8.751) 18.997 7.971 ( 5.537 10.355 1.165) 11.800 8.219 ( -0.803 -1.064 2.286) 2.646 8.462 ( 8.479 21.803 -0.695) 23.404 8.875 ( 9.410 -1.552 -2.053) 9.755 10.072 ( 7.569 5.839 3.369) 10.136 10.312 ( -5.806 -3.322 -4.364) 7.987 16.875 ( 0.640 3.595 0.431) 3.677 17.053 ( 1.315 -2.787 -0.608) 3.141 17.264 ( -11.610 2.864 -7.279) 13.999 17.415 ( -13.263 -6.902 -8.194) 17.050 21.351 ( -0.411 0.035 -0.437) 0.601 21.404 ( -1.170 -3.127 1.074) 3.507 27.755 ( 1.242 -0.927 1.143) 1.925 27.837 ( 0.438 -4.901 2.470) 5.506 37.198 ( -7.509 3.704 -2.504) 8.740 37.441 ( -8.156 -7.603 -3.172) 11.592 38.984 ( 15.218 11.633 2.979) 19.385 39.118 ( 20.993 6.363 1.659) 21.998 ======================= Grid point 493 (263/318) ======================= q-point: (-0.08 0.40 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.417 ( -5.608 7.430 6.985) 11.638 2.578 ( -3.835 -0.794 -0.521) 3.951 2.998 ( -8.817 11.932 3.943) 15.352 3.214 ( -6.201 1.783 1.690) 6.670 3.652 ( 6.852 11.639 -8.346) 15.877 4.125 ( -0.414 -8.222 -8.744) 12.010 4.678 ( 5.753 13.313 5.497) 15.509 4.879 ( -3.952 4.733 1.960) 6.470 5.842 ( -2.989 4.299 3.750) 6.441 6.151 ( 1.869 -8.444 5.827) 10.429 6.855 ( 11.807 9.660 9.219) 17.824 7.237 ( 9.222 -8.133 8.147) 14.750 8.076 ( 4.078 10.142 4.206) 11.713 8.205 ( -1.538 5.590 5.628) 8.080 8.636 ( 10.594 16.113 -3.233) 19.553 9.010 ( 6.223 0.204 -2.250) 6.621 10.094 ( -9.016 3.460 -2.509) 9.977 10.280 ( 6.342 -5.656 0.838) 8.539 16.893 ( -0.239 2.984 -0.480) 3.032 17.043 ( -4.942 0.057 -5.668) 7.520 17.075 ( -0.772 -0.239 -1.585) 1.779 17.143 ( -9.015 -9.697 -7.614) 15.274 21.340 ( -0.594 0.054 -0.186) 0.625 21.387 ( -1.024 -2.536 0.708) 2.825 27.792 ( 1.882 -1.097 1.186) 2.480 27.852 ( -0.281 -4.056 1.915) 4.494 37.082 ( -3.445 2.802 -1.461) 4.675 37.284 ( -6.568 -6.968 -2.894) 10.003 39.237 ( 9.401 14.788 3.607) 17.891 39.470 ( 15.754 4.142 -0.714) 16.305 ======================= Grid point 494 (264/318) ======================= q-point: ( 0.00 -0.50 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 312 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.523 ( 0.943 -3.998 3.148) 5.175 2.523 ( 0.943 3.998 3.148) 5.175 3.080 ( -3.099 -6.147 3.881) 7.903 3.080 ( -3.099 6.147 3.881) 7.903 3.819 ( -2.242 -8.510 -12.309) 15.131 3.819 ( -2.242 8.510 -12.309) 15.131 4.955 ( 2.203 -2.601 6.229) 7.101 4.955 ( 2.203 2.601 6.229) 7.101 5.984 ( -0.310 -9.625 3.434) 10.224 5.984 ( -0.310 9.625 3.434) 10.224 7.206 ( -1.716 -8.721 7.306) 11.506 7.206 ( -1.716 8.721 7.306) 11.506 8.299 ( 3.977 -2.851 4.480) 6.634 8.299 ( 3.977 2.851 4.480) 6.634 9.025 ( 4.818 -8.219 -3.483) 10.144 9.025 ( 4.818 8.219 -3.483) 10.144 10.109 ( -4.239 -11.950 0.207) 12.681 10.109 ( -4.239 11.950 0.207) 12.681 16.832 ( -4.995 -2.811 -4.015) 6.998 16.832 ( -4.995 2.811 -4.015) 6.998 17.072 ( 3.208 -2.129 -2.180) 4.424 17.072 ( 3.208 2.129 -2.180) 4.424 21.345 ( -0.136 -1.327 0.207) 1.350 21.345 ( -0.136 1.327 0.207) 1.350 27.818 ( 0.546 -0.655 1.031) 1.338 27.818 ( 0.546 0.655 1.031) 1.338 37.094 ( -0.950 -3.120 -1.180) 3.469 37.094 ( -0.950 3.120 -1.180) 3.469 39.602 ( 3.202 -7.907 -0.237) 8.534 39.602 ( 3.202 7.907 -0.237) 8.534 ======================= Grid point 496 (265/318) ======================= q-point: ( 0.08 -0.50 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 312 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.600 ( 5.296 -3.941 1.905) 6.870 2.600 ( 5.296 3.941 1.905) 6.870 3.122 ( 4.652 -6.076 6.352) 9.945 3.122 ( 4.652 6.076 6.352) 9.945 3.694 ( -4.118 -8.413 -8.651) 12.750 3.694 ( -4.118 8.413 -8.651) 12.750 5.016 ( 0.965 -3.397 3.255) 4.803 5.016 ( 0.965 3.397 3.255) 4.803 6.015 ( 1.779 -9.599 2.644) 10.114 6.015 ( 1.779 9.599 2.644) 10.114 7.081 ( -15.027 -9.416 5.889) 18.686 7.081 ( -15.027 9.416 5.889) 18.686 8.374 ( 1.582 -5.891 0.766) 6.148 8.374 ( 1.582 5.891 0.766) 6.148 9.039 ( -0.616 -7.291 -6.859) 10.029 9.039 ( -0.616 7.291 -6.859) 10.029 10.044 ( -3.444 -12.390 3.728) 13.389 10.044 ( -3.444 12.390 3.728) 13.389 16.784 ( 0.614 -1.461 0.596) 1.693 16.784 ( 0.614 1.461 0.596) 1.693 17.125 ( 4.523 -0.716 -3.594) 5.821 17.125 ( 4.523 0.716 -3.594) 5.821 21.349 ( 0.406 -1.773 0.268) 1.839 21.349 ( 0.406 1.773 0.268) 1.839 27.828 ( 0.093 -1.630 0.331) 1.666 27.828 ( 0.093 1.630 0.331) 1.666 37.113 ( 3.263 -2.952 -0.141) 4.403 37.113 ( 3.263 2.952 -0.141) 4.403 39.559 ( -6.692 -8.771 -2.656) 11.348 39.559 ( -6.692 8.771 -2.656) 11.348 ======================= Grid point 498 (266/318) ======================= q-point: ( 0.15 -0.50 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 312 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.712 ( 5.297 -3.487 0.126) 6.343 2.712 ( 5.297 3.487 0.126) 6.343 3.332 ( 13.111 -6.914 7.658) 16.684 3.332 ( 13.111 6.914 7.658) 16.684 3.571 ( -4.834 -9.128 -4.298) 11.188 3.571 ( -4.834 9.128 -4.298) 11.188 5.013 ( -2.256 -8.200 -1.869) 8.708 5.013 ( -2.256 8.200 -1.869) 8.708 6.074 ( 2.785 -8.627 1.423) 9.177 6.074 ( 2.785 8.627 1.423) 9.177 6.764 ( -20.923 -11.544 4.434) 24.304 6.764 ( -20.923 11.544 4.434) 24.304 8.353 ( -3.257 -7.098 -2.535) 8.210 8.353 ( -3.257 7.098 -2.535) 8.210 8.916 ( -7.166 -7.450 -8.667) 13.490 8.916 ( -7.166 7.450 -8.667) 13.490 10.035 ( -1.059 -4.148 6.469) 7.758 10.035 ( -1.059 4.148 6.469) 7.758 16.836 ( 2.818 -1.864 3.327) 4.742 16.836 ( 2.818 1.864 3.327) 4.742 17.217 ( 8.078 -1.383 -2.678) 8.622 17.217 ( 8.078 1.383 -2.678) 8.622 21.361 ( 0.594 -2.197 0.311) 2.297 21.361 ( 0.594 2.197 0.311) 2.297 27.825 ( -0.338 -2.775 -0.415) 2.826 27.825 ( -0.338 2.775 -0.415) 2.826 37.206 ( 6.338 -4.588 0.994) 7.887 37.206 ( 6.338 4.588 0.994) 7.887 39.337 ( -14.274 -9.048 -5.114) 17.657 39.337 ( -14.274 9.048 -5.114) 17.657 ======================= Grid point 500 (267/318) ======================= q-point: ( 0.23 -0.50 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 312 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.782 ( 2.911 -2.213 -2.568) 4.468 2.782 ( 2.911 2.213 -2.568) 4.469 3.430 ( -8.232 -9.148 2.162) 12.495 3.430 ( -8.232 9.148 2.162) 12.495 3.693 ( 19.634 -3.137 2.590) 20.051 3.693 ( 19.634 3.137 2.590) 20.051 4.890 ( -8.289 -15.395 -7.843) 19.164 4.890 ( -8.289 15.395 -7.843) 19.164 6.072 ( -5.922 -9.759 -3.235) 11.865 6.072 ( -5.922 9.759 -3.235) 11.865 6.463 ( -10.669 -8.886 7.301) 15.687 6.463 ( -10.669 8.886 7.301) 15.687 8.226 ( -7.958 -6.869 -4.983) 11.634 8.226 ( -7.958 6.869 -4.983) 11.634 8.711 ( -8.966 -5.911 -6.090) 12.346 8.711 ( -8.966 5.911 -6.090) 12.346 10.063 ( -0.388 -5.028 6.310) 8.077 10.063 ( -0.388 5.028 6.310) 8.077 16.900 ( 2.066 -3.321 2.546) 4.667 16.900 ( 2.066 3.321 2.546) 4.667 17.403 ( 12.111 -3.127 1.402) 12.587 17.403 ( 12.111 3.127 1.402) 12.587 21.372 ( 0.348 -2.440 0.264) 2.479 21.372 ( 0.348 2.440 0.264) 2.479 27.810 ( -0.725 -3.223 -1.142) 3.495 27.810 ( -0.725 3.223 -1.142) 3.495 37.348 ( 7.654 -5.161 2.024) 9.450 37.348 ( 7.654 5.161 2.024) 9.450 38.997 ( -17.709 -9.229 -6.993) 21.158 38.997 ( -17.709 9.229 -6.993) 21.158 ======================= Grid point 502 (268/318) ======================= q-point: ( 0.31 -0.50 -0.62) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 312 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.789 ( 0.443 -1.451 -5.074) 5.296 2.789 ( 0.443 1.451 -5.074) 5.296 3.251 ( -11.535 -3.599 -1.930) 12.236 3.251 ( -11.535 3.599 -1.930) 12.236 4.065 ( 17.883 -6.516 -0.576) 19.042 4.065 ( 17.883 6.516 -0.576) 19.042 4.621 ( -13.553 -17.526 -9.749) 24.205 4.621 ( -13.553 17.526 -9.749) 24.205 5.827 ( -13.431 -15.494 -5.706) 21.284 5.827 ( -13.431 15.494 -5.706) 21.284 6.479 ( 3.281 -3.480 9.316) 10.472 6.479 ( 3.281 3.480 9.316) 10.472 8.015 ( -10.501 -6.700 -5.885) 13.776 8.015 ( -10.501 6.700 -5.885) 13.776 8.540 ( -6.639 -2.740 -2.334) 7.552 8.540 ( -6.639 2.740 -2.334) 7.552 10.088 ( -0.562 -10.254 5.148) 11.487 10.088 ( -0.562 10.254 5.148) 11.487 16.948 ( 1.965 -3.777 1.636) 4.561 16.948 ( 1.965 3.777 1.636) 4.561 17.655 ( 12.396 -3.878 4.611) 13.782 17.655 ( 12.396 3.878 4.611) 13.782 21.376 ( -0.107 -2.447 0.107) 2.451 21.376 ( -0.107 2.447 0.107) 2.451 27.785 ( -1.051 -2.926 -1.729) 3.557 27.785 ( -1.051 2.926 -1.729) 3.557 37.502 ( 7.185 -4.255 2.641) 8.758 37.502 ( 7.185 4.255 2.641) 8.758 38.628 ( -16.640 -9.657 -7.842) 20.776 38.628 ( -16.640 9.657 -7.842) 20.776 ======================= Grid point 504 (269/318) ======================= q-point: ( 0.38 -0.50 -0.62) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 312 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.746 ( -1.546 -2.191 -5.521) 6.138 2.746 ( -1.546 2.191 -5.521) 6.138 2.969 ( -14.028 -3.355 -12.647) 19.183 2.969 ( -14.028 3.355 -12.647) 19.183 4.157 ( -7.371 -15.337 -11.679) 20.639 4.157 ( -7.371 15.337 -11.679) 20.639 4.494 ( 7.225 -3.613 1.700) 8.255 4.494 ( 7.225 3.613 1.700) 8.255 5.580 ( -9.356 -13.750 -5.287) 17.451 5.580 ( -9.356 13.750 -5.287) 17.451 6.613 ( 4.149 -0.889 9.098) 10.038 6.613 ( 4.149 0.889 9.098) 10.038 7.805 ( -8.040 -6.581 -4.460) 11.307 7.805 ( -8.040 6.581 -4.460) 11.307 8.432 ( -4.173 -1.585 -0.725) 4.522 8.432 ( -4.173 1.585 -0.725) 4.522 10.106 ( -0.357 -12.376 4.057) 13.028 10.106 ( -0.357 12.376 4.057) 13.028 16.995 ( 1.968 -3.284 1.524) 4.121 16.995 ( 1.968 3.284 1.524) 4.121 17.892 ( 9.427 -3.596 5.535) 11.508 17.892 ( 9.427 3.596 5.535) 11.508 21.370 ( -0.443 -2.240 -0.064) 2.284 21.370 ( -0.443 2.240 -0.064) 2.284 27.753 ( -1.184 -2.199 -1.974) 3.184 27.753 ( -1.184 2.199 -1.974) 3.184 37.636 ( 5.434 -2.327 2.503) 6.419 37.636 ( 5.434 2.327 2.503) 6.419 38.313 ( -12.007 -10.380 -7.427) 17.524 38.313 ( -12.007 10.380 -7.427) 17.524 ======================= Grid point 506 (270/318) ======================= q-point: ( 0.46 -0.50 -0.62) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 312 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.566 ( -15.004 -10.318 -12.835) 22.278 2.566 ( -15.004 10.318 -12.835) 22.278 2.728 ( 1.317 -1.215 -12.392) 12.521 2.728 ( 1.317 1.215 -12.392) 12.521 3.969 ( -3.285 -4.850 -7.527) 9.538 3.969 ( -3.285 4.850 -7.527) 9.538 4.642 ( 5.144 -4.053 0.506) 6.568 4.642 ( 5.144 4.053 0.506) 6.568 5.416 ( -5.698 -9.434 -3.241) 11.488 5.416 ( -5.698 9.434 -3.241) 11.488 6.712 ( 0.510 -5.125 8.375) 9.832 6.712 ( 0.510 5.125 8.375) 9.832 7.685 ( -2.240 -8.044 -3.073) 8.897 7.685 ( -2.240 8.044 -3.073) 8.897 8.378 ( -1.191 -2.146 -0.515) 2.508 8.378 ( -1.191 2.146 -0.515) 2.508 10.126 ( 0.212 -13.109 3.055) 13.462 10.126 ( 0.212 13.109 3.055) 13.462 17.033 ( 1.069 -2.279 1.422) 2.891 17.033 ( 1.069 2.279 1.422) 2.891 18.055 ( 4.659 -2.727 4.673) 7.140 18.055 ( 4.659 2.727 4.673) 7.140 21.361 ( -0.430 -1.870 -0.083) 1.920 21.361 ( -0.430 1.870 -0.083) 1.920 27.721 ( -0.961 -1.413 -1.705) 2.414 27.721 ( -0.961 1.413 -1.705) 2.414 37.731 ( 3.618 -0.342 1.523) 3.941 37.731 ( 3.618 0.342 1.523) 3.941 38.107 ( -5.870 -10.834 -5.857) 13.643 38.107 ( -5.870 10.834 -5.857) 13.643 ======================= Grid point 508 (271/318) ======================= q-point: (-0.46 -0.50 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 312 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.278 ( -6.119 -12.462 -8.699) 16.383 2.278 ( -6.119 12.462 -8.699) 16.383 2.738 ( 6.141 -3.829 -9.021) 11.565 2.738 ( 6.141 3.829 -9.021) 11.565 3.970 ( 7.196 -1.001 -6.216) 9.561 3.970 ( 7.196 1.001 -6.216) 9.561 4.668 ( -1.985 -4.479 -0.807) 4.965 4.668 ( -1.985 4.479 -0.807) 4.965 5.328 ( -2.925 -5.293 0.319) 6.056 5.328 ( -2.925 5.293 0.319) 6.056 6.724 ( -4.325 -8.148 8.132) 12.298 6.724 ( -4.325 8.148 8.132) 12.298 7.682 ( 3.658 -9.967 -3.402) 11.149 7.682 ( 3.658 9.967 -3.402) 11.149 8.385 ( 2.261 -2.009 -0.710) 3.107 8.385 ( 2.261 2.009 -0.710) 3.107 10.150 ( 0.702 -13.851 2.075) 14.023 10.150 ( 0.702 13.851 2.075) 14.023 17.045 ( -0.635 -1.174 0.958) 1.643 17.045 ( -0.635 1.174 0.958) 1.643 18.113 ( -0.796 -2.142 2.525) 3.406 18.113 ( -0.796 2.142 2.525) 3.406 21.356 ( -0.101 -1.394 0.109) 1.402 21.356 ( -0.101 1.394 0.109) 1.402 27.700 ( -0.391 -0.685 -0.936) 1.224 27.700 ( -0.391 0.685 -0.936) 1.224 37.788 ( 1.466 -1.630 0.517) 2.252 37.788 ( 1.466 1.630 0.517) 2.252 38.029 ( 1.092 -8.837 -4.085) 9.797 38.029 ( 1.092 8.837 -4.085) 9.797 ======================= Grid point 510 (272/318) ======================= q-point: (-0.38 -0.50 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 312 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.280 ( 6.410 -13.697 5.555) 16.111 2.280 ( 6.410 13.697 5.555) 16.111 2.847 ( 10.412 -4.087 -6.108) 12.744 2.847 ( 10.412 4.087 -6.108) 12.744 4.109 ( 9.378 -3.309 -6.855) 12.078 4.109 ( 9.378 3.309 -6.855) 12.078 4.591 ( -3.204 -4.865 -3.056) 6.578 4.591 ( -3.204 4.865 -3.056) 6.578 5.319 ( 0.547 -6.642 5.573) 8.688 5.319 ( 0.547 6.642 5.573) 8.688 6.663 ( -6.996 -8.433 8.157) 13.660 6.663 ( -6.996 8.433 8.157) 13.660 7.766 ( 7.584 -10.042 -4.425) 13.340 7.766 ( 7.584 10.042 -4.425) 13.340 8.446 ( 4.641 -1.175 -0.964) 4.883 8.446 ( 4.641 1.175 -0.964) 4.883 10.174 ( 0.855 -14.819 1.252) 14.897 10.174 ( 0.855 14.819 1.252) 14.897 17.023 ( -2.080 -1.437 0.401) 2.560 17.023 ( -2.080 1.437 0.401) 2.560 18.055 ( -6.111 -2.725 -0.489) 6.709 18.055 ( -6.111 2.725 -0.489) 6.709 21.359 ( 0.226 -0.998 0.372) 1.089 21.359 ( 0.226 0.998 0.372) 1.089 27.697 ( 0.285 -0.304 0.089) 0.426 27.697 ( 0.285 0.304 0.089) 0.426 37.761 ( -4.320 -4.761 -0.733) 6.471 37.761 ( -4.320 4.761 -0.733) 6.471 38.127 ( 11.270 -3.509 -1.947) 11.963 38.127 ( 11.270 3.509 -1.947) 11.963 ======================= Grid point 512 (273/318) ======================= q-point: (-0.31 -0.50 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 312 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.482 ( 7.399 -12.322 8.979) 16.947 2.482 ( 7.399 12.322 8.979) 16.947 3.060 ( 13.543 -10.420 3.482) 17.439 3.060 ( 13.543 10.420 3.482) 17.439 4.106 ( -5.944 -2.130 -7.282) 9.638 4.106 ( -5.944 2.130 -7.282) 9.638 4.609 ( 8.433 -10.650 -7.428) 15.483 4.609 ( 8.433 10.650 -7.428) 15.483 5.439 ( 7.457 -8.762 11.454) 16.235 5.439 ( 7.457 8.762 11.454) 16.235 6.582 ( -6.160 -7.376 7.611) 12.259 6.582 ( -6.160 7.376 7.611) 12.259 7.899 ( 9.105 -8.907 -4.159) 13.399 7.899 ( 9.105 8.907 -4.159) 13.399 8.536 ( 5.551 -3.219 -1.142) 6.518 8.536 ( 5.551 3.219 -1.142) 6.518 10.195 ( 0.760 -14.974 0.703) 15.010 10.195 ( 0.760 14.974 0.703) 15.010 16.982 ( -2.112 -3.042 0.130) 3.705 16.982 ( -2.112 3.042 0.130) 3.705 17.885 ( -10.629 -3.613 -3.816) 11.857 17.885 ( -10.629 3.613 -3.816) 11.857 21.366 ( 0.200 -0.997 0.494) 1.131 21.366 ( 0.200 0.997 0.494) 1.131 27.711 ( 0.796 -1.165 1.036) 1.751 27.711 ( 0.796 1.165 1.036) 1.751 37.639 ( -7.569 -5.860 -1.756) 9.732 37.639 ( -7.569 5.860 -1.756) 9.732 38.396 ( 17.729 -0.733 0.041) 17.745 38.396 ( 17.729 0.733 0.041) 17.745 ======================= Grid point 514 (274/318) ======================= q-point: (-0.23 -0.50 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 312 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.593 ( 0.352 -8.477 4.632) 9.666 2.593 ( 0.352 8.477 4.632) 9.666 3.337 ( 8.013 -17.878 11.559) 22.747 3.337 ( 8.013 17.878 11.559) 22.747 3.908 ( -6.605 -3.318 -9.307) 11.885 3.908 ( -6.605 3.318 -9.307) 11.885 4.726 ( 7.538 -15.416 -7.053) 18.553 4.726 ( 7.538 15.416 -7.053) 18.553 5.706 ( 11.441 -6.470 13.052) 18.523 5.706 ( 11.441 6.470 13.052) 18.523 6.562 ( 0.795 -7.551 6.995) 10.324 6.562 ( 0.795 7.551 6.995) 10.324 8.037 ( 7.179 -8.085 -1.614) 10.932 8.037 ( 7.179 8.085 -1.614) 10.932 8.641 ( 6.748 -7.083 -1.216) 9.859 8.641 ( 6.748 7.083 -1.216) 9.859 10.210 ( 0.416 -12.644 0.257) 12.653 10.210 ( 0.416 12.644 0.257) 12.653 16.956 ( -0.560 -4.478 0.038) 4.513 16.956 ( -0.560 4.478 0.038) 4.513 17.626 ( -13.625 -3.889 -6.606) 15.633 17.626 ( -13.625 3.889 -6.606) 15.633 21.369 ( -0.214 -1.189 0.414) 1.277 21.369 ( -0.214 1.189 0.414) 1.277 27.736 ( 1.049 -1.931 1.653) 2.750 27.736 ( 1.049 1.931 1.653) 2.750 37.472 ( -8.815 -6.385 -2.360) 11.138 37.472 ( -8.815 6.385 -2.360) 11.138 38.760 ( 20.388 -1.444 1.536) 20.497 38.760 ( 20.388 1.444 1.536) 20.497 ======================= Grid point 516 (275/318) ======================= q-point: (-0.15 -0.50 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 312 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.578 ( -3.853 -5.660 4.106) 7.984 2.578 ( -3.853 5.660 4.106) 7.984 3.357 ( -9.662 -6.878 4.302) 12.616 3.357 ( -9.662 6.878 4.302) 12.616 3.865 ( 5.864 -12.098 -7.652) 15.469 3.865 ( 5.864 12.098 -7.652) 15.469 4.803 ( 3.934 -11.668 -1.142) 12.366 4.803 ( 3.934 11.668 -1.142) 12.366 5.922 ( 3.563 -5.159 8.970) 10.944 5.922 ( 3.563 5.159 8.970) 10.944 6.740 ( 13.185 -10.457 8.138) 18.693 6.740 ( 13.185 10.457 8.138) 18.693 8.137 ( 3.402 -6.429 2.451) 7.675 8.137 ( 3.402 6.429 2.451) 7.675 8.775 ( 8.356 -9.663 -1.298) 12.840 8.775 ( 8.356 9.663 -1.298) 12.840 10.209 ( -0.606 -6.905 -0.369) 6.941 10.209 ( -0.606 6.905 -0.369) 6.941 16.964 ( 1.474 -5.226 -0.540) 5.456 16.964 ( 1.474 5.226 -0.540) 5.456 17.322 ( -14.008 -3.225 -7.655) 16.286 17.322 ( -14.008 3.225 -7.655) 16.286 21.363 ( -0.635 -1.200 0.266) 1.383 21.363 ( -0.635 1.200 0.266) 1.383 27.767 ( 1.082 -2.127 1.830) 3.007 27.767 ( 1.082 2.127 1.830) 3.007 37.299 ( -7.999 -6.382 -2.438) 10.519 37.299 ( -7.999 6.382 -2.438) 10.519 39.141 ( 18.712 -3.812 2.131) 19.215 39.141 ( 18.712 3.812 2.131) 19.215 ======================= Grid point 518 (276/318) ======================= q-point: (-0.08 -0.50 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 312 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.528 ( -3.432 -4.049 4.107) 6.711 2.528 ( -3.432 4.050 4.107) 6.711 3.180 ( -9.014 -5.557 1.614) 10.712 3.180 ( -9.014 5.557 1.614) 10.712 3.896 ( 2.196 -12.975 -11.409) 17.416 3.896 ( 2.196 12.975 -11.409) 17.416 4.874 ( 2.590 -5.464 5.163) 7.951 4.874 ( 2.590 5.464 5.163) 7.951 5.975 ( -0.892 -8.593 5.048) 10.006 5.975 ( -0.892 8.593 5.048) 10.006 7.053 ( 12.197 -10.088 8.346) 17.894 7.053 ( 12.197 10.089 8.346) 17.894 8.208 ( 2.391 -3.760 5.303) 6.927 8.208 ( 2.391 3.760 5.303) 6.927 8.920 ( 7.783 -9.933 -1.706) 12.734 8.920 ( 7.783 9.933 -1.706) 12.734 10.177 ( -2.522 -4.799 -0.860) 5.490 10.177 ( -2.522 4.799 -0.860) 5.490 16.977 ( -2.120 -5.772 -4.880) 7.850 16.977 ( -2.120 5.772 -4.880) 7.850 17.065 ( -6.036 -0.856 -3.224) 6.897 17.065 ( -6.036 0.856 -3.224) 6.897 21.352 ( -0.619 -1.125 0.190) 1.298 21.352 ( -0.619 1.125 0.190) 1.298 27.796 ( 0.910 -1.534 1.583) 2.385 27.796 ( 0.910 1.534 1.583) 2.385 37.161 ( -5.128 -5.190 -1.995) 7.564 37.161 ( -5.128 5.190 -1.995) 7.564 39.448 ( 12.552 -6.171 1.511) 14.068 39.448 ( 12.552 6.171 1.511) 14.068 ======================= Grid point 572 (277/318) ======================= q-point: ( 0.00 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 162 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.396 ( -0.000 0.000 0.000) 0.000 1.411 ( -0.000 0.000 0.000) 0.000 1.689 ( -0.000 0.000 -0.000) 0.000 2.670 ( -0.000 0.000 0.000) 0.000 3.615 ( 0.000 0.000 0.000) 0.000 3.862 ( -0.000 0.000 -0.000) 0.000 3.964 ( 0.000 0.000 0.000) 0.000 3.979 ( -0.000 0.000 -0.000) 0.000 5.758 ( -0.000 0.000 0.000) 0.000 6.057 ( -0.000 0.000 0.000) 0.000 6.132 ( -0.000 0.000 0.000) 0.000 6.660 ( -0.000 0.000 0.000) 0.000 7.584 ( -0.000 0.000 0.000) 0.000 8.268 ( -0.000 0.000 -0.000) 0.000 8.444 ( -0.000 0.000 0.000) 0.000 8.919 ( -0.000 0.000 0.000) 0.000 8.989 ( 0.000 0.000 0.000) 0.000 11.184 ( -0.000 0.000 0.000) 0.000 16.843 ( 0.000 0.000 0.000) 0.000 16.914 ( -0.000 0.000 -0.000) 0.000 17.232 ( -0.000 0.000 0.000) 0.000 17.682 ( 0.000 0.000 0.000) 0.000 21.402 ( -0.000 0.000 0.000) 0.000 21.662 ( -0.000 0.000 0.000) 0.000 28.063 ( -0.000 0.000 0.000) 0.000 28.197 ( 0.000 0.000 0.000) 0.000 36.817 ( -0.000 0.000 0.000) 0.000 37.489 ( -0.000 0.000 0.000) 0.000 37.972 ( -0.000 0.000 0.000) 0.000 39.086 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 574 (278/318) ======================= q-point: ( 0.08 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 318 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.497 ( 12.275 0.000 -9.386) 15.452 1.661 ( 27.058 0.000 -4.617) 27.449 1.847 ( 13.450 0.000 5.773) 14.637 2.631 ( -3.887 0.000 0.986) 4.010 3.474 ( -21.063 0.000 -18.508) 28.039 3.611 ( 7.938 0.000 -23.538) 24.840 4.003 ( 11.342 0.000 7.429) 13.558 4.410 ( 16.436 0.000 14.822) 22.132 5.864 ( 9.097 0.000 4.335) 10.077 6.008 ( -4.696 0.000 -0.099) 4.697 6.117 ( -1.058 0.000 -1.586) 1.906 6.461 ( -19.763 0.000 -0.252) 19.765 7.576 ( -0.982 0.000 -0.808) 1.272 7.911 ( -23.640 0.000 -8.046) 24.972 8.428 ( -1.187 0.000 -2.060) 2.377 8.900 ( -2.781 0.000 2.441) 3.700 9.424 ( 27.680 0.000 17.650) 32.829 10.957 ( -19.677 0.000 -9.582) 21.887 16.768 ( -4.447 0.000 -4.047) 6.013 16.958 ( 1.299 0.000 3.714) 3.935 17.216 ( -0.964 0.000 -1.185) 1.528 17.755 ( 5.765 0.000 3.871) 6.944 21.376 ( -2.141 0.000 0.944) 2.340 21.738 ( 5.235 0.000 4.421) 6.852 28.039 ( -1.228 0.000 -1.273) 1.769 28.245 ( 3.781 0.000 0.684) 3.842 36.834 ( 1.997 0.000 -0.661) 2.104 37.486 ( -0.665 0.000 0.892) 1.113 37.757 ( -18.221 0.000 -3.415) 18.538 39.136 ( 9.540 0.000 -18.799) 21.081 ======================= Grid point 575 (279/318) ======================= q-point: ( 0.15 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 318 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.723 ( 17.500 0.000 -12.615) 21.572 2.181 ( 16.969 0.000 5.764) 17.921 2.195 ( 29.959 0.000 -9.759) 31.508 2.574 ( 0.156 0.000 -0.768) 0.783 3.028 ( -15.380 0.000 -10.823) 18.806 3.667 ( 12.683 0.000 -19.097) 22.925 4.313 ( 19.744 0.000 -3.413) 20.037 4.741 ( 11.245 0.000 8.919) 14.353 5.914 ( -4.453 0.000 0.528) 4.484 5.923 ( -21.550 0.000 -1.143) 21.581 6.078 ( -1.604 0.000 -2.726) 3.163 6.176 ( 4.622 0.000 7.935) 9.183 7.443 ( -21.158 0.000 -7.325) 22.390 7.516 ( -5.091 0.000 -2.445) 5.648 8.376 ( -3.323 0.000 -1.308) 3.571 8.846 ( -5.018 0.000 3.884) 6.346 9.940 ( 7.610 0.000 12.802) 14.893 10.517 ( -10.201 0.000 -8.576) 13.327 16.659 ( -4.613 0.000 -3.281) 5.661 16.983 ( -0.825 0.000 2.869) 2.986 17.199 ( -0.009 0.000 -0.275) 0.276 17.898 ( 5.315 0.000 6.549) 8.435 21.356 ( -0.839 0.000 1.810) 1.995 21.852 ( 2.586 0.000 6.018) 6.550 28.022 ( 0.426 0.000 -1.470) 1.530 28.313 ( 2.742 0.000 0.060) 2.743 36.882 ( 3.735 0.000 -1.402) 3.989 37.424 ( -10.584 0.000 -7.621) 13.042 37.475 ( -1.387 0.000 1.795) 2.269 39.169 ( 7.397 0.000 -24.165) 25.272 ======================= Grid point 576 (280/318) ======================= q-point: ( 0.23 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 318 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.936 ( 12.437 0.000 -10.432) 16.233 2.389 ( 8.824 0.000 -27.719) 29.090 2.484 ( 12.022 0.000 5.729) 13.317 2.810 ( 13.352 0.000 15.633) 20.559 2.884 ( 3.893 0.000 1.134) 4.055 3.884 ( 22.210 0.000 -15.860) 27.291 4.668 ( 22.616 0.000 -10.663) 25.004 4.917 ( 4.163 0.000 2.104) 4.665 5.430 ( -26.682 0.000 2.528) 26.802 5.884 ( 0.766 0.000 2.129) 2.263 6.033 ( -1.222 0.000 -3.213) 3.438 6.297 ( -2.049 0.000 -2.057) 2.904 7.104 ( -10.007 0.000 0.608) 10.025 7.341 ( -11.621 0.000 -4.985) 12.645 8.284 ( -6.502 0.000 0.172) 6.505 8.764 ( -6.198 0.000 4.032) 7.394 9.668 ( -19.635 0.000 -14.076) 24.159 10.732 ( 15.876 0.000 15.746) 22.360 16.567 ( -3.512 0.000 -1.784) 3.939 16.962 ( -2.822 0.000 1.586) 3.237 17.222 ( 2.238 0.000 1.725) 2.826 18.006 ( 1.560 0.000 7.875) 8.028 21.364 ( 0.381 0.000 2.230) 2.262 21.880 ( -2.790 0.000 3.641) 4.587 28.035 ( 1.733 0.000 -1.441) 2.254 28.336 ( 0.178 0.000 -1.347) 1.359 36.953 ( 4.984 0.000 -2.229) 5.460 37.341 ( 4.615 0.000 -2.157) 5.094 37.455 ( -2.174 0.000 2.678) 3.449 39.130 ( 3.857 0.000 -23.182) 23.501 ======================= Grid point 577 (281/318) ======================= q-point: ( 0.31 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 318 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.134 ( 13.438 0.000 4.036) 14.031 2.434 ( 14.433 0.000 -25.686) 29.464 2.750 ( 13.233 0.000 6.263) 14.640 3.022 ( -0.970 0.000 18.492) 18.518 3.057 ( 9.358 0.000 3.750) 10.081 4.247 ( 22.632 0.000 -14.811) 27.047 4.943 ( 0.144 0.000 -2.993) 2.997 4.960 ( 4.948 0.000 -7.978) 9.388 5.095 ( 0.596 0.000 3.895) 3.940 5.942 ( 1.666 0.000 1.604) 2.312 6.011 ( -19.237 0.000 -15.713) 24.839 6.011 ( 2.193 0.000 -1.877) 2.886 7.032 ( -17.216 0.000 -7.631) 18.831 7.098 ( 2.523 0.000 8.401) 8.771 8.140 ( -8.894 0.000 0.716) 8.923 8.671 ( -6.054 0.000 3.302) 6.896 9.300 ( -10.995 0.000 -12.264) 16.471 11.068 ( 10.014 0.000 14.292) 17.452 16.513 ( -1.673 0.000 -0.191) 1.684 16.902 ( -4.079 0.000 0.296) 4.090 17.301 ( 4.322 0.000 3.461) 5.537 18.051 ( -1.445 0.000 7.527) 7.664 21.392 ( 0.985 0.000 2.461) 2.651 21.805 ( -5.771 0.000 -0.164) 5.773 28.065 ( 2.286 0.000 -1.191) 2.578 28.310 ( -1.518 0.000 -2.371) 2.815 37.036 ( 5.561 0.000 -3.010) 6.323 37.426 ( -2.934 0.000 3.408) 4.497 37.519 ( 11.311 0.000 6.045) 12.825 39.051 ( 1.676 0.000 -19.741) 19.812 ======================= Grid point 578 (282/318) ======================= q-point: ( 0.38 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 318 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.479 ( 16.943 0.000 10.570) 19.970 2.559 ( 8.444 0.000 -16.893) 18.886 3.018 ( 10.720 0.000 4.647) 11.684 3.119 ( 5.479 0.000 16.978) 17.840 3.219 ( 5.507 0.000 5.504) 7.786 4.350 ( -4.770 0.000 -5.331) 7.154 4.928 ( 1.505 0.000 -4.550) 4.792 5.018 ( 10.203 0.000 0.595) 10.220 5.314 ( 10.603 0.000 -5.191) 11.806 5.548 ( -14.835 0.000 -17.549) 22.979 5.900 ( -4.938 0.000 -2.761) 5.657 6.108 ( 6.037 0.000 1.683) 6.267 6.657 ( -16.467 0.000 -7.987) 18.302 7.190 ( 2.019 0.000 5.428) 5.791 7.988 ( -7.254 0.000 0.498) 7.271 8.587 ( -4.511 0.000 2.150) 4.997 9.102 ( -5.098 0.000 -6.451) 8.222 11.271 ( 4.726 0.000 9.048) 10.208 16.502 ( 0.128 0.000 0.865) 0.874 16.823 ( -4.091 0.000 -0.624) 4.138 17.408 ( 4.479 0.000 3.512) 5.692 18.052 ( -2.337 0.000 5.448) 5.928 21.429 ( 1.427 0.000 2.712) 3.064 21.687 ( -5.580 0.000 -2.562) 6.140 28.101 ( 2.022 0.000 -0.674) 2.132 28.264 ( -1.676 0.000 -2.151) 2.727 37.118 ( 5.188 0.000 -3.354) 6.178 37.388 ( -3.336 0.000 3.622) 4.925 37.765 ( 9.243 0.000 8.627) 12.643 38.969 ( 0.581 0.000 -14.240) 14.252 ======================= Grid point 579 (283/318) ======================= q-point: ( 0.46 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 318 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.524 ( -1.845 0.000 -4.374) 4.747 2.786 ( 8.809 0.000 4.670) 9.970 3.136 ( 1.071 0.000 0.114) 1.078 3.354 ( 4.138 0.000 5.402) 6.805 3.449 ( 15.913 0.000 8.358) 17.975 4.151 ( -11.638 0.000 -1.423) 11.725 4.956 ( 2.836 0.000 -2.030) 3.488 5.016 ( -6.386 0.000 -7.122) 9.565 5.345 ( 5.089 0.000 -1.410) 5.281 5.511 ( 4.378 0.000 -3.137) 5.386 5.753 ( -6.520 0.000 -2.736) 7.071 6.228 ( 5.620 0.000 2.270) 6.061 6.386 ( -8.454 0.000 -4.469) 9.563 7.232 ( 0.482 0.000 1.550) 1.623 7.895 ( -2.724 0.000 0.207) 2.732 8.537 ( -1.691 0.000 0.751) 1.851 9.017 ( -1.624 0.000 -1.818) 2.438 11.361 ( 1.307 0.000 3.040) 3.309 16.517 ( 0.599 0.000 0.672) 0.900 16.758 ( -2.007 0.000 -0.552) 2.081 17.487 ( 1.973 0.000 1.485) 2.469 18.039 ( -1.145 0.000 1.988) 2.294 21.476 ( 1.739 0.000 2.433) 2.991 21.584 ( -3.329 0.000 -2.621) 4.238 28.127 ( 0.864 0.000 -0.155) 0.878 28.231 ( -0.738 0.000 -0.890) 1.156 37.179 ( 2.708 0.000 -1.986) 3.359 37.352 ( -2.042 0.000 2.080) 2.915 37.926 ( 3.377 0.000 4.069) 5.288 38.914 ( 0.106 0.000 -5.493) 5.494 ======================= Grid point 586 (284/318) ======================= q-point: ( 0.00 0.10 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 265 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.515 ( -0.000 11.607 0.000) 11.607 1.798 ( -0.000 29.635 0.000) 29.635 2.205 ( 0.000 40.359 0.000) 40.359 2.695 ( 0.000 2.888 0.000) 2.888 3.612 ( 0.000 1.983 0.000) 1.983 3.888 ( 0.000 -6.082 0.000) 6.082 3.979 ( -0.000 10.860 -0.000) 10.860 4.011 ( 0.000 3.043 0.000) 3.043 5.748 ( -0.000 -0.924 0.000) 0.924 6.213 ( 0.000 14.488 0.000) 14.488 6.351 ( -0.000 20.588 0.000) 20.588 6.653 ( -0.000 0.094 0.000) 0.094 7.587 ( -0.000 0.205 0.000) 0.205 8.285 ( -0.000 1.749 -0.000) 1.749 8.386 ( -0.000 -5.927 0.000) 5.927 8.750 ( 0.000 -4.305 0.000) 4.305 9.250 ( 0.000 14.140 0.000) 14.140 11.110 ( -0.000 -7.274 0.000) 7.274 16.872 ( 0.000 2.743 0.000) 2.743 16.917 ( -0.000 0.330 -0.000) 0.330 17.192 ( -0.000 -3.837 0.000) 3.837 17.596 ( 0.000 -8.381 0.000) 8.381 21.387 ( -0.000 -1.338 0.000) 1.338 21.623 ( -0.000 -3.680 0.000) 3.680 28.034 ( -0.000 -2.804 0.000) 2.804 28.156 ( -0.000 -3.866 0.000) 3.866 36.874 ( -0.000 5.017 -0.000) 5.017 37.489 ( -0.000 -1.491 -0.000) 1.491 38.110 ( -0.000 14.557 0.000) 14.557 39.141 ( 0.000 5.517 -0.000) 5.517 ======================= Grid point 588 (285/318) ======================= q-point: ( 0.08 0.10 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.722 ( 18.768 11.810 -3.348) 22.426 1.902 ( 13.571 25.103 -2.686) 28.663 2.263 ( 6.276 34.335 -0.522) 34.907 2.669 ( -2.904 4.597 0.356) 5.449 3.428 ( -15.878 -3.307 -15.983) 22.771 3.687 ( 5.715 6.710 -20.341) 22.169 4.066 ( 7.707 7.457 5.452) 12.030 4.394 ( 17.534 -1.072 13.732) 22.297 5.849 ( 8.893 -1.342 3.793) 9.761 6.143 ( -7.822 11.851 -0.188) 14.201 6.339 ( -1.639 19.547 -0.566) 19.623 6.503 ( -13.485 6.287 -1.332) 14.938 7.568 ( -2.270 -0.922 0.314) 2.471 7.933 ( -22.523 2.350 -8.724) 24.268 8.379 ( -1.443 -3.918 -0.012) 4.175 8.873 ( 2.765 -1.568 0.679) 3.250 9.517 ( 20.677 7.776 16.474) 27.557 10.890 ( -19.298 -6.537 -8.831) 22.207 16.798 ( -3.931 2.800 -4.278) 6.450 16.964 ( 1.404 0.635 3.639) 3.952 17.179 ( -0.692 -3.494 -1.001) 3.700 17.674 ( 6.111 -7.892 4.309) 10.872 21.367 ( -1.792 -0.866 1.006) 2.230 21.687 ( 4.671 -4.726 3.189) 7.370 28.006 ( -1.472 -3.087 -1.257) 3.644 28.202 ( 3.593 -4.087 0.281) 5.449 36.892 ( 2.035 4.915 0.086) 5.320 37.475 ( -2.066 -1.243 1.482) 2.830 37.949 ( -14.169 18.375 -1.962) 23.286 39.159 ( 6.577 2.610 -17.606) 18.975 ======================= Grid point 589 (286/318) ======================= q-point: ( 0.15 0.10 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.973 ( 12.970 18.990 -9.704) 24.960 2.273 ( 18.657 9.275 -5.031) 21.434 2.433 ( 15.554 20.521 -1.430) 25.789 2.611 ( -0.697 3.895 -2.286) 4.570 3.088 ( -10.636 5.629 -6.037) 13.463 3.744 ( 12.575 7.699 -18.714) 23.825 4.297 ( 15.152 -0.633 -1.697) 15.260 4.747 ( 13.308 0.924 7.179) 15.149 5.870 ( -21.952 1.118 -0.205) 21.981 6.052 ( 6.621 1.426 2.863) 7.353 6.238 ( -3.923 14.173 0.974) 14.738 6.357 ( -1.365 23.336 0.094) 23.376 7.450 ( -16.451 0.022 -6.643) 17.741 7.525 ( -10.223 1.531 -1.181) 10.404 8.334 ( -3.086 -3.326 -1.495) 4.777 8.859 ( -3.632 0.894 1.621) 4.077 9.951 ( 4.849 1.266 12.623) 13.581 10.457 ( -10.301 -5.785 -7.504) 13.996 16.701 ( -3.770 3.926 -3.331) 6.382 16.997 ( 0.028 1.341 2.668) 2.986 17.170 ( 0.261 -2.721 0.021) 2.733 17.828 ( 5.933 -6.808 6.927) 11.381 21.351 ( -0.682 -0.424 1.760) 1.935 21.787 ( 2.682 -6.063 4.368) 7.940 27.986 ( 0.252 -3.463 -1.417) 3.750 28.262 ( 2.551 -4.765 -0.605) 5.438 36.960 ( 5.038 5.891 1.741) 7.945 37.422 ( -4.096 1.817 -0.137) 4.483 37.686 ( -9.682 18.902 -4.131) 21.636 39.149 ( 5.213 -1.617 -23.296) 23.927 ======================= Grid point 590 (287/318) ======================= q-point: ( 0.23 0.10 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.084 ( 5.889 13.331 -13.019) 19.542 2.352 ( 6.167 1.516 -17.587) 18.698 2.677 ( 10.464 11.403 0.823) 15.499 2.822 ( 12.184 3.086 10.237) 16.210 3.022 ( 3.781 11.529 3.965) 12.764 3.944 ( 19.964 5.868 -14.944) 25.618 4.581 ( 17.584 -6.649 -7.178) 20.123 4.956 ( 7.064 2.624 -0.614) 7.561 5.427 ( -23.557 0.672 2.386) 23.687 6.062 ( -2.102 11.286 -0.517) 11.491 6.265 ( 1.598 17.466 -3.496) 17.884 6.353 ( -2.256 14.006 0.375) 14.192 7.116 ( -11.017 1.681 -1.144) 11.203 7.347 ( -11.318 0.194 -1.519) 11.421 8.240 ( -6.515 -3.360 -0.806) 7.375 8.780 ( -5.691 0.896 1.757) 6.023 9.650 ( -20.164 -1.318 -12.469) 23.745 10.664 ( 14.657 -6.323 15.283) 22.100 16.627 ( -2.454 5.589 -1.767) 6.355 16.997 ( -1.387 3.330 1.622) 3.955 17.198 ( 2.305 -2.167 1.865) 3.672 17.952 ( 2.390 -5.287 8.072) 9.941 21.361 ( 0.377 -0.362 2.117) 2.181 21.816 ( -1.878 -5.979 2.508) 6.750 27.997 ( 1.683 -3.653 -1.306) 4.229 28.281 ( 0.277 -5.213 -1.879) 5.548 37.094 ( 6.179 10.741 4.631) 13.228 37.366 ( 1.593 3.592 -3.766) 5.443 37.558 ( -4.146 10.873 0.780) 11.663 39.083 ( 2.611 -4.434 -22.598) 23.177 ======================= Grid point 591 (288/318) ======================= q-point: ( 0.31 0.10 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.127 ( 8.267 0.472 -6.301) 10.405 2.437 ( 13.240 1.651 -15.202) 20.227 2.923 ( 12.594 12.914 6.516) 19.179 2.992 ( 1.248 -0.831 12.033) 12.127 3.146 ( 3.453 7.017 5.764) 9.715 4.269 ( 20.874 2.117 -13.541) 24.971 4.776 ( 3.657 -6.893 -4.880) 9.203 5.042 ( 3.826 -4.486 1.342) 6.047 5.145 ( -2.076 7.584 -3.137) 8.465 5.900 ( -15.383 -2.558 -11.989) 19.670 6.235 ( -2.359 20.457 -4.680) 21.118 6.279 ( 0.548 24.558 -0.439) 24.568 7.021 ( -8.286 0.016 -3.492) 8.992 7.136 ( -5.284 2.866 7.195) 9.376 8.082 ( -9.602 -4.679 -0.786) 10.710 8.675 ( -6.241 -0.545 0.826) 6.319 9.297 ( -10.173 0.547 -9.756) 14.105 10.977 ( 9.270 -8.577 13.452) 18.451 16.592 ( -0.710 7.393 -0.255) 7.431 16.967 ( -2.490 6.149 0.665) 6.667 17.276 ( 4.267 -2.113 3.355) 5.825 18.013 ( -0.697 -3.691 7.588) 8.467 21.386 ( 0.895 -0.539 2.319) 2.543 21.756 ( -4.682 -4.624 -0.547) 6.603 28.028 ( 2.251 -3.683 -1.016) 4.434 28.256 ( -1.290 -5.174 -2.626) 5.945 37.183 ( 2.435 13.494 -0.528) 13.722 37.456 ( 2.250 1.642 1.616) 3.221 37.544 ( 4.894 4.103 6.531) 9.135 38.990 ( 1.060 -5.918 -19.274) 20.190 ======================= Grid point 592 (289/318) ======================= q-point: ( 0.38 0.10 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.336 ( 13.774 -8.866 -1.076) 16.417 2.612 ( 11.048 1.582 -6.580) 12.956 3.041 ( -0.380 -0.730 11.046) 11.076 3.127 ( 3.154 -0.205 5.567) 6.402 3.311 ( 12.436 10.960 7.679) 18.269 4.357 ( -5.890 1.057 -5.862) 8.377 4.851 ( 10.307 -4.563 -1.640) 11.391 5.063 ( -1.819 -0.603 0.792) 2.073 5.286 ( 12.851 -3.365 -8.168) 15.595 5.479 ( -14.809 -2.671 -15.120) 21.332 6.118 ( -7.865 17.943 -5.530) 20.357 6.347 ( 4.846 22.902 1.023) 23.432 6.758 ( -11.853 10.600 -4.680) 16.576 7.192 ( 1.533 0.230 6.974) 7.145 7.905 ( -8.074 -7.356 -1.245) 10.993 8.569 ( -5.220 -2.591 0.234) 5.832 9.137 ( -3.617 4.056 -4.320) 6.942 11.167 ( 4.473 -9.902 8.437) 13.756 16.594 ( 0.643 8.682 0.624) 8.728 16.918 ( -2.732 9.028 -0.071) 9.433 17.381 ( 4.446 -2.280 3.326) 6.002 18.025 ( -1.893 -2.533 5.437) 6.289 21.420 ( 1.257 -0.867 2.539) 2.963 21.656 ( -4.748 -3.033 -2.515) 6.170 28.063 ( 1.971 -3.708 -0.517) 4.230 28.213 ( -1.527 -4.991 -2.281) 5.696 37.217 ( 2.769 9.407 -3.014) 10.259 37.433 ( -3.262 4.387 3.236) 6.353 37.756 ( 8.569 -0.751 8.718) 12.248 38.903 ( 0.341 -6.481 -13.858) 15.302 ======================= Grid point 593 (290/318) ======================= q-point: ( 0.46 0.10 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.458 ( 0.998 -6.272 -2.536) 6.839 2.779 ( 6.857 -1.089 2.135) 7.264 3.097 ( -0.082 -3.982 0.754) 4.054 3.262 ( 7.583 -6.392 7.430) 12.392 3.586 ( 10.833 10.179 5.188) 15.744 4.119 ( -13.625 -2.692 -3.547) 14.334 4.906 ( -6.180 -9.340 -6.569) 12.984 5.032 ( 6.095 6.279 1.271) 8.842 5.342 ( 1.572 0.313 -3.304) 3.672 5.425 ( 4.400 -8.158 -2.804) 9.684 5.918 ( -7.294 13.928 -3.775) 16.169 6.443 ( 4.369 20.523 0.830) 20.999 6.579 ( -5.641 19.143 -1.773) 20.036 7.239 ( 0.508 0.873 2.338) 2.547 7.793 ( -3.024 -9.527 -0.645) 10.016 8.499 ( -2.129 -3.969 0.075) 4.504 9.083 ( -0.890 6.538 -1.053) 6.682 11.251 ( 1.271 -10.402 2.825) 10.854 16.612 ( 0.629 9.073 0.454) 9.107 16.876 ( -1.350 11.077 -0.208) 11.161 17.460 ( 1.976 -2.370 1.400) 3.388 18.017 ( -1.015 -2.008 1.973) 2.993 21.462 ( 1.419 -1.425 2.160) 2.951 21.566 ( -2.787 -1.749 -2.360) 4.050 28.089 ( 0.856 -3.700 -0.067) 3.798 28.181 ( -0.712 -4.938 -0.962) 5.081 37.247 ( 1.665 6.514 -1.851) 6.974 37.398 ( -1.832 4.526 1.898) 5.238 37.909 ( 3.165 -1.629 4.010) 5.362 38.848 ( 0.051 -6.579 -5.328) 8.466 ======================= Grid point 600 (291/318) ======================= q-point: ( 0.00 0.20 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 266 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.809 ( -0.000 16.860 0.000) 16.860 2.275 ( -0.000 15.685 0.000) 15.685 2.809 ( -0.000 9.186 -0.000) 9.186 2.838 ( 0.000 17.911 0.000) 17.911 3.724 ( -0.000 -9.316 0.000) 9.316 3.844 ( 0.000 22.792 0.000) 22.792 4.085 ( 0.000 4.365 0.000) 4.365 4.302 ( -0.000 20.082 0.000) 20.082 5.730 ( -0.000 -0.439 0.000) 0.439 6.543 ( -0.000 -3.672 0.000) 3.672 6.554 ( 0.000 18.164 -0.000) 18.164 6.997 ( -0.000 34.687 0.000) 34.687 7.584 ( -0.000 -0.689 0.000) 0.689 8.268 ( 0.000 -3.965 0.000) 3.965 8.340 ( 0.000 3.979 0.000) 3.979 8.773 ( -0.000 5.469 -0.000) 5.469 9.497 ( 0.000 10.870 0.000) 10.870 10.913 ( -0.000 -12.151 0.000) 12.151 16.928 ( 0.000 0.755 0.000) 0.755 16.938 ( -0.000 3.427 -0.000) 3.427 17.091 ( -0.000 -6.085 0.000) 6.085 17.376 ( 0.000 -12.960 0.000) 12.960 21.358 ( -0.000 -1.466 0.000) 1.466 21.535 ( -0.000 -4.757 0.000) 4.757 27.964 ( -0.000 -3.977 0.000) 3.977 28.060 ( -0.000 -5.522 0.000) 5.522 36.975 ( -0.000 4.292 -0.000) 4.292 37.409 ( -0.000 -6.071 0.000) 6.071 38.515 ( -0.000 24.397 -0.000) 24.397 39.296 ( 0.000 9.682 -0.000) 9.682 ======================= Grid point 602 (292/318) ======================= q-point: ( 0.08 0.20 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 522 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.987 ( 17.275 14.670 -0.078) 22.663 2.321 ( 4.134 14.322 2.131) 15.058 2.727 ( -0.388 11.108 -7.061) 13.168 2.952 ( 4.538 19.336 -0.474) 19.867 3.387 ( -16.440 -0.240 -10.152) 19.323 3.893 ( 5.130 14.942 -11.368) 19.463 4.262 ( 1.208 7.585 6.187) 9.863 4.440 ( 18.220 9.995 4.997) 21.374 5.818 ( 7.907 -1.462 2.901) 8.548 6.354 ( -17.111 5.975 -0.227) 18.126 6.568 ( -0.661 9.647 -1.475) 9.782 6.990 ( -0.094 35.487 -1.490) 35.518 7.534 ( -5.817 -2.562 2.612) 6.872 8.015 ( -17.134 6.560 -10.564) 21.171 8.327 ( -1.513 -0.392 1.573) 2.218 8.872 ( 4.466 1.751 -1.458) 5.014 9.679 ( 13.434 8.036 14.385) 21.260 10.716 ( -17.865 -10.518 -6.786) 21.814 16.862 ( -2.701 3.178 -4.476) 6.118 16.985 ( 1.600 1.495 3.221) 3.895 17.089 ( 0.276 -5.185 -0.239) 5.198 17.466 ( 6.899 -12.409 5.148) 15.102 21.347 ( -1.041 -0.958 1.009) 1.738 21.576 ( 3.369 -5.908 1.140) 6.896 27.931 ( -1.926 -4.153 -1.143) 4.719 28.099 ( 3.077 -5.925 -0.348) 6.686 36.984 ( 1.421 3.630 0.029) 3.898 37.431 ( 1.166 -3.398 2.845) 4.583 38.410 ( -10.768 26.099 0.262) 28.235 39.251 ( -0.260 6.718 -13.973) 15.507 ======================= Grid point 603 (293/318) ======================= q-point: ( 0.15 0.20 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 522 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.302 ( 12.585 13.608 -4.517) 19.078 2.464 ( 9.893 7.997 4.201) 13.396 2.742 ( 5.291 11.060 -10.142) 15.912 2.860 ( -5.182 18.236 -10.485) 21.665 3.221 ( -0.809 7.147 3.625) 8.055 3.955 ( 10.283 12.683 -13.949) 21.474 4.305 ( 3.334 0.937 0.935) 3.587 4.801 ( 15.631 5.077 3.028) 16.711 5.934 ( -23.857 3.895 0.199) 24.173 6.019 ( 8.188 -1.659 1.080) 8.424 6.542 ( -0.735 12.286 -0.360) 12.313 6.979 ( -0.378 36.029 -1.116) 36.048 7.400 ( -10.531 -5.248 1.041) 11.812 7.642 ( -16.489 11.936 -4.845) 20.924 8.291 ( -1.843 -0.323 -3.800) 4.236 8.872 ( -2.569 0.503 -1.714) 3.129 9.995 ( -0.467 3.191 11.777) 12.210 10.312 ( -9.337 -8.074 -4.546) 13.155 16.792 ( -2.026 4.548 -3.350) 6.000 17.034 ( 1.922 2.331 1.670) 3.452 17.107 ( 1.460 -3.004 1.712) 3.754 17.647 ( 7.593 -10.952 7.594) 15.339 21.341 ( -0.337 -0.462 1.547) 1.649 21.645 ( 2.540 -7.530 1.587) 8.104 27.902 ( -0.287 -4.601 -1.283) 4.785 28.143 ( 1.987 -6.832 -1.523) 7.277 37.050 ( 5.549 3.002 2.303) 6.716 37.472 ( 0.747 2.010 4.061) 4.593 38.161 ( -14.210 26.896 -1.883) 30.478 39.132 ( -1.219 0.627 -20.334) 20.380 ======================= Grid point 604 (294/318) ======================= q-point: ( 0.23 0.20 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 522 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.396 ( 2.635 14.934 -9.937) 18.130 2.456 ( -4.055 10.383 -20.428) 23.272 2.756 ( 6.596 -0.234 10.309) 12.241 3.035 ( 14.193 14.451 -0.148) 20.256 3.249 ( 0.437 10.345 5.794) 11.865 4.097 ( 12.942 8.944 -11.280) 19.358 4.441 ( 12.517 -7.909 -3.620) 15.243 5.013 ( 5.996 3.710 -2.066) 7.347 5.474 ( -22.118 3.814 0.016) 22.444 6.105 ( -2.095 -3.142 -5.709) 6.845 6.568 ( 3.619 11.285 0.939) 11.888 6.947 ( -3.236 35.551 -0.185) 35.698 7.185 ( -8.863 1.935 -1.432) 9.184 7.373 ( -12.781 8.065 1.962) 15.240 8.204 ( -5.478 0.742 -3.844) 6.733 8.774 ( -6.450 -1.744 -2.819) 7.252 9.649 ( -19.592 1.958 -7.746) 21.159 10.517 ( 11.738 -7.647 13.955) 19.774 16.756 ( -0.220 6.385 -1.627) 6.593 17.070 ( 1.496 2.613 0.131) 3.014 17.169 ( 3.212 1.064 4.052) 5.279 17.813 ( 4.857 -8.265 8.392) 12.740 21.352 ( 0.334 -0.457 1.774) 1.862 21.673 ( -0.336 -7.719 0.576) 7.748 27.905 ( 1.270 -5.215 -1.071) 5.473 28.151 ( 0.166 -7.517 -2.620) 7.962 37.220 ( 9.631 2.393 6.203) 11.703 37.497 ( -0.501 7.170 3.018) 7.795 37.902 ( -11.745 22.477 -2.218) 25.457 38.980 ( -1.678 -5.066 -20.724) 21.400 ======================= Grid point 605 (295/318) ======================= q-point: ( 0.31 0.20 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 522 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.207 ( -1.510 8.301 -18.822) 20.626 2.497 ( 8.270 3.926 -7.581) 11.886 2.929 ( 2.737 -3.179 12.412) 13.102 3.156 ( -2.381 5.943 3.339) 7.220 3.357 ( 8.401 14.768 5.039) 17.722 4.318 ( 16.790 2.150 -9.789) 19.553 4.669 ( 11.046 -5.364 -5.053) 13.278 4.961 ( -7.663 -1.268 2.153) 8.060 5.219 ( -4.776 -0.931 -4.264) 6.469 5.855 ( -15.375 -1.528 -14.881) 21.452 6.616 ( -0.617 11.311 -5.309) 12.510 6.890 ( -1.814 31.701 2.752) 31.872 7.102 ( -2.090 8.542 -0.463) 8.806 7.197 ( -7.034 7.473 8.271) 13.181 8.027 ( -11.049 1.272 -4.156) 11.873 8.615 ( -7.722 -5.550 -3.735) 10.217 9.362 ( -7.570 6.640 -4.142) 10.888 10.770 ( 7.233 -11.295 11.310) 17.545 16.763 ( 1.470 8.664 -0.094) 8.788 17.095 ( 1.113 3.964 0.039) 4.117 17.266 ( 4.288 3.890 4.481) 7.322 17.921 ( 1.667 -5.059 7.608) 9.287 21.372 ( 0.625 -0.816 1.905) 2.164 21.642 ( -2.538 -6.370 -1.140) 6.951 27.930 ( 1.915 -5.772 -0.691) 6.120 28.123 ( -1.105 -7.775 -3.049) 8.424 37.445 ( 7.281 3.955 9.651) 12.720 37.489 ( 0.319 8.469 -2.594) 8.863 37.724 ( -6.626 14.041 2.402) 15.710 38.837 ( -1.225 -8.908 -17.972) 20.096 ======================= Grid point 606 (296/318) ======================= q-point: ( 0.38 0.20 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 522 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.201 ( 8.308 -3.946 -8.230) 12.341 2.620 ( 8.290 -0.315 -4.250) 9.321 2.986 ( -2.634 -4.315 10.815) 11.938 3.084 ( -4.288 -3.667 1.108) 5.750 3.583 ( 10.987 13.757 6.054) 18.618 4.406 ( -8.104 4.068 -7.525) 11.783 4.751 ( 7.223 -6.856 -2.071) 10.171 4.983 ( -0.055 -5.748 3.131) 6.545 5.123 ( 2.917 -10.785 -8.506) 14.042 5.530 ( -7.467 5.212 -12.374) 15.364 6.441 ( -11.261 12.015 -8.675) 18.613 6.911 ( 1.621 29.352 1.056) 29.416 7.082 ( -0.149 18.930 2.088) 19.045 7.211 ( 0.597 4.267 9.329) 10.276 7.777 ( -11.571 -2.088 -5.766) 13.096 8.470 ( -5.891 -7.125 -1.930) 9.444 9.276 ( -1.311 10.016 -1.216) 10.175 10.921 ( 3.547 -13.797 6.911) 15.833 16.800 ( 2.048 10.758 0.594) 10.968 17.109 ( 0.324 6.517 0.128) 6.526 17.372 ( 4.300 4.676 3.552) 7.278 17.969 ( -0.412 -2.518 5.291) 5.875 21.397 ( 0.794 -1.422 2.030) 2.603 21.578 ( -2.945 -4.475 -2.257) 5.813 27.962 ( 1.703 -6.206 -0.169) 6.437 28.082 ( -1.371 -7.826 -2.590) 8.356 37.445 ( -1.378 12.165 -2.570) 12.509 37.543 ( -1.914 5.963 2.520) 6.750 37.752 ( 4.782 1.187 8.817) 10.101 38.728 ( -0.546 -10.674 -12.853) 16.716 ======================= Grid point 607 (297/318) ======================= q-point: ( 0.46 0.20 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 522 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.300 ( 3.142 -8.962 -1.793) 9.665 2.737 ( 4.791 -3.061 -0.363) 5.697 2.984 ( -2.200 -7.129 1.638) 7.638 3.110 ( 5.332 -9.271 5.166) 11.877 3.787 ( 7.839 8.570 3.745) 12.203 4.073 ( -17.469 -1.380 -7.015) 18.876 4.711 ( -3.376 -9.031 -4.648) 10.703 5.137 ( 11.724 3.238 7.584) 14.334 5.212 ( 4.408 -12.642 -1.385) 13.460 5.375 ( -6.032 2.968 -8.666) 10.968 6.210 ( -6.818 14.385 -4.084) 16.435 6.946 ( 1.708 25.923 -0.488) 25.984 7.085 ( -0.874 28.820 1.110) 28.855 7.292 ( 2.023 6.140 6.291) 9.020 7.574 ( -5.675 -9.772 -4.846) 12.296 8.383 ( -2.396 -7.408 -0.452) 7.799 9.265 ( 0.018 11.588 -0.197) 11.590 10.990 ( 1.035 -14.975 2.293) 15.185 16.834 ( 1.009 11.943 0.347) 11.990 17.111 ( -0.082 8.492 0.050) 8.493 17.450 ( 1.967 4.739 1.383) 5.314 17.978 ( -0.566 -1.276 1.885) 2.345 21.424 ( 0.723 -2.283 1.469) 2.810 21.520 ( -1.626 -2.807 -1.693) 3.659 27.987 ( 0.828 -6.352 0.212) 6.409 28.049 ( -0.744 -7.954 -1.222) 8.081 37.415 ( -0.357 9.821 -1.679) 9.970 37.516 ( -1.462 6.867 1.546) 7.189 37.869 ( 2.416 -2.076 3.862) 5.006 38.668 ( -0.137 -11.098 -4.892) 12.129 ======================= Grid point 614 (298/318) ======================= q-point: ( 0.00 0.30 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 265 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.139 ( -0.000 15.752 0.000) 15.752 2.463 ( -0.000 5.923 0.000) 5.923 3.014 ( 0.000 4.378 0.000) 4.378 3.019 ( -0.000 10.209 -0.000) 10.209 3.554 ( -0.000 -7.025 0.000) 7.025 4.056 ( -0.000 -2.629 -0.000) 2.629 4.425 ( 0.000 25.544 0.000) 25.544 4.695 ( -0.000 18.078 0.000) 18.078 5.751 ( -0.000 2.957 0.000) 2.957 6.417 ( 0.000 -8.401 0.000) 8.401 6.877 ( -0.000 13.827 0.000) 13.827 7.521 ( -0.000 -1.265 0.000) 1.265 7.730 ( -0.000 31.132 0.000) 31.132 8.262 ( 0.000 2.942 0.000) 2.942 8.456 ( 0.000 8.496 -0.000) 8.496 8.922 ( -0.000 8.326 0.000) 8.326 9.691 ( 0.000 9.296 0.000) 9.296 10.649 ( -0.000 -14.149 0.000) 14.149 16.922 ( -0.000 -3.522 0.000) 3.522 16.979 ( -0.000 -0.895 0.000) 0.895 16.991 ( 0.000 -1.413 -0.000) 1.413 17.133 ( 0.000 -9.342 0.000) 9.342 21.336 ( -0.000 -0.697 0.000) 0.697 21.448 ( -0.000 -3.870 0.000) 3.870 27.888 ( -0.000 -3.403 0.000) 3.403 27.952 ( -0.000 -5.038 0.000) 5.038 37.031 ( -0.000 1.536 -0.000) 1.536 37.276 ( -0.000 -6.833 0.000) 6.833 38.999 ( -0.000 23.100 0.000) 23.100 39.492 ( 0.000 9.154 -0.000) 9.154 ======================= Grid point 616 (299/318) ======================= q-point: ( 0.08 0.30 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.266 ( 11.880 12.872 1.709) 17.600 2.504 ( 3.542 6.249 1.368) 7.312 2.939 ( 1.529 10.044 -8.887) 13.498 3.169 ( 8.595 5.703 2.150) 10.537 3.398 ( -11.896 0.791 -3.125) 12.325 4.092 ( 0.122 -1.053 4.195) 4.327 4.461 ( 1.081 17.603 -2.302) 17.786 4.737 ( 7.566 15.503 -2.309) 17.405 5.811 ( 5.628 1.283 1.380) 5.935 6.363 ( -6.968 -3.975 -1.288) 8.125 6.773 ( -8.825 9.824 -0.939) 13.239 7.438 ( -8.507 -4.133 0.708) 9.485 7.707 ( -2.644 30.506 1.158) 30.642 8.207 ( -2.842 12.243 -13.480) 18.431 8.374 ( -5.599 5.486 1.769) 8.036 8.938 ( 0.390 4.495 -1.931) 4.908 9.830 ( 9.800 7.420 11.616) 16.912 10.496 ( -14.408 -11.187 -3.849) 18.643 16.897 ( -1.591 -0.513 -2.345) 2.879 16.991 ( 1.683 -2.710 2.292) 3.929 17.027 ( 2.596 1.189 0.426) 2.887 17.221 ( 7.233 -11.178 4.751) 14.136 21.333 ( -0.349 -0.388 0.780) 0.939 21.470 ( 2.048 -4.624 0.043) 5.057 27.856 ( -2.041 -3.154 -0.948) 3.875 27.981 ( 2.182 -5.735 -0.711) 6.177 37.032 ( 1.152 1.620 -0.356) 2.020 37.340 ( 4.956 -5.581 3.236) 8.135 38.909 ( -9.544 23.165 0.171) 25.054 39.404 ( -6.166 7.843 -9.041) 13.464 ======================= Grid point 617 (300/318) ======================= q-point: ( 0.15 0.30 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.509 ( 10.782 7.385 -1.626) 13.169 2.584 ( 3.866 4.977 2.771) 6.885 3.009 ( 11.087 14.433 -8.938) 20.276 3.135 ( -8.708 10.888 -7.303) 15.739 3.355 ( 5.360 6.150 5.877) 10.054 4.113 ( 1.982 -1.795 2.145) 3.428 4.386 ( -4.980 10.912 -5.994) 13.409 4.932 ( 11.906 6.814 -1.739) 13.828 5.925 ( 0.650 -1.879 0.652) 2.092 6.098 ( -14.940 6.469 -4.642) 16.929 6.650 ( -3.245 -0.094 0.090) 3.248 7.243 ( -12.490 -9.167 1.802) 15.597 7.646 ( -4.394 27.139 0.078) 27.493 8.018 ( -9.542 24.934 -6.419) 27.459 8.314 ( -0.244 1.895 -6.514) 6.789 8.884 ( -4.660 0.703 -3.185) 5.688 10.071 ( -6.874 3.924 7.823) 11.129 10.174 ( -2.385 -4.830 1.197) 5.518 16.854 ( -1.033 1.505 -2.273) 2.916 17.051 ( 1.658 -1.260 1.420) 2.521 17.102 ( 5.899 2.856 3.163) 7.277 17.426 ( 10.093 -10.546 7.353) 16.345 21.336 ( -0.001 -0.072 1.124) 1.126 21.510 ( 1.928 -5.829 0.041) 6.139 27.821 ( -0.917 -3.258 -1.180) 3.584 28.006 ( 1.115 -6.812 -1.872) 7.152 37.096 ( 5.620 2.146 1.591) 6.222 37.464 ( 5.312 -3.047 4.694) 7.716 38.665 ( -15.934 22.742 -0.492) 27.773 39.182 ( -9.317 3.966 -14.933) 18.043 ======================= Grid point 618 (301/318) ======================= q-point: ( 0.23 0.30 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.558 ( 2.065 5.939 -9.489) 11.383 2.738 ( 5.948 -0.673 7.174) 9.343 2.818 ( -11.277 19.874 -17.528) 28.799 3.298 ( 9.656 11.575 1.233) 15.124 3.437 ( 2.838 9.422 6.883) 12.008 4.248 ( 10.461 -10.993 0.644) 15.189 4.272 ( 0.297 7.773 -7.482) 10.793 5.089 ( 5.691 1.942 -3.129) 6.779 5.563 ( -25.324 5.573 -4.445) 26.308 6.043 ( -1.270 -1.949 -7.543) 7.893 6.626 ( 0.388 -3.068 0.453) 3.126 7.052 ( -8.690 -11.374 5.141) 15.209 7.546 ( -5.731 22.233 -1.496) 23.008 7.810 ( -9.480 28.852 -2.506) 30.473 8.268 ( -1.312 4.832 -5.796) 7.659 8.725 ( -9.913 -2.397 -4.765) 11.257 9.744 ( -14.646 7.813 -2.726) 16.822 10.391 ( 7.997 -4.806 11.484) 14.796 16.845 ( 1.180 2.464 -0.907) 2.878 17.078 ( 1.284 -0.745 -0.204) 1.498 17.262 ( 7.852 6.504 5.599) 11.632 17.654 ( 9.000 -7.055 8.139) 14.036 21.345 ( 0.237 -0.152 1.229) 1.261 21.532 ( 0.459 -6.227 -0.460) 6.261 27.809 ( 0.353 -4.031 -1.045) 4.179 27.999 ( -0.314 -7.550 -2.816) 8.064 37.254 ( 9.218 1.871 3.863) 10.168 37.577 ( 3.250 0.399 5.472) 6.377 38.345 ( -17.214 20.493 -1.260) 26.793 38.911 ( -9.075 -1.611 -16.791) 19.154 ======================= Grid point 619 (302/318) ======================= q-point: ( 0.31 0.30 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.431 ( -7.678 12.206 -24.828) 28.712 2.592 ( 0.010 6.233 -4.272) 7.557 2.868 ( 1.785 -2.167 6.907) 7.456 3.227 ( -12.362 2.446 3.584) 13.101 3.642 ( 8.978 12.984 5.109) 16.592 4.324 ( 11.602 -2.114 -6.107) 13.281 4.515 ( 14.897 -9.286 -0.791) 17.572 5.065 ( -23.624 6.067 -3.651) 24.662 5.101 ( -3.543 -5.378 -4.387) 7.792 5.847 ( -10.132 0.154 -13.676) 17.021 6.660 ( 1.871 -2.780 -2.855) 4.402 6.990 ( -3.416 -9.160 10.582) 14.407 7.435 ( -4.137 16.993 -3.535) 17.843 7.662 ( -5.159 27.965 0.072) 28.437 8.169 ( -7.552 11.449 -2.826) 14.003 8.493 ( -10.380 -5.164 -4.765) 12.535 9.561 ( -4.663 13.285 -0.634) 14.093 10.563 ( 4.263 -9.292 8.451) 13.264 16.886 ( 3.200 3.313 0.762) 4.669 17.101 ( 1.511 -1.297 -0.692) 2.109 17.441 ( 7.574 11.065 5.724) 14.580 17.840 ( 5.917 -2.575 7.132) 9.618 21.357 ( 0.234 -0.599 1.263) 1.417 21.522 ( -0.937 -5.548 -1.259) 5.766 27.818 ( 0.997 -5.155 -0.667) 5.293 27.965 ( -1.257 -7.874 -3.143) 8.571 37.458 ( 9.489 0.816 4.099) 10.369 37.642 ( 0.207 4.157 5.532) 6.923 38.043 ( -14.105 16.091 -0.306) 21.400 38.670 ( -6.244 -7.287 -15.575) 18.294 ======================= Grid point 620 (303/318) ======================= q-point: ( 0.38 0.30 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.202 ( -1.971 4.179 -16.352) 16.993 2.612 ( 3.494 -0.326 -3.115) 4.692 2.884 ( -3.723 -5.627 6.251) 9.198 2.999 ( -10.731 -4.671 -1.118) 11.757 3.797 ( 4.955 7.787 4.906) 10.453 4.492 ( -13.570 2.035 -9.104) 16.467 4.544 ( 0.648 -12.578 -5.923) 13.918 4.814 ( 8.953 -10.708 2.777) 14.231 5.041 ( 0.218 4.174 0.522) 4.212 5.609 ( -6.864 2.014 -11.183) 13.275 6.593 ( -5.277 4.466 -6.588) 9.550 7.058 ( 2.106 -7.474 14.211) 16.194 7.352 ( -1.557 10.669 -7.457) 13.110 7.627 ( 0.434 24.757 1.117) 24.786 7.961 ( -11.994 18.603 -1.147) 22.164 8.323 ( -6.006 -6.158 -2.312) 8.907 9.525 ( -0.066 14.993 0.181) 14.995 10.657 ( 1.769 -12.565 5.007) 13.641 16.960 ( 3.580 4.406 1.649) 5.912 17.123 ( 1.206 -2.017 -0.801) 2.483 17.598 ( 5.835 14.506 4.272) 16.209 17.953 ( 2.564 1.348 4.709) 5.529 21.369 ( 0.203 -1.297 1.259) 1.819 21.490 ( -1.367 -4.292 -1.694) 4.812 27.835 ( 1.004 -6.226 -0.068) 6.307 27.922 ( -1.394 -7.948 -2.734) 8.520 37.612 ( 4.380 3.024 -1.484) 5.526 37.656 ( -1.530 6.131 5.301) 8.248 37.850 ( -6.774 8.574 4.129) 11.681 38.506 ( -2.702 -11.121 -11.443) 16.184 ======================= Grid point 621 (304/318) ======================= q-point: ( 0.46 0.30 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 520 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.142 ( 0.427 -5.892 -4.204) 7.251 2.670 ( 3.419 -3.403 -1.196) 4.970 2.833 ( -4.105 -7.675 1.781) 8.884 2.887 ( -0.255 -13.257 -0.107) 13.260 3.880 ( 1.674 1.251 2.204) 3.037 4.051 ( -15.019 -2.339 -6.074) 16.368 4.601 ( 1.262 -1.478 -2.088) 2.852 4.953 ( 3.526 -12.408 -0.165) 12.900 5.178 ( 9.446 1.817 6.142) 11.413 5.434 ( -6.737 2.053 -7.637) 10.389 6.465 ( -3.591 11.288 -2.859) 12.186 7.188 ( 2.200 -5.859 13.160) 14.572 7.282 ( -0.436 3.107 -10.874) 11.318 7.664 ( 3.028 23.684 -0.672) 23.887 7.767 ( -7.822 24.508 0.746) 25.737 8.234 ( -2.445 -5.967 -0.601) 6.477 9.534 ( 0.398 15.397 0.148) 15.403 10.695 ( 0.444 -14.281 1.649) 14.382 17.021 ( 1.697 5.740 0.984) 6.066 17.133 ( 0.326 -2.935 -0.504) 2.996 17.695 ( 2.374 16.218 1.613) 16.470 17.997 ( 0.444 3.579 1.597) 3.945 21.379 ( 0.151 -2.051 0.732) 2.183 21.460 ( -0.691 -3.136 -0.978) 3.356 27.853 ( 0.695 -6.846 0.554) 6.904 27.886 ( -0.879 -7.981 -1.585) 8.184 37.607 ( -0.910 8.942 -1.650) 9.138 37.649 ( -1.194 6.185 1.372) 6.447 37.841 ( 0.430 -0.373 3.501) 3.547 38.431 ( -0.579 -12.411 -4.325) 13.156 ======================= Grid point 628 (305/318) ======================= q-point: ( 0.00 0.40 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 266 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.408 ( -0.000 11.078 0.000) 11.078 2.555 ( 0.000 3.179 0.000) 3.179 3.083 ( 0.000 2.914 0.000) 2.914 3.153 ( -0.000 2.191 0.000) 2.191 3.501 ( -0.000 3.293 0.000) 3.293 3.912 ( 0.000 -11.049 0.000) 11.049 4.839 ( 0.000 15.673 0.000) 15.673 4.971 ( -0.000 9.015 0.000) 9.015 5.851 ( -0.000 6.982 0.000) 6.982 6.226 ( 0.000 -10.592 0.000) 10.592 7.104 ( -0.000 9.737 0.000) 9.737 7.428 ( -0.000 -6.538 0.000) 6.538 8.207 ( -0.000 14.395 0.000) 14.395 8.340 ( -0.000 3.496 0.000) 3.496 8.709 ( 0.000 16.457 -0.000) 16.457 9.044 ( 0.000 2.658 0.000) 2.658 9.884 ( 0.000 10.460 0.000) 10.460 10.369 ( -0.000 -13.940 0.000) 13.940 16.825 ( -0.000 -4.306 -0.000) 4.306 16.864 ( 0.000 -6.879 0.000) 6.879 17.014 ( -0.000 2.015 0.000) 2.015 17.069 ( 0.000 -0.479 0.000) 0.479 21.331 ( -0.000 0.297 0.000) 0.297 21.385 ( -0.000 -2.518 0.000) 2.518 27.837 ( 0.000 -1.617 0.000) 1.617 27.869 ( -0.000 -3.236 0.000) 3.236 37.050 ( -0.000 0.881 -0.000) 0.881 37.156 ( -0.000 -5.056 0.000) 5.056 39.387 ( -0.000 15.559 0.000) 15.559 39.622 ( 0.000 3.256 -0.000) 3.256 ======================= Grid point 630 (306/318) ======================= q-point: ( 0.08 0.40 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 522 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.479 ( 6.692 8.554 0.232) 10.863 2.598 ( 4.373 2.943 -1.301) 5.429 3.104 ( 5.041 6.569 -4.115) 9.246 3.231 ( 7.413 0.338 0.168) 7.423 3.462 ( -5.120 7.248 5.762) 10.581 3.939 ( -0.569 -12.097 7.326) 14.154 4.806 ( -3.028 14.689 -4.912) 15.781 4.972 ( 2.160 7.216 -3.846) 8.458 5.881 ( 3.085 5.862 -0.063) 6.625 6.225 ( -0.094 -9.139 -1.191) 9.217 6.956 ( -14.603 9.094 -0.679) 17.216 7.310 ( -11.923 -7.957 0.372) 14.339 8.154 ( -3.949 14.225 -2.248) 14.933 8.359 ( 2.923 2.065 -7.212) 8.052 8.633 ( -5.822 18.570 -3.552) 19.783 9.008 ( -3.613 1.069 -2.089) 4.308 9.978 ( 6.445 7.501 7.828) 12.612 10.290 ( -7.840 -9.397 -0.288) 12.242 16.852 ( 1.666 -2.329 2.271) 3.655 16.926 ( 2.864 -5.107 6.029) 8.404 17.047 ( 5.427 0.869 -1.791) 5.781 17.089 ( 3.033 -1.865 -0.027) 3.560 21.334 ( 0.129 0.466 0.412) 0.635 21.396 ( 1.104 -2.905 -0.153) 3.111 27.814 ( -1.520 -0.927 -0.828) 1.963 27.882 ( 0.926 -4.171 -0.828) 4.352 37.065 ( 2.304 2.092 0.163) 3.116 37.224 ( 5.627 -5.775 2.478) 8.436 39.292 ( -9.580 15.172 -1.354) 17.994 39.520 ( -8.981 3.014 -5.165) 10.790 ======================= Grid point 631 (307/318) ======================= q-point: ( 0.15 0.40 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 522 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.614 ( 7.133 3.876 -1.275) 8.218 2.660 ( 3.046 2.266 -3.544) 5.193 3.261 ( 13.992 10.276 -3.033) 17.623 3.336 ( -1.276 8.938 -1.415) 9.139 3.461 ( 4.846 5.613 7.961) 10.880 3.943 ( -3.961 -12.807 9.015) 16.155 4.658 ( -8.143 14.102 -8.282) 18.270 5.006 ( 3.548 -0.628 -5.272) 6.386 5.937 ( 1.372 3.638 -1.910) 4.332 6.164 ( -6.093 -1.608 -5.325) 8.250 6.657 ( -13.570 3.704 0.996) 14.102 7.037 ( -16.277 -11.315 0.783) 19.839 8.045 ( -5.719 14.419 -4.677) 16.201 8.323 ( -3.404 -0.889 -5.953) 6.915 8.504 ( -3.986 20.193 -5.343) 21.265 8.885 ( -7.780 -1.451 -3.082) 8.493 10.110 ( -9.901 1.347 -0.423) 10.001 10.161 ( 6.246 1.598 9.761) 11.698 16.872 ( -0.238 1.133 0.866) 1.446 17.006 ( 1.419 -3.837 4.064) 5.766 17.161 ( 8.718 2.774 1.895) 9.343 17.268 ( 12.750 -4.938 4.749) 14.474 21.341 ( 0.288 0.677 0.575) 0.933 21.418 ( 1.202 -3.592 -0.261) 3.796 27.782 ( -1.160 -0.491 -1.265) 1.785 27.884 ( 0.088 -5.304 -1.794) 5.599 37.151 ( 6.317 3.654 1.737) 7.502 37.366 ( 7.306 -6.208 3.572) 10.231 39.032 ( -16.664 14.178 -2.350) 22.005 39.251 ( -14.689 1.898 -9.209) 17.441 ======================= Grid point 632 (308/318) ======================= q-point: ( 0.23 0.40 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 522 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.650 ( 0.993 3.345 -8.382) 9.079 2.719 ( 2.855 -1.010 0.311) 3.045 3.197 ( -8.991 17.613 -7.724) 21.230 3.479 ( -2.051 6.159 2.146) 6.837 3.622 ( 11.910 8.391 6.127) 15.805 3.990 ( 8.182 -13.806 2.034) 16.177 4.453 ( -7.786 10.843 -5.045) 14.270 4.999 ( -2.316 -11.168 -5.205) 12.537 5.731 ( -18.923 11.125 -7.410) 23.168 6.029 ( -4.172 -0.912 -9.092) 10.045 6.545 ( -1.096 -2.828 2.606) 3.999 6.804 ( -8.105 -12.739 4.124) 15.651 7.887 ( -7.914 13.328 -5.328) 16.391 8.169 ( -9.146 2.960 -3.396) 10.195 8.434 ( -1.234 13.449 -4.173) 14.136 8.696 ( -10.391 -1.050 -2.419) 10.720 9.947 ( -6.916 12.011 0.582) 13.872 10.309 ( 3.723 -4.568 7.697) 9.694 16.880 ( 1.165 2.051 0.364) 2.387 17.033 ( 0.630 -3.987 1.099) 4.183 17.388 ( 12.080 5.907 5.800) 14.645 17.552 ( 13.265 -3.559 6.918) 15.378 21.349 ( 0.181 0.641 0.569) 0.876 21.432 ( 0.506 -3.942 -0.525) 4.009 27.758 ( -0.589 -0.940 -1.381) 1.772 27.864 ( -0.848 -5.873 -2.527) 6.450 37.309 ( 8.772 3.889 3.192) 10.112 37.522 ( 6.650 -5.134 4.374) 9.472 38.675 ( -19.357 12.738 -2.901) 23.353 38.900 ( -15.875 -0.573 -11.213) 19.444 ======================= Grid point 633 (309/318) ======================= q-point: ( 0.31 0.40 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 522 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.589 ( -1.611 4.451 -14.012) 14.790 2.696 ( -4.639 0.261 -4.902) 6.754 2.947 ( -10.286 12.215 -6.340) 17.181 3.260 ( -18.326 0.242 1.501) 18.389 3.865 ( 6.656 9.604 3.563) 12.216 4.201 ( 12.935 -9.622 -5.326) 16.979 4.405 ( 4.639 -0.127 3.075) 5.567 4.806 ( -15.614 -15.989 -3.787) 22.667 5.372 ( -12.147 16.235 -6.412) 21.266 5.820 ( -9.728 -3.976 -12.035) 15.978 6.600 ( 4.524 -1.827 0.639) 4.921 6.784 ( 0.899 -10.205 6.486) 12.125 7.704 ( -8.118 11.239 -4.837) 14.683 7.984 ( -8.278 2.524 -1.481) 8.780 8.387 ( -2.361 10.073 -1.498) 10.454 8.488 ( -10.520 4.030 -1.030) 11.313 9.867 ( -2.531 16.700 0.965) 16.918 10.391 ( 1.121 -8.981 5.358) 10.518 16.924 ( 2.941 1.615 1.065) 3.521 17.053 ( 1.209 -3.666 0.114) 3.862 17.645 ( 11.179 8.869 6.216) 15.565 17.815 ( 10.512 -0.692 6.324) 12.287 21.353 ( -0.092 0.320 0.499) 0.600 21.429 ( -0.289 -3.750 -0.883) 3.863 27.743 ( -0.212 -2.056 -1.164) 2.372 27.826 ( -1.401 -5.882 -2.752) 6.643 37.495 ( 8.638 3.014 3.585) 9.826 37.653 ( 4.182 -2.562 5.014) 7.013 38.312 ( -17.303 10.786 -2.622) 20.557 38.560 ( -12.907 -4.207 -11.250) 17.631 ======================= Grid point 634 (310/318) ======================= q-point: ( 0.38 0.40 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 522 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.348 ( -9.856 9.533 -21.068) 25.137 2.602 ( -1.341 -1.333 -4.407) 4.795 2.789 ( -7.146 -2.959 1.602) 7.899 2.902 ( -17.220 -5.193 -3.881) 18.400 3.913 ( -1.715 4.746 3.532) 6.159 4.244 ( -12.009 -14.134 -7.058) 19.844 4.520 ( 5.110 -0.373 -0.280) 5.131 4.635 ( 5.661 -7.059 2.870) 9.493 5.221 ( -2.100 12.053 -2.285) 12.446 5.592 ( -7.402 -4.004 -9.478) 12.675 6.658 ( 1.842 3.046 -2.659) 4.443 6.882 ( 4.589 -8.810 7.017) 12.162 7.541 ( -6.280 9.491 -4.589) 12.271 7.867 ( -4.002 -1.730 0.721) 4.419 8.301 ( -7.980 12.743 0.936) 15.064 8.335 ( -3.428 7.551 -1.250) 8.386 9.851 ( -0.197 17.172 0.859) 17.195 10.422 ( -0.162 -11.663 3.165) 12.086 16.993 ( 3.348 0.497 1.685) 3.781 17.076 ( 1.149 -2.896 -0.400) 3.141 17.858 ( 7.993 10.821 4.632) 14.228 18.003 ( 6.223 2.461 4.130) 7.863 21.352 ( -0.241 -0.176 0.427) 0.521 21.414 ( -0.596 -3.220 -0.991) 3.421 27.736 ( -0.017 -3.340 -0.577) 3.390 27.784 ( -1.337 -5.571 -2.351) 6.193 37.654 ( 6.189 2.223 2.259) 6.954 37.728 ( 0.697 0.918 4.807) 4.944 38.028 ( -11.704 8.360 -1.156) 14.430 38.312 ( -6.915 -8.273 -9.185) 14.164 ======================= Grid point 635 (311/318) ======================= q-point: ( 0.46 0.40 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 522 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.111 ( -4.775 3.444 -7.777) 9.754 2.560 ( -0.735 -12.964 -5.791) 14.218 2.649 ( -4.534 -4.512 -1.229) 6.513 2.703 ( -4.499 -5.242 2.022) 7.198 3.881 ( -2.992 -0.282 0.879) 3.131 3.968 ( -7.843 -4.916 -1.665) 9.405 4.616 ( 3.109 1.595 -0.160) 3.498 4.752 ( 3.447 -7.519 0.261) 8.276 5.243 ( 3.155 4.983 1.665) 6.128 5.435 ( -4.658 -2.107 -5.024) 7.167 6.657 ( -0.009 8.405 -1.338) 8.511 6.991 ( 2.747 -9.967 3.192) 10.820 7.433 ( -2.594 9.594 -2.440) 10.234 7.831 ( -0.869 -6.055 0.677) 6.154 8.194 ( -3.266 16.474 0.330) 16.798 8.283 ( -1.553 9.104 -0.224) 9.238 9.856 ( 0.172 16.624 0.343) 16.629 10.430 ( -0.219 -12.895 1.055) 12.940 17.055 ( 2.037 -0.898 1.597) 2.740 17.083 ( -0.089 -1.776 -1.002) 2.041 17.983 ( 3.041 11.589 1.761) 12.110 18.093 ( 1.871 4.666 1.350) 5.206 21.351 ( -0.123 -0.602 0.210) 0.649 21.401 ( -0.290 -2.745 -0.479) 2.802 27.737 ( 0.248 -4.349 0.328) 4.368 27.753 ( -0.787 -5.136 -1.417) 5.386 37.737 ( 1.686 3.678 0.408) 4.066 37.744 ( -0.399 3.149 1.513) 3.517 37.881 ( -3.830 4.875 0.672) 6.236 38.198 ( -1.587 -10.776 -3.689) 11.500 ======================= Grid point 642 (312/318) ======================= q-point: ( 0.00 -0.50 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 159 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.558 ( -0.000 -3.655 0.000) 3.655 2.558 ( -0.000 3.655 0.000) 3.655 3.134 ( -0.000 -2.389 0.000) 2.389 3.134 ( 0.000 2.389 0.000) 2.389 3.670 ( -0.000 -11.983 -0.000) 11.983 3.670 ( -0.000 11.983 0.000) 11.983 5.030 ( -0.000 -3.329 0.000) 3.329 5.030 ( 0.000 3.329 0.000) 3.329 6.019 ( -0.000 -9.835 0.000) 9.835 6.019 ( -0.000 9.835 0.000) 9.835 7.279 ( 0.000 -8.226 0.000) 8.226 7.279 ( -0.000 8.226 0.000) 8.226 8.356 ( -0.000 -2.514 0.000) 2.514 8.356 ( -0.000 2.514 0.000) 2.514 8.986 ( 0.000 -9.111 0.000) 9.111 8.986 ( -0.000 9.111 0.000) 9.111 10.108 ( -0.000 -12.313 0.000) 12.313 10.108 ( 0.000 12.313 0.000) 12.313 16.786 ( 0.000 -0.811 0.000) 0.811 16.786 ( -0.000 0.811 0.000) 0.811 17.051 ( 0.000 -1.518 0.000) 1.518 17.051 ( -0.000 1.518 0.000) 1.518 21.347 ( -0.000 -1.329 0.000) 1.329 21.347 ( -0.000 1.329 0.000) 1.329 27.829 ( -0.000 -0.803 0.000) 0.803 27.829 ( 0.000 0.803 0.000) 0.803 37.081 ( -0.000 -2.517 0.000) 2.517 37.081 ( -0.000 2.517 0.000) 2.517 39.599 ( 0.000 -5.841 0.000) 5.841 39.599 ( -0.000 5.841 0.000) 5.841 ======================= Grid point 646 (313/318) ======================= q-point: ( 0.08 -0.50 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 312 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.598 ( 4.421 -3.190 -2.045) 5.823 2.598 ( 4.421 3.190 -2.045) 5.823 3.199 ( 6.969 -3.187 0.450) 7.676 3.199 ( 6.969 3.187 0.450) 7.676 3.675 ( -1.937 -13.252 6.985) 15.105 3.675 ( -1.937 13.252 6.985) 15.105 5.000 ( -1.868 -4.427 -4.596) 6.650 5.000 ( -1.868 4.427 -4.596) 6.650 6.035 ( 1.819 -9.336 -0.780) 9.544 6.035 ( 1.819 9.336 -0.780) 9.544 7.138 ( -14.228 -9.191 -0.404) 16.944 7.138 ( -14.228 9.191 -0.404) 16.944 8.332 ( -1.165 -4.817 -4.955) 7.008 8.332 ( -1.165 4.817 -4.955) 7.008 8.930 ( -4.877 -9.700 -2.923) 11.244 8.930 ( -4.877 9.700 -2.923) 11.244 10.125 ( 0.434 -7.589 3.675) 8.443 10.125 ( 0.434 7.589 3.675) 8.443 16.845 ( 3.698 -2.003 5.274) 6.745 16.845 ( 3.698 2.003 5.274) 6.745 17.069 ( 3.379 -1.063 -1.755) 3.953 17.069 ( 3.379 1.063 -1.755) 3.953 21.353 ( 0.532 -1.519 0.057) 1.610 21.353 ( 0.532 1.519 0.057) 1.610 27.822 ( -0.431 -1.749 -0.820) 1.979 27.822 ( -0.431 1.749 -0.820) 1.979 37.125 ( 4.204 -4.073 1.279) 5.992 37.125 ( 4.204 4.073 1.279) 5.992 39.498 ( -9.725 -5.627 -2.951) 11.616 39.498 ( -9.725 5.627 -2.951) 11.616 ======================= Grid point 648 (314/318) ======================= q-point: ( 0.15 -0.50 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 312 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.668 ( 4.276 -1.370 -3.838) 5.907 2.668 ( 4.276 1.370 -3.838) 5.907 3.393 ( 12.882 -2.721 -0.178) 13.167 3.393 ( 12.882 2.721 -0.178) 13.167 3.666 ( -4.614 -13.984 10.123) 17.870 3.666 ( -4.614 13.984 10.123) 17.870 4.899 ( -5.342 -9.568 -7.526) 13.294 4.899 ( -5.342 9.568 -7.526) 13.294 6.056 ( 0.527 -7.335 -3.555) 8.168 6.056 ( 0.527 7.335 -3.555) 8.168 6.813 ( -18.171 -10.734 0.146) 21.105 6.813 ( -18.171 10.734 0.146) 21.105 8.249 ( -4.201 -6.720 -6.741) 10.404 8.249 ( -4.201 6.720 -6.741) 10.404 8.790 ( -7.618 -8.980 -3.093) 12.176 8.790 ( -7.618 8.980 -3.093) 12.176 10.156 ( -0.034 -2.168 4.548) 5.038 10.156 ( -0.034 2.168 4.548) 5.038 16.920 ( 0.771 -3.838 3.774) 5.437 16.920 ( 0.771 3.838 3.774) 5.437 17.208 ( 11.695 -2.127 2.408) 12.128 17.208 ( 11.695 2.127 2.408) 12.128 21.365 ( 0.647 -1.849 0.046) 1.959 21.365 ( 0.647 1.849 0.046) 1.959 27.804 ( -0.784 -2.660 -1.524) 3.164 27.804 ( -0.784 2.660 -1.524) 3.164 37.244 ( 7.180 -5.709 2.464) 9.498 37.244 ( 7.180 5.709 2.464) 9.498 39.223 ( -16.638 -5.247 -5.227) 18.212 39.223 ( -16.638 5.247 -5.227) 18.212 ======================= Grid point 650 (315/318) ======================= q-point: ( 0.23 -0.50 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 312 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.696 ( 1.411 -1.502 -5.018) 5.424 2.696 ( 1.411 1.502 -5.017) 5.424 3.476 ( -8.771 -8.450 -0.168) 12.181 3.476 ( -8.771 8.450 -0.168) 12.181 3.761 ( 13.460 -7.756 4.161) 16.082 3.761 ( 13.460 7.756 4.161) 16.082 4.717 ( -9.546 -15.321 -5.989) 19.019 4.717 ( -9.546 15.321 -5.989) 19.019 5.940 ( -9.879 -8.458 -9.077) 15.859 5.940 ( -9.879 8.458 -9.077) 15.859 6.590 ( -4.931 -7.659 3.666) 9.819 6.590 ( -4.931 7.659 3.666) 9.819 8.094 ( -8.132 -7.798 -6.169) 12.845 8.094 ( -8.132 7.798 -6.169) 12.845 8.638 ( -6.890 -6.000 -1.225) 9.219 8.638 ( -6.890 6.000 -1.225) 9.219 10.173 ( -0.779 -9.626 3.733) 10.354 10.173 ( -0.779 9.626 3.733) 10.354 16.943 ( 0.785 -4.307 1.353) 4.583 16.943 ( 0.785 4.307 1.353) 4.583 17.485 ( 14.265 -3.839 6.058) 15.967 17.485 ( 14.265 3.839 6.058) 15.967 21.374 ( 0.295 -2.002 -0.076) 2.025 21.374 ( 0.295 2.002 -0.076) 2.025 27.776 ( -1.030 -2.776 -1.965) 3.553 27.776 ( -1.030 2.776 -1.965) 3.553 37.407 ( 8.188 -5.827 3.385) 10.604 37.407 ( 8.188 5.827 3.385) 10.604 38.850 ( -19.098 -5.199 -6.392) 20.800 38.850 ( -19.098 5.199 -6.392) 20.800 ======================= Grid point 652 (316/318) ======================= q-point: ( 0.31 -0.50 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 312 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.657 ( -1.771 -2.858 -7.379) 8.108 2.657 ( -1.771 2.858 -7.379) 8.108 3.187 ( -18.874 -8.729 -5.635) 21.545 3.187 ( -18.874 8.729 -5.635) 21.545 4.025 ( 10.087 -7.591 -0.633) 12.640 4.025 ( 10.087 7.591 -0.633) 12.640 4.519 ( -7.583 -11.435 0.511) 13.730 4.519 ( -7.583 11.435 0.511) 13.730 5.662 ( -11.458 -11.999 -9.615) 19.176 5.662 ( -11.458 11.999 -9.615) 19.176 6.627 ( 4.413 -4.911 3.409) 7.430 6.627 ( 4.413 4.911 3.409) 7.430 7.897 ( -9.224 -8.175 -3.917) 12.933 7.897 ( -9.224 8.175 -3.917) 12.933 8.522 ( -5.539 -2.371 0.147) 6.027 8.522 ( -5.539 2.371 0.147) 6.027 10.174 ( -1.050 -13.483 2.715) 13.793 10.174 ( -1.050 13.483 2.715) 13.793 16.975 ( 1.916 -3.636 0.844) 4.196 16.975 ( 1.916 3.636 0.844) 4.196 17.775 ( 12.455 -4.101 6.179) 14.496 17.775 ( 12.455 4.101 6.179) 14.496 21.374 ( -0.193 -1.882 -0.250) 1.908 21.374 ( -0.193 1.882 -0.250) 1.908 27.744 ( -1.111 -2.185 -1.989) 3.156 27.744 ( -1.111 2.185 -1.989) 3.156 37.574 ( 7.119 -4.601 3.868) 9.317 37.574 ( 7.119 4.601 3.868) 9.317 38.471 ( -16.954 -5.641 -6.390) 18.976 38.471 ( -16.954 5.641 -6.390) 18.976 ======================= Grid point 654 (317/318) ======================= q-point: ( 0.38 -0.50 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 312 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.523 ( -6.877 -6.983 -14.859) 17.800 2.523 ( -6.877 6.983 -14.859) 17.800 2.803 ( -16.007 -4.017 -2.142) 16.641 2.803 ( -16.007 4.017 -2.142) 16.641 4.025 ( -7.387 -7.754 -0.368) 10.716 4.025 ( -7.387 7.754 -0.368) 10.716 4.537 ( 6.432 -2.785 2.303) 7.378 4.537 ( 6.432 2.785 2.303) 7.378 5.451 ( -5.976 -10.055 -6.635) 13.448 5.451 ( -5.976 10.055 -6.635) 13.448 6.739 ( 5.097 -5.500 1.675) 7.683 6.739 ( 5.097 5.500 1.675) 7.683 7.730 ( -6.657 -9.312 -1.489) 11.543 7.730 ( -6.657 9.312 -1.489) 11.543 8.432 ( -4.279 -0.482 0.448) 4.330 8.432 ( -4.279 0.482 0.448) 4.330 10.169 ( -0.820 -14.492 1.740) 14.619 10.169 ( -0.820 14.492 1.740) 14.619 17.019 ( 2.115 -2.351 0.718) 3.243 17.019 ( 2.115 2.351 0.718) 3.243 18.001 ( 8.299 -3.432 4.350) 9.978 18.001 ( 8.299 3.432 4.350) 9.978 21.366 ( -0.409 -1.602 -0.306) 1.682 21.366 ( -0.409 1.602 -0.306) 1.682 27.714 ( -0.901 -1.279 -1.500) 2.168 27.714 ( -0.901 1.279 -1.500) 2.168 37.705 ( 4.337 -2.550 3.746) 6.272 37.705 ( 4.337 2.550 3.746) 6.272 38.171 ( -11.084 -6.558 -5.363) 13.951 38.171 ( -11.084 6.558 -5.363) 13.951 ======================= Grid point 656 (318/318) ======================= q-point: ( 0.46 -0.50 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.35e-03 1.35e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 4.65e-08 4.65e-08 Number of triplets: 312 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.277 ( -6.810 -12.732 -9.058) 17.044 2.277 ( -6.810 12.732 -9.058) 17.045 2.636 ( -3.666 -1.531 0.773) 4.047 2.636 ( -3.666 1.531 0.774) 4.047 3.895 ( -4.538 -2.142 0.379) 5.032 3.895 ( -4.538 2.142 0.379) 5.032 4.654 ( 3.606 -2.819 0.631) 4.620 4.654 ( 3.606 2.819 0.631) 4.620 5.355 ( -1.707 -5.522 -2.294) 6.219 5.355 ( -1.707 5.522 -2.294) 6.219 6.815 ( 2.110 -8.083 0.390) 8.363 6.815 ( 2.110 8.083 0.390) 8.363 7.641 ( -2.336 -11.001 -0.220) 11.249 7.641 ( -2.336 11.001 -0.220) 11.249 8.376 ( -1.727 -1.715 0.194) 2.442 8.376 ( -1.727 1.715 0.194) 2.442 10.166 ( -0.306 -14.375 0.616) 14.391 10.166 ( -0.306 14.375 0.616) 14.391 17.052 ( 0.920 -0.978 0.309) 1.378 17.052 ( 0.920 0.978 0.309) 1.378 18.124 ( 2.899 -2.494 1.548) 4.125 18.124 ( 2.899 2.494 1.548) 4.125 21.358 ( -0.203 -1.375 -0.140) 1.397 21.358 ( -0.203 1.375 -0.140) 1.397 27.696 ( -0.353 -0.404 -0.561) 0.776 27.696 ( -0.353 0.404 -0.561) 0.776 37.771 ( 1.015 -0.263 1.983) 2.243 37.771 ( 1.015 0.263 1.983) 2.243 38.012 ( -3.408 -8.016 -2.534) 9.071 38.012 ( -3.408 8.016 -2.534) 9.071 =================== 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 3/31200 10.0 1128.722 1125.089 1046.851 0.000 300.690 0.000 3/31200 20.0 239.679 193.427 177.489 0.000 55.547 0.000 3/31200 30.0 85.066 64.791 57.679 0.000 19.826 0.000 3/31200 40.0 44.023 32.890 28.799 0.000 10.093 0.000 3/31200 50.0 27.951 20.747 18.011 0.000 6.302 0.000 3/31200 60.0 19.993 14.860 12.807 0.000 4.443 0.000 3/31200 70.0 15.425 11.537 9.863 0.000 3.386 0.000 3/31200 80.0 12.526 9.453 8.009 0.000 2.721 0.000 3/31200 90.0 10.547 8.039 6.749 0.000 2.271 0.000 3/31200 100.0 9.119 7.021 5.842 0.000 1.949 0.000 3/31200 110.0 8.045 6.254 5.160 0.000 1.709 0.000 3/31200 120.0 7.208 5.653 4.628 0.000 1.524 0.000 3/31200 130.0 6.537 5.169 4.203 0.000 1.377 0.000 3/31200 140.0 5.988 4.770 3.854 0.000 1.258 0.000 3/31200 150.0 5.529 4.435 3.562 0.000 1.159 0.000 3/31200 160.0 5.140 4.148 3.314 0.000 1.076 0.000 3/31200 170.0 4.806 3.900 3.101 0.000 1.004 0.000 3/31200 180.0 4.515 3.684 2.916 0.000 0.943 0.000 3/31200 190.0 4.259 3.492 2.753 0.000 0.889 0.000 3/31200 200.0 4.032 3.322 2.609 0.000 0.841 0.000 3/31200 210.0 3.830 3.169 2.480 0.000 0.799 0.000 3/31200 220.0 3.648 3.031 2.364 0.000 0.761 0.000 3/31200 230.0 3.484 2.906 2.259 0.000 0.727 0.000 3/31200 240.0 3.335 2.792 2.164 0.000 0.695 0.000 3/31200 250.0 3.199 2.688 2.077 0.000 0.667 0.000 3/31200 260.0 3.074 2.591 1.997 0.000 0.641 0.000 3/31200 270.0 2.959 2.503 1.924 0.000 0.617 0.000 3/31200 280.0 2.853 2.420 1.856 0.000 0.594 0.000 3/31200 290.0 2.755 2.344 1.793 0.000 0.574 0.000 3/31200 300.0 2.663 2.273 1.735 0.000 0.554 0.000 3/31200 310.0 2.578 2.206 1.681 0.000 0.536 0.000 3/31200 320.0 2.499 2.144 1.630 0.000 0.519 0.000 3/31200 330.0 2.424 2.085 1.583 0.000 0.504 0.000 3/31200 340.0 2.355 2.030 1.538 0.000 0.489 0.000 3/31200 350.0 2.289 1.978 1.496 0.000 0.475 0.000 3/31200 360.0 2.227 1.929 1.457 0.000 0.461 0.000 3/31200 370.0 2.169 1.883 1.420 0.000 0.449 0.000 3/31200 380.0 2.114 1.839 1.384 0.000 0.437 0.000 3/31200 390.0 2.062 1.797 1.351 0.000 0.426 0.000 3/31200 400.0 2.012 1.757 1.319 0.000 0.415 0.000 3/31200 410.0 1.965 1.719 1.289 0.000 0.405 0.000 3/31200 420.0 1.921 1.683 1.261 0.000 0.395 0.000 3/31200 430.0 1.878 1.649 1.234 0.000 0.386 0.000 3/31200 440.0 1.837 1.616 1.208 0.000 0.377 0.000 3/31200 450.0 1.799 1.584 1.183 0.000 0.369 0.000 3/31200 460.0 1.762 1.554 1.159 0.000 0.360 0.000 3/31200 470.0 1.726 1.525 1.137 0.000 0.353 0.000 3/31200 480.0 1.692 1.497 1.115 0.000 0.345 0.000 3/31200 490.0 1.660 1.471 1.094 0.000 0.338 0.000 3/31200 500.0 1.629 1.445 1.074 0.000 0.331 0.000 3/31200 510.0 1.599 1.420 1.055 0.000 0.325 0.000 3/31200 520.0 1.570 1.397 1.036 0.000 0.318 0.000 3/31200 530.0 1.542 1.374 1.019 0.000 0.312 0.000 3/31200 540.0 1.516 1.351 1.001 0.000 0.306 0.000 3/31200 550.0 1.490 1.330 0.985 0.000 0.301 0.000 3/31200 560.0 1.465 1.309 0.969 0.000 0.295 0.000 3/31200 570.0 1.441 1.289 0.954 0.000 0.290 0.000 3/31200 580.0 1.418 1.270 0.939 0.000 0.285 0.000 3/31200 590.0 1.396 1.251 0.924 0.000 0.280 0.000 3/31200 600.0 1.374 1.233 0.910 0.000 0.275 0.000 3/31200 610.0 1.353 1.216 0.897 0.000 0.271 0.000 3/31200 620.0 1.333 1.199 0.884 0.000 0.266 0.000 3/31200 630.0 1.313 1.182 0.871 0.000 0.262 0.000 3/31200 640.0 1.294 1.166 0.859 0.000 0.258 0.000 3/31200 650.0 1.276 1.150 0.847 0.000 0.254 0.000 3/31200 660.0 1.258 1.135 0.836 0.000 0.250 0.000 3/31200 670.0 1.241 1.121 0.824 0.000 0.246 0.000 3/31200 680.0 1.224 1.106 0.814 0.000 0.242 0.000 3/31200 690.0 1.207 1.092 0.803 0.000 0.239 0.000 3/31200 700.0 1.191 1.079 0.793 0.000 0.235 0.000 3/31200 710.0 1.176 1.066 0.783 0.000 0.232 0.000 3/31200 720.0 1.161 1.053 0.773 0.000 0.229 0.000 3/31200 730.0 1.146 1.040 0.763 0.000 0.225 0.000 3/31200 740.0 1.132 1.028 0.754 0.000 0.222 0.000 3/31200 750.0 1.118 1.016 0.745 0.000 0.219 0.000 3/31200 760.0 1.104 1.004 0.736 0.000 0.216 0.000 3/31200 770.0 1.091 0.993 0.728 0.000 0.213 0.000 3/31200 780.0 1.078 0.982 0.719 0.000 0.211 0.000 3/31200 790.0 1.066 0.971 0.711 0.000 0.208 0.000 3/31200 800.0 1.053 0.960 0.703 0.000 0.205 0.000 3/31200 810.0 1.041 0.950 0.695 0.000 0.203 0.000 3/31200 820.0 1.030 0.940 0.688 0.000 0.200 0.000 3/31200 830.0 1.018 0.930 0.680 0.000 0.198 0.000 3/31200 840.0 1.007 0.920 0.673 0.000 0.195 0.000 3/31200 850.0 0.996 0.911 0.666 0.000 0.193 0.000 3/31200 860.0 0.985 0.901 0.659 0.000 0.191 0.000 3/31200 870.0 0.975 0.892 0.652 0.000 0.188 0.000 3/31200 880.0 0.965 0.883 0.645 0.000 0.186 0.000 3/31200 890.0 0.955 0.875 0.639 0.000 0.184 0.000 3/31200 900.0 0.945 0.866 0.632 0.000 0.182 0.000 3/31200 910.0 0.935 0.858 0.626 0.000 0.180 0.000 3/31200 920.0 0.926 0.850 0.620 0.000 0.178 0.000 3/31200 930.0 0.917 0.841 0.614 0.000 0.176 0.000 3/31200 940.0 0.908 0.834 0.608 0.000 0.174 0.000 3/31200 950.0 0.899 0.826 0.602 0.000 0.172 0.000 3/31200 960.0 0.890 0.818 0.597 0.000 0.171 0.000 3/31200 970.0 0.882 0.811 0.591 0.000 0.169 0.000 3/31200 980.0 0.873 0.804 0.586 0.000 0.167 0.000 3/31200 990.0 0.865 0.796 0.580 0.000 0.165 0.000 3/31200 1000.0 0.857 0.789 0.575 0.000 0.164 0.000 3/31200 Thermal conductivity related properties were written into "kappa-m13108.hdf5". Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-07 22:26:29]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|