----------------------------- ------- calculate fc2 ------- ----------------------------- _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1 -------------------------[time 2026-01-08 20:45:04]------------------------- Compiled with OpenMP support (max 128 threads). Running in phonopy.load mode. Python version 3.14.2 Spglib version 2.6.1 Crystal structure was read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". Unit of length: angstrom Settings: Supercell: [3 2 3] Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: P2_1/c (14) Number of symmetry operations in supercell: 72 ------------------------------ primitive cell ------------------------------ Lattice vectors: a 3.945592377710002 0.000000000000000 0.000000000000000 b 0.000000000000000 10.709580530000000 0.000000000000000 c -3.943799610531709 0.000000000000000 4.309378225362503 Atomic positions (fractional): *1 In 0.11738413403558 0.87974783732133 0.11716560790440 114.818 2 In 0.11738413403558 0.62025216267867 0.61716560790440 114.818 3 In 0.88261586596442 0.12025216267867 0.88283439209560 114.818 4 In 0.88261586596442 0.37974783732133 0.38283439209560 114.818 *5 S 0.00474538849828 0.34992006342551 0.00469684850523 32.065 6 S 0.99525461150172 0.84992006342551 0.49530315149477 32.065 7 S 0.99525461150172 0.65007993657449 0.99530315149477 32.065 8 S 0.00474538849828 0.15007993657449 0.50469684850523 32.065 -------------------------------- unit cell --------------------------------- Lattice vectors: a 3.945592377710002 0.000000000000000 0.000000000000000 b 0.000000000000000 10.709580530000000 0.000000000000000 c -3.943799610531709 0.000000000000000 4.309378225362503 Atomic positions (fractional): *1 In 0.11738413403558 0.87974783732133 0.11716560790440 114.818 > 1 2 In 0.11738413403558 0.62025216267867 0.61716560790440 114.818 > 2 3 In 0.88261586596442 0.12025216267867 0.88283439209560 114.818 > 3 4 In 0.88261586596442 0.37974783732133 0.38283439209560 114.818 > 4 *5 S 0.00474538849828 0.34992006342551 0.00469684850523 32.065 > 5 6 S 0.99525461150172 0.84992006342551 0.49530315149477 32.065 > 6 7 S 0.99525461150172 0.65007993657449 0.99530315149477 32.065 > 7 8 S 0.00474538849828 0.15007993657449 0.50469684850523 32.065 > 8 -------------------------------- super cell -------------------------------- Lattice vectors: a 11.836777133130006 0.000000000000000 0.000000000000000 b 0.000000000000000 21.419161060000000 0.000000000000000 c -11.831398831595127 0.000000000000000 12.928134676087508 Atomic positions (fractional): *1 In 0.03912804467853 0.43987391866066 0.03905520263480 114.818 > 1 2 In 0.37246137801186 0.43987391866066 0.03905520263480 114.818 > 1 3 In 0.70579471134519 0.43987391866066 0.03905520263480 114.818 > 1 4 In 0.03912804467853 0.93987391866067 0.03905520263480 114.818 > 1 5 In 0.37246137801186 0.93987391866067 0.03905520263480 114.818 > 1 6 In 0.70579471134519 0.93987391866067 0.03905520263480 114.818 > 1 7 In 0.03912804467853 0.43987391866066 0.37238853596813 114.818 > 1 8 In 0.37246137801186 0.43987391866066 0.37238853596813 114.818 > 1 9 In 0.70579471134519 0.43987391866066 0.37238853596813 114.818 > 1 10 In 0.03912804467853 0.93987391866067 0.37238853596813 114.818 > 1 11 In 0.37246137801186 0.93987391866067 0.37238853596813 114.818 > 1 12 In 0.70579471134519 0.93987391866067 0.37238853596813 114.818 > 1 13 In 0.03912804467853 0.43987391866066 0.70572186930147 114.818 > 1 14 In 0.37246137801186 0.43987391866066 0.70572186930147 114.818 > 1 15 In 0.70579471134519 0.43987391866066 0.70572186930147 114.818 > 1 16 In 0.03912804467853 0.93987391866067 0.70572186930147 114.818 > 1 17 In 0.37246137801186 0.93987391866067 0.70572186930147 114.818 > 1 18 In 0.70579471134519 0.93987391866067 0.70572186930147 114.818 > 1 19 In 0.03912804467853 0.31012608133934 0.20572186930147 114.818 > 2 20 In 0.37246137801186 0.31012608133934 0.20572186930147 114.818 > 2 21 In 0.70579471134519 0.31012608133934 0.20572186930147 114.818 > 2 22 In 0.03912804467853 0.81012608133933 0.20572186930147 114.818 > 2 23 In 0.37246137801186 0.81012608133933 0.20572186930147 114.818 > 2 24 In 0.70579471134519 0.81012608133933 0.20572186930147 114.818 > 2 25 In 0.03912804467853 0.31012608133934 0.53905520263480 114.818 > 2 26 In 0.37246137801186 0.31012608133934 0.53905520263480 114.818 > 2 27 In 0.70579471134519 0.31012608133934 0.53905520263480 114.818 > 2 28 In 0.03912804467853 0.81012608133933 0.53905520263480 114.818 > 2 29 In 0.37246137801186 0.81012608133933 0.53905520263480 114.818 > 2 30 In 0.70579471134519 0.81012608133933 0.53905520263480 114.818 > 2 31 In 0.03912804467853 0.31012608133934 0.87238853596813 114.818 > 2 32 In 0.37246137801186 0.31012608133934 0.87238853596813 114.818 > 2 33 In 0.70579471134519 0.31012608133934 0.87238853596813 114.818 > 2 34 In 0.03912804467853 0.81012608133933 0.87238853596813 114.818 > 2 35 In 0.37246137801186 0.81012608133933 0.87238853596813 114.818 > 2 36 In 0.70579471134519 0.81012608133933 0.87238853596813 114.818 > 2 37 In 0.29420528865481 0.06012608133934 0.29427813069853 114.818 > 3 38 In 0.62753862198814 0.06012608133934 0.29427813069853 114.818 > 3 39 In 0.96087195532147 0.06012608133934 0.29427813069853 114.818 > 3 40 In 0.29420528865481 0.56012608133934 0.29427813069853 114.818 > 3 41 In 0.62753862198814 0.56012608133934 0.29427813069853 114.818 > 3 42 In 0.96087195532147 0.56012608133934 0.29427813069853 114.818 > 3 43 In 0.29420528865481 0.06012608133934 0.62761146403187 114.818 > 3 44 In 0.62753862198814 0.06012608133934 0.62761146403187 114.818 > 3 45 In 0.96087195532147 0.06012608133934 0.62761146403187 114.818 > 3 46 In 0.29420528865481 0.56012608133934 0.62761146403187 114.818 > 3 47 In 0.62753862198814 0.56012608133934 0.62761146403187 114.818 > 3 48 In 0.96087195532147 0.56012608133934 0.62761146403187 114.818 > 3 49 In 0.29420528865481 0.06012608133934 0.96094479736520 114.818 > 3 50 In 0.62753862198814 0.06012608133934 0.96094479736520 114.818 > 3 51 In 0.96087195532147 0.06012608133934 0.96094479736520 114.818 > 3 52 In 0.29420528865481 0.56012608133934 0.96094479736520 114.818 > 3 53 In 0.62753862198814 0.56012608133934 0.96094479736520 114.818 > 3 54 In 0.96087195532147 0.56012608133934 0.96094479736520 114.818 > 3 55 In 0.29420528865481 0.18987391866066 0.12761146403187 114.818 > 4 56 In 0.62753862198814 0.18987391866066 0.12761146403187 114.818 > 4 57 In 0.96087195532147 0.18987391866066 0.12761146403187 114.818 > 4 58 In 0.29420528865481 0.68987391866066 0.12761146403187 114.818 > 4 59 In 0.62753862198814 0.68987391866066 0.12761146403187 114.818 > 4 60 In 0.96087195532147 0.68987391866066 0.12761146403187 114.818 > 4 61 In 0.29420528865481 0.18987391866066 0.46094479736520 114.818 > 4 62 In 0.62753862198814 0.18987391866066 0.46094479736520 114.818 > 4 63 In 0.96087195532147 0.18987391866066 0.46094479736520 114.818 > 4 64 In 0.29420528865481 0.68987391866066 0.46094479736520 114.818 > 4 65 In 0.62753862198814 0.68987391866066 0.46094479736520 114.818 > 4 66 In 0.96087195532147 0.68987391866066 0.46094479736520 114.818 > 4 67 In 0.29420528865481 0.18987391866066 0.79427813069853 114.818 > 4 68 In 0.62753862198814 0.18987391866066 0.79427813069853 114.818 > 4 69 In 0.96087195532147 0.18987391866066 0.79427813069853 114.818 > 4 70 In 0.29420528865481 0.68987391866066 0.79427813069853 114.818 > 4 71 In 0.62753862198814 0.68987391866066 0.79427813069853 114.818 > 4 72 In 0.96087195532147 0.68987391866066 0.79427813069853 114.818 > 4 *73 S 0.00158179616609 0.17496003171275 0.00156561616841 32.065 > 5 74 S 0.33491512949943 0.17496003171275 0.00156561616841 32.065 > 5 75 S 0.66824846283276 0.17496003171275 0.00156561616841 32.065 > 5 76 S 0.00158179616609 0.67496003171275 0.00156561616841 32.065 > 5 77 S 0.33491512949943 0.67496003171275 0.00156561616841 32.065 > 5 78 S 0.66824846283276 0.67496003171275 0.00156561616841 32.065 > 5 79 S 0.00158179616609 0.17496003171275 0.33489894950174 32.065 > 5 80 S 0.33491512949943 0.17496003171275 0.33489894950174 32.065 > 5 81 S 0.66824846283276 0.17496003171275 0.33489894950174 32.065 > 5 82 S 0.00158179616609 0.67496003171275 0.33489894950174 32.065 > 5 83 S 0.33491512949943 0.67496003171275 0.33489894950174 32.065 > 5 84 S 0.66824846283276 0.67496003171275 0.33489894950174 32.065 > 5 85 S 0.00158179616609 0.17496003171275 0.66823228283508 32.065 > 5 86 S 0.33491512949943 0.17496003171275 0.66823228283508 32.065 > 5 87 S 0.66824846283276 0.17496003171275 0.66823228283508 32.065 > 5 88 S 0.00158179616609 0.67496003171275 0.66823228283508 32.065 > 5 89 S 0.33491512949943 0.67496003171275 0.66823228283508 32.065 > 5 90 S 0.66824846283276 0.67496003171275 0.66823228283508 32.065 > 5 91 S 0.33175153716724 0.42496003171275 0.16510105049826 32.065 > 6 92 S 0.66508487050057 0.42496003171275 0.16510105049826 32.065 > 6 93 S 0.99841820383391 0.42496003171275 0.16510105049826 32.065 > 6 94 S 0.33175153716724 0.92496003171275 0.16510105049826 32.065 > 6 95 S 0.66508487050057 0.92496003171275 0.16510105049826 32.065 > 6 96 S 0.99841820383391 0.92496003171275 0.16510105049826 32.065 > 6 97 S 0.33175153716724 0.42496003171275 0.49843438383159 32.065 > 6 98 S 0.66508487050057 0.42496003171275 0.49843438383159 32.065 > 6 99 S 0.99841820383391 0.42496003171275 0.49843438383159 32.065 > 6 100 S 0.33175153716724 0.92496003171275 0.49843438383159 32.065 > 6 101 S 0.66508487050057 0.92496003171275 0.49843438383159 32.065 > 6 102 S 0.99841820383391 0.92496003171275 0.49843438383159 32.065 > 6 103 S 0.33175153716724 0.42496003171275 0.83176771716492 32.065 > 6 104 S 0.66508487050057 0.42496003171275 0.83176771716492 32.065 > 6 105 S 0.99841820383391 0.42496003171275 0.83176771716492 32.065 > 6 106 S 0.33175153716724 0.92496003171275 0.83176771716492 32.065 > 6 107 S 0.66508487050057 0.92496003171275 0.83176771716492 32.065 > 6 108 S 0.99841820383391 0.92496003171275 0.83176771716492 32.065 > 6 109 S 0.33175153716724 0.32503996828725 0.33176771716492 32.065 > 7 110 S 0.66508487050057 0.32503996828725 0.33176771716492 32.065 > 7 111 S 0.99841820383391 0.32503996828725 0.33176771716492 32.065 > 7 112 S 0.33175153716724 0.82503996828725 0.33176771716492 32.065 > 7 113 S 0.66508487050057 0.82503996828725 0.33176771716492 32.065 > 7 114 S 0.99841820383391 0.82503996828725 0.33176771716492 32.065 > 7 115 S 0.33175153716724 0.32503996828725 0.66510105049826 32.065 > 7 116 S 0.66508487050057 0.32503996828725 0.66510105049826 32.065 > 7 117 S 0.99841820383391 0.32503996828725 0.66510105049826 32.065 > 7 118 S 0.33175153716724 0.82503996828725 0.66510105049826 32.065 > 7 119 S 0.66508487050057 0.82503996828725 0.66510105049826 32.065 > 7 120 S 0.99841820383391 0.82503996828725 0.66510105049826 32.065 > 7 121 S 0.33175153716724 0.32503996828725 0.99843438383159 32.065 > 7 122 S 0.66508487050057 0.32503996828725 0.99843438383159 32.065 > 7 123 S 0.99841820383391 0.32503996828725 0.99843438383159 32.065 > 7 124 S 0.33175153716724 0.82503996828725 0.99843438383159 32.065 > 7 125 S 0.66508487050057 0.82503996828725 0.99843438383159 32.065 > 7 126 S 0.99841820383391 0.82503996828725 0.99843438383159 32.065 > 7 127 S 0.00158179616609 0.07503996828725 0.16823228283508 32.065 > 8 128 S 0.33491512949943 0.07503996828725 0.16823228283508 32.065 > 8 129 S 0.66824846283276 0.07503996828725 0.16823228283508 32.065 > 8 130 S 0.00158179616609 0.57503996828725 0.16823228283508 32.065 > 8 131 S 0.33491512949943 0.57503996828725 0.16823228283508 32.065 > 8 132 S 0.66824846283276 0.57503996828725 0.16823228283508 32.065 > 8 133 S 0.00158179616609 0.07503996828725 0.50156561616841 32.065 > 8 134 S 0.33491512949943 0.07503996828725 0.50156561616841 32.065 > 8 135 S 0.66824846283276 0.07503996828725 0.50156561616841 32.065 > 8 136 S 0.00158179616609 0.57503996828725 0.50156561616841 32.065 > 8 137 S 0.33491512949943 0.57503996828725 0.50156561616841 32.065 > 8 138 S 0.66824846283276 0.57503996828725 0.50156561616841 32.065 > 8 139 S 0.00158179616609 0.07503996828725 0.83489894950174 32.065 > 8 140 S 0.33491512949943 0.07503996828725 0.83489894950174 32.065 > 8 141 S 0.66824846283276 0.07503996828725 0.83489894950174 32.065 > 8 142 S 0.00158179616609 0.57503996828725 0.83489894950174 32.065 > 8 143 S 0.33491512949943 0.57503996828725 0.83489894950174 32.065 > 8 144 S 0.66824846283276 0.57503996828725 0.83489894950174 32.065 > 8 ---------------------------------------------------------------------------- NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". --------------------------- Dielectric constant ---------------------------- 9.8228861 0.0000000 -0.0985132 0.0000000 13.2031722 0.0000000 -0.0985124 0.0000000 9.9941847 -------------------------- Born effective charges -------------------------- 1 In 3.0694051 0.0001962 -0.0087645 0.0000400 2.8057395 -0.3058546 -0.0063708 0.4121881 2.6653309 2 In 3.0694051 -0.0001962 -0.0087645 -0.0000400 2.8057395 0.3058546 -0.0063708 -0.4121881 2.6653309 3 In 3.0694051 0.0001962 -0.0087645 0.0000400 2.8057395 -0.3058546 -0.0063708 0.4121881 2.6653309 4 In 3.0694051 -0.0001962 -0.0087645 -0.0000400 2.8057395 0.3058546 -0.0063708 -0.4121881 2.6653309 5 S -3.0694051 0.0014870 0.0087645 -0.0007072 -2.8057395 -0.3656363 0.0063708 -0.5792054 -2.6653309 6 S -3.0694051 -0.0014870 0.0087645 0.0007072 -2.8057395 0.3656363 0.0063708 0.5792054 -2.6653309 7 S -3.0694051 0.0014870 0.0087645 -0.0007072 -2.8057395 -0.3656363 0.0063708 -0.5792054 -2.6653309 8 S -3.0694051 -0.0014870 0.0087645 0.0007072 -2.8057395 0.3656363 0.0063708 0.5792054 -2.6653309 ---------------------------------------------------------------------------- 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: 432/432 Permutation basis: 5784/5784 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 1362 Number of blocks in projector: 1362 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: 288 Use standard eigh solver. --- Eigsh_solver_block: 2 / 6 --- Block_size: 288 Use standard eigh solver. --- Eigsh_solver_block: 3 / 6 --- Block_size: 288 Use standard eigh solver. --- Eigsh_solver_block: 4 / 6 --- Block_size: 166 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 166 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 166 Use standard eigh solver. Tree of FC basis block matrices: - (1362, 1345), data: False |-- (166, 164), data: True |-- (166, 164), data: True |-- (166, 164), data: True |-- (288, 284), data: True |-- (288, 284), data: True |-- (288, 285), data: True ----- Solver_atoms: 1 -- 144 / 144 Time (Solver_compr_matrix_reshape): 0.012 Solver_block: 100 / 240 - Time: 2.278 Solver_block: 200 / 240 - Time: 2.279 Solver_block: 240 / 240 - Time: 0.976 Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 5.574 --------------------------------- Symfc end -------------------------------- Max drift of force constants: 0.00000000 (yy) 0.00000000 (yy) Permutation basis: 432/432 Permutation basis: 5784/5784 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 1362 Number of blocks in projector: 1362 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: 288 Use standard eigh solver. --- Eigsh_solver_block: 2 / 6 --- Block_size: 288 Use standard eigh solver. --- Eigsh_solver_block: 3 / 6 --- Block_size: 288 Use standard eigh solver. --- Eigsh_solver_block: 4 / 6 --- Block_size: 166 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 166 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 166 Use standard eigh solver. Tree of FC basis block matrices: - (1362, 1345), data: False |-- (166, 164), data: True |-- (166, 164), data: True |-- (166, 164), data: True |-- (288, 284), data: True |-- (288, 284), data: True |-- (288, 285), data: True Max drift after symmetrization by symfc projector: 0.00000000 (yy) 0.00000000 (yy) Force constants are written into "force_constants.hdf5". ---------------------------------------------------------------------------- One of the following run modes may be specified for phonon calculations. - Mesh sampling (MESH, --mesh) - Q-points (QPOINTS, --qpoints) - Band structure (BAND, --band) - Animation (ANIME, --anime) - Modulation (MODULATION, --modulation) - Characters of Irreps (IRREPS, --irreps) - Create displacements (CREATE_DISPLACEMENTS, -d) ---------------------------------------------------------------------------- Summary of calculation was written in "phonopy.yaml". -------------------------[time 2026-01-08 20:45:23]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate fc3 ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 20:45:23]------------------------- 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 3] Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: P2_1/c (14) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 3.945592377710002 0.000000000000000 0.000000000000000 b 0.000000000000000 10.709580530000000 0.000000000000000 c -3.943799610531709 0.000000000000000 4.309378225362503 Atomic positions (fractional): 1 In 0.11738413403558 0.87974783732133 0.11716560790440 114.818 2 In 0.11738413403558 0.62025216267867 0.61716560790440 114.818 3 In 0.88261586596442 0.12025216267867 0.88283439209560 114.818 4 In 0.88261586596442 0.37974783732133 0.38283439209560 114.818 5 S 0.00474538849828 0.34992006342551 0.00469684850523 32.065 6 S 0.99525461150172 0.84992006342551 0.49530315149477 32.065 7 S 0.99525461150172 0.65007993657449 0.99530315149477 32.065 8 S 0.00474538849828 0.15007993657449 0.50469684850523 32.065 -------------------------------- supercell --------------------------------- Lattice vectors: a 11.836777133130006 0.000000000000000 0.000000000000000 b 0.000000000000000 21.419161060000000 0.000000000000000 c -11.831398831595127 0.000000000000000 12.928134676087508 Atomic positions (fractional): 1 In 0.03912804467853 0.43987391866066 0.03905520263480 114.818 > 1 2 In 0.37246137801186 0.43987391866066 0.03905520263480 114.818 > 1 3 In 0.70579471134519 0.43987391866066 0.03905520263480 114.818 > 1 4 In 0.03912804467853 0.93987391866067 0.03905520263480 114.818 > 1 5 In 0.37246137801186 0.93987391866067 0.03905520263480 114.818 > 1 6 In 0.70579471134519 0.93987391866067 0.03905520263480 114.818 > 1 7 In 0.03912804467853 0.43987391866066 0.37238853596813 114.818 > 1 8 In 0.37246137801186 0.43987391866066 0.37238853596813 114.818 > 1 9 In 0.70579471134519 0.43987391866066 0.37238853596813 114.818 > 1 10 In 0.03912804467853 0.93987391866067 0.37238853596813 114.818 > 1 11 In 0.37246137801186 0.93987391866067 0.37238853596813 114.818 > 1 12 In 0.70579471134519 0.93987391866067 0.37238853596813 114.818 > 1 13 In 0.03912804467853 0.43987391866066 0.70572186930147 114.818 > 1 14 In 0.37246137801186 0.43987391866066 0.70572186930147 114.818 > 1 15 In 0.70579471134519 0.43987391866066 0.70572186930147 114.818 > 1 16 In 0.03912804467853 0.93987391866067 0.70572186930147 114.818 > 1 17 In 0.37246137801186 0.93987391866067 0.70572186930147 114.818 > 1 18 In 0.70579471134519 0.93987391866067 0.70572186930147 114.818 > 1 19 In 0.03912804467853 0.31012608133934 0.20572186930147 114.818 > 19 20 In 0.37246137801186 0.31012608133934 0.20572186930147 114.818 > 19 21 In 0.70579471134519 0.31012608133934 0.20572186930147 114.818 > 19 22 In 0.03912804467853 0.81012608133933 0.20572186930147 114.818 > 19 23 In 0.37246137801186 0.81012608133933 0.20572186930147 114.818 > 19 24 In 0.70579471134519 0.81012608133933 0.20572186930147 114.818 > 19 25 In 0.03912804467853 0.31012608133934 0.53905520263480 114.818 > 19 26 In 0.37246137801186 0.31012608133934 0.53905520263480 114.818 > 19 27 In 0.70579471134519 0.31012608133934 0.53905520263480 114.818 > 19 28 In 0.03912804467853 0.81012608133933 0.53905520263480 114.818 > 19 29 In 0.37246137801186 0.81012608133933 0.53905520263480 114.818 > 19 30 In 0.70579471134519 0.81012608133933 0.53905520263480 114.818 > 19 31 In 0.03912804467853 0.31012608133934 0.87238853596813 114.818 > 19 32 In 0.37246137801186 0.31012608133934 0.87238853596813 114.818 > 19 33 In 0.70579471134519 0.31012608133934 0.87238853596813 114.818 > 19 34 In 0.03912804467853 0.81012608133933 0.87238853596813 114.818 > 19 35 In 0.37246137801186 0.81012608133933 0.87238853596813 114.818 > 19 36 In 0.70579471134519 0.81012608133933 0.87238853596813 114.818 > 19 37 In 0.29420528865481 0.06012608133934 0.29427813069853 114.818 > 37 38 In 0.62753862198814 0.06012608133934 0.29427813069853 114.818 > 37 39 In 0.96087195532147 0.06012608133934 0.29427813069853 114.818 > 37 40 In 0.29420528865481 0.56012608133934 0.29427813069853 114.818 > 37 41 In 0.62753862198814 0.56012608133934 0.29427813069853 114.818 > 37 42 In 0.96087195532147 0.56012608133934 0.29427813069853 114.818 > 37 43 In 0.29420528865481 0.06012608133934 0.62761146403187 114.818 > 37 44 In 0.62753862198814 0.06012608133934 0.62761146403187 114.818 > 37 45 In 0.96087195532147 0.06012608133934 0.62761146403187 114.818 > 37 46 In 0.29420528865481 0.56012608133934 0.62761146403187 114.818 > 37 47 In 0.62753862198814 0.56012608133934 0.62761146403187 114.818 > 37 48 In 0.96087195532147 0.56012608133934 0.62761146403187 114.818 > 37 49 In 0.29420528865481 0.06012608133934 0.96094479736520 114.818 > 37 50 In 0.62753862198814 0.06012608133934 0.96094479736520 114.818 > 37 51 In 0.96087195532147 0.06012608133934 0.96094479736520 114.818 > 37 52 In 0.29420528865481 0.56012608133934 0.96094479736520 114.818 > 37 53 In 0.62753862198814 0.56012608133934 0.96094479736520 114.818 > 37 54 In 0.96087195532147 0.56012608133934 0.96094479736520 114.818 > 37 55 In 0.29420528865481 0.18987391866066 0.12761146403187 114.818 > 55 56 In 0.62753862198814 0.18987391866066 0.12761146403187 114.818 > 55 57 In 0.96087195532147 0.18987391866066 0.12761146403187 114.818 > 55 58 In 0.29420528865481 0.68987391866066 0.12761146403187 114.818 > 55 59 In 0.62753862198814 0.68987391866066 0.12761146403187 114.818 > 55 60 In 0.96087195532147 0.68987391866066 0.12761146403187 114.818 > 55 61 In 0.29420528865481 0.18987391866066 0.46094479736520 114.818 > 55 62 In 0.62753862198814 0.18987391866066 0.46094479736520 114.818 > 55 63 In 0.96087195532147 0.18987391866066 0.46094479736520 114.818 > 55 64 In 0.29420528865481 0.68987391866066 0.46094479736520 114.818 > 55 65 In 0.62753862198814 0.68987391866066 0.46094479736520 114.818 > 55 66 In 0.96087195532147 0.68987391866066 0.46094479736520 114.818 > 55 67 In 0.29420528865481 0.18987391866066 0.79427813069853 114.818 > 55 68 In 0.62753862198814 0.18987391866066 0.79427813069853 114.818 > 55 69 In 0.96087195532147 0.18987391866066 0.79427813069853 114.818 > 55 70 In 0.29420528865481 0.68987391866066 0.79427813069853 114.818 > 55 71 In 0.62753862198814 0.68987391866066 0.79427813069853 114.818 > 55 72 In 0.96087195532147 0.68987391866066 0.79427813069853 114.818 > 55 73 S 0.00158179616609 0.17496003171275 0.00156561616841 32.065 > 73 74 S 0.33491512949943 0.17496003171275 0.00156561616841 32.065 > 73 75 S 0.66824846283276 0.17496003171275 0.00156561616841 32.065 > 73 76 S 0.00158179616609 0.67496003171275 0.00156561616841 32.065 > 73 77 S 0.33491512949943 0.67496003171275 0.00156561616841 32.065 > 73 78 S 0.66824846283276 0.67496003171275 0.00156561616841 32.065 > 73 79 S 0.00158179616609 0.17496003171275 0.33489894950174 32.065 > 73 80 S 0.33491512949943 0.17496003171275 0.33489894950174 32.065 > 73 81 S 0.66824846283276 0.17496003171275 0.33489894950174 32.065 > 73 82 S 0.00158179616609 0.67496003171275 0.33489894950174 32.065 > 73 83 S 0.33491512949943 0.67496003171275 0.33489894950174 32.065 > 73 84 S 0.66824846283276 0.67496003171275 0.33489894950174 32.065 > 73 85 S 0.00158179616609 0.17496003171275 0.66823228283508 32.065 > 73 86 S 0.33491512949943 0.17496003171275 0.66823228283508 32.065 > 73 87 S 0.66824846283276 0.17496003171275 0.66823228283508 32.065 > 73 88 S 0.00158179616609 0.67496003171275 0.66823228283508 32.065 > 73 89 S 0.33491512949943 0.67496003171275 0.66823228283508 32.065 > 73 90 S 0.66824846283276 0.67496003171275 0.66823228283508 32.065 > 73 91 S 0.33175153716724 0.42496003171275 0.16510105049826 32.065 > 91 92 S 0.66508487050057 0.42496003171275 0.16510105049826 32.065 > 91 93 S 0.99841820383391 0.42496003171275 0.16510105049826 32.065 > 91 94 S 0.33175153716724 0.92496003171275 0.16510105049826 32.065 > 91 95 S 0.66508487050057 0.92496003171275 0.16510105049826 32.065 > 91 96 S 0.99841820383391 0.92496003171275 0.16510105049826 32.065 > 91 97 S 0.33175153716724 0.42496003171275 0.49843438383159 32.065 > 91 98 S 0.66508487050057 0.42496003171275 0.49843438383159 32.065 > 91 99 S 0.99841820383391 0.42496003171275 0.49843438383159 32.065 > 91 100 S 0.33175153716724 0.92496003171275 0.49843438383159 32.065 > 91 101 S 0.66508487050057 0.92496003171275 0.49843438383159 32.065 > 91 102 S 0.99841820383391 0.92496003171275 0.49843438383159 32.065 > 91 103 S 0.33175153716724 0.42496003171275 0.83176771716492 32.065 > 91 104 S 0.66508487050057 0.42496003171275 0.83176771716492 32.065 > 91 105 S 0.99841820383391 0.42496003171275 0.83176771716492 32.065 > 91 106 S 0.33175153716724 0.92496003171275 0.83176771716492 32.065 > 91 107 S 0.66508487050057 0.92496003171275 0.83176771716492 32.065 > 91 108 S 0.99841820383391 0.92496003171275 0.83176771716492 32.065 > 91 109 S 0.33175153716724 0.32503996828725 0.33176771716492 32.065 > 109 110 S 0.66508487050057 0.32503996828725 0.33176771716492 32.065 > 109 111 S 0.99841820383391 0.32503996828725 0.33176771716492 32.065 > 109 112 S 0.33175153716724 0.82503996828725 0.33176771716492 32.065 > 109 113 S 0.66508487050057 0.82503996828725 0.33176771716492 32.065 > 109 114 S 0.99841820383391 0.82503996828725 0.33176771716492 32.065 > 109 115 S 0.33175153716724 0.32503996828725 0.66510105049826 32.065 > 109 116 S 0.66508487050057 0.32503996828725 0.66510105049826 32.065 > 109 117 S 0.99841820383391 0.32503996828725 0.66510105049826 32.065 > 109 118 S 0.33175153716724 0.82503996828725 0.66510105049826 32.065 > 109 119 S 0.66508487050057 0.82503996828725 0.66510105049826 32.065 > 109 120 S 0.99841820383391 0.82503996828725 0.66510105049826 32.065 > 109 121 S 0.33175153716724 0.32503996828725 0.99843438383159 32.065 > 109 122 S 0.66508487050057 0.32503996828725 0.99843438383159 32.065 > 109 123 S 0.99841820383391 0.32503996828725 0.99843438383159 32.065 > 109 124 S 0.33175153716724 0.82503996828725 0.99843438383159 32.065 > 109 125 S 0.66508487050057 0.82503996828725 0.99843438383159 32.065 > 109 126 S 0.99841820383391 0.82503996828725 0.99843438383159 32.065 > 109 127 S 0.00158179616609 0.07503996828725 0.16823228283508 32.065 > 127 128 S 0.33491512949943 0.07503996828725 0.16823228283508 32.065 > 127 129 S 0.66824846283276 0.07503996828725 0.16823228283508 32.065 > 127 130 S 0.00158179616609 0.57503996828725 0.16823228283508 32.065 > 127 131 S 0.33491512949943 0.57503996828725 0.16823228283508 32.065 > 127 132 S 0.66824846283276 0.57503996828725 0.16823228283508 32.065 > 127 133 S 0.00158179616609 0.07503996828725 0.50156561616841 32.065 > 127 134 S 0.33491512949943 0.07503996828725 0.50156561616841 32.065 > 127 135 S 0.66824846283276 0.07503996828725 0.50156561616841 32.065 > 127 136 S 0.00158179616609 0.57503996828725 0.50156561616841 32.065 > 127 137 S 0.33491512949943 0.57503996828725 0.50156561616841 32.065 > 127 138 S 0.66824846283276 0.57503996828725 0.50156561616841 32.065 > 127 139 S 0.00158179616609 0.07503996828725 0.83489894950174 32.065 > 127 140 S 0.33491512949943 0.07503996828725 0.83489894950174 32.065 > 127 141 S 0.66824846283276 0.07503996828725 0.83489894950174 32.065 > 127 142 S 0.00158179616609 0.57503996828725 0.83489894950174 32.065 > 127 143 S 0.33491512949943 0.57503996828725 0.83489894950174 32.065 > 127 144 S 0.66824846283276 0.57503996828725 0.83489894950174 32.065 > 127 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz". --------------------------- Dielectric constant ---------------------------- 9.8228861 0.0000000 -0.0985132 0.0000000 13.2031722 0.0000000 -0.0985124 0.0000000 9.9941847 -------------------------- Born effective charges -------------------------- 1 In 3.0694051 0.0001962 -0.0087645 0.0000400 2.8057395 -0.3058546 -0.0063708 0.4121881 2.6653309 2 In 3.0694051 -0.0001962 -0.0087645 -0.0000400 2.8057395 0.3058546 -0.0063708 -0.4121881 2.6653309 3 In 3.0694051 0.0001962 -0.0087645 0.0000400 2.8057395 -0.3058546 -0.0063708 0.4121881 2.6653309 4 In 3.0694051 -0.0001962 -0.0087645 -0.0000400 2.8057395 0.3058546 -0.0063708 -0.4121881 2.6653309 5 S -3.0694051 0.0014870 0.0087645 -0.0007072 -2.8057395 -0.3656363 0.0063708 -0.5792054 -2.6653309 6 S -3.0694051 -0.0014870 0.0087645 0.0007072 -2.8057395 0.3656363 0.0063708 0.5792054 -2.6653309 7 S -3.0694051 0.0014870 0.0087645 -0.0007072 -2.8057395 -0.3656363 0.0063708 -0.5792054 -2.6653309 8 S -3.0694051 -0.0014870 0.0087645 0.0007072 -2.8057395 0.3656363 0.0063708 0.5792054 -2.6653309 ---------------------------------------------------------------------------- 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] [-0.0068 0.0000 0.0074] [ 0.0068 0.0000 -0.0074] Computing fc3[ 73, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0068 0.0000 0.0074] [ 0.0068 0.0000 -0.0074] Expanding fc3. Symmetrizing fc3 by traditional approach (N=3). Symmetrizing fc2 by traditional approach (N=3). Max drift of fc3: 0.00000000 (yyy) 0.00000000 (yyy) 0.00000000 (yyy) fc3 was written into "fc3.hdf5". Max drift of fc2: -0.00000000 (zy) -0.00000000 (zy) fc2 was written into "fc2.hdf5". --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperatures: 0.0 300.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 ----------- None of ph-ph interaction calculation was performed. ----------- Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-08 20:45:37]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate LTC ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 20:45:37]------------------------- 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 3] Primitive matrix: [1. 0. 0.] [0. 1. 0.] [0. 0. 1.] Spacegroup: P2_1/c (14) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 3.945592377710002 0.000000000000000 0.000000000000000 b 0.000000000000000 10.709580530000000 0.000000000000000 c -3.943799610531709 0.000000000000000 4.309378225362503 Atomic positions (fractional): 1 In 0.11738413403558 0.87974783732133 0.11716560790440 114.818 2 In 0.11738413403558 0.62025216267867 0.61716560790440 114.818 3 In 0.88261586596442 0.12025216267867 0.88283439209560 114.818 4 In 0.88261586596442 0.37974783732133 0.38283439209560 114.818 5 S 0.00474538849828 0.34992006342551 0.00469684850523 32.065 6 S 0.99525461150172 0.84992006342551 0.49530315149477 32.065 7 S 0.99525461150172 0.65007993657449 0.99530315149477 32.065 8 S 0.00474538849828 0.15007993657449 0.50469684850523 32.065 -------------------------------- supercell --------------------------------- Lattice vectors: a 11.836777133130006 0.000000000000000 0.000000000000000 b 0.000000000000000 21.419161060000000 0.000000000000000 c -11.831398831595127 0.000000000000000 12.928134676087508 Atomic positions (fractional): 1 In 0.03912804467853 0.43987391866066 0.03905520263480 114.818 > 1 2 In 0.37246137801186 0.43987391866066 0.03905520263480 114.818 > 1 3 In 0.70579471134519 0.43987391866066 0.03905520263480 114.818 > 1 4 In 0.03912804467853 0.93987391866067 0.03905520263480 114.818 > 1 5 In 0.37246137801186 0.93987391866067 0.03905520263480 114.818 > 1 6 In 0.70579471134519 0.93987391866067 0.03905520263480 114.818 > 1 7 In 0.03912804467853 0.43987391866066 0.37238853596813 114.818 > 1 8 In 0.37246137801186 0.43987391866066 0.37238853596813 114.818 > 1 9 In 0.70579471134519 0.43987391866066 0.37238853596813 114.818 > 1 10 In 0.03912804467853 0.93987391866067 0.37238853596813 114.818 > 1 11 In 0.37246137801186 0.93987391866067 0.37238853596813 114.818 > 1 12 In 0.70579471134519 0.93987391866067 0.37238853596813 114.818 > 1 13 In 0.03912804467853 0.43987391866066 0.70572186930147 114.818 > 1 14 In 0.37246137801186 0.43987391866066 0.70572186930147 114.818 > 1 15 In 0.70579471134519 0.43987391866066 0.70572186930147 114.818 > 1 16 In 0.03912804467853 0.93987391866067 0.70572186930147 114.818 > 1 17 In 0.37246137801186 0.93987391866067 0.70572186930147 114.818 > 1 18 In 0.70579471134519 0.93987391866067 0.70572186930147 114.818 > 1 19 In 0.03912804467853 0.31012608133934 0.20572186930147 114.818 > 19 20 In 0.37246137801186 0.31012608133934 0.20572186930147 114.818 > 19 21 In 0.70579471134519 0.31012608133934 0.20572186930147 114.818 > 19 22 In 0.03912804467853 0.81012608133933 0.20572186930147 114.818 > 19 23 In 0.37246137801186 0.81012608133933 0.20572186930147 114.818 > 19 24 In 0.70579471134519 0.81012608133933 0.20572186930147 114.818 > 19 25 In 0.03912804467853 0.31012608133934 0.53905520263480 114.818 > 19 26 In 0.37246137801186 0.31012608133934 0.53905520263480 114.818 > 19 27 In 0.70579471134519 0.31012608133934 0.53905520263480 114.818 > 19 28 In 0.03912804467853 0.81012608133933 0.53905520263480 114.818 > 19 29 In 0.37246137801186 0.81012608133933 0.53905520263480 114.818 > 19 30 In 0.70579471134519 0.81012608133933 0.53905520263480 114.818 > 19 31 In 0.03912804467853 0.31012608133934 0.87238853596813 114.818 > 19 32 In 0.37246137801186 0.31012608133934 0.87238853596813 114.818 > 19 33 In 0.70579471134519 0.31012608133934 0.87238853596813 114.818 > 19 34 In 0.03912804467853 0.81012608133933 0.87238853596813 114.818 > 19 35 In 0.37246137801186 0.81012608133933 0.87238853596813 114.818 > 19 36 In 0.70579471134519 0.81012608133933 0.87238853596813 114.818 > 19 37 In 0.29420528865481 0.06012608133934 0.29427813069853 114.818 > 37 38 In 0.62753862198814 0.06012608133934 0.29427813069853 114.818 > 37 39 In 0.96087195532147 0.06012608133934 0.29427813069853 114.818 > 37 40 In 0.29420528865481 0.56012608133934 0.29427813069853 114.818 > 37 41 In 0.62753862198814 0.56012608133934 0.29427813069853 114.818 > 37 42 In 0.96087195532147 0.56012608133934 0.29427813069853 114.818 > 37 43 In 0.29420528865481 0.06012608133934 0.62761146403187 114.818 > 37 44 In 0.62753862198814 0.06012608133934 0.62761146403187 114.818 > 37 45 In 0.96087195532147 0.06012608133934 0.62761146403187 114.818 > 37 46 In 0.29420528865481 0.56012608133934 0.62761146403187 114.818 > 37 47 In 0.62753862198814 0.56012608133934 0.62761146403187 114.818 > 37 48 In 0.96087195532147 0.56012608133934 0.62761146403187 114.818 > 37 49 In 0.29420528865481 0.06012608133934 0.96094479736520 114.818 > 37 50 In 0.62753862198814 0.06012608133934 0.96094479736520 114.818 > 37 51 In 0.96087195532147 0.06012608133934 0.96094479736520 114.818 > 37 52 In 0.29420528865481 0.56012608133934 0.96094479736520 114.818 > 37 53 In 0.62753862198814 0.56012608133934 0.96094479736520 114.818 > 37 54 In 0.96087195532147 0.56012608133934 0.96094479736520 114.818 > 37 55 In 0.29420528865481 0.18987391866066 0.12761146403187 114.818 > 55 56 In 0.62753862198814 0.18987391866066 0.12761146403187 114.818 > 55 57 In 0.96087195532147 0.18987391866066 0.12761146403187 114.818 > 55 58 In 0.29420528865481 0.68987391866066 0.12761146403187 114.818 > 55 59 In 0.62753862198814 0.68987391866066 0.12761146403187 114.818 > 55 60 In 0.96087195532147 0.68987391866066 0.12761146403187 114.818 > 55 61 In 0.29420528865481 0.18987391866066 0.46094479736520 114.818 > 55 62 In 0.62753862198814 0.18987391866066 0.46094479736520 114.818 > 55 63 In 0.96087195532147 0.18987391866066 0.46094479736520 114.818 > 55 64 In 0.29420528865481 0.68987391866066 0.46094479736520 114.818 > 55 65 In 0.62753862198814 0.68987391866066 0.46094479736520 114.818 > 55 66 In 0.96087195532147 0.68987391866066 0.46094479736520 114.818 > 55 67 In 0.29420528865481 0.18987391866066 0.79427813069853 114.818 > 55 68 In 0.62753862198814 0.18987391866066 0.79427813069853 114.818 > 55 69 In 0.96087195532147 0.18987391866066 0.79427813069853 114.818 > 55 70 In 0.29420528865481 0.68987391866066 0.79427813069853 114.818 > 55 71 In 0.62753862198814 0.68987391866066 0.79427813069853 114.818 > 55 72 In 0.96087195532147 0.68987391866066 0.79427813069853 114.818 > 55 73 S 0.00158179616609 0.17496003171275 0.00156561616841 32.065 > 73 74 S 0.33491512949943 0.17496003171275 0.00156561616841 32.065 > 73 75 S 0.66824846283276 0.17496003171275 0.00156561616841 32.065 > 73 76 S 0.00158179616609 0.67496003171275 0.00156561616841 32.065 > 73 77 S 0.33491512949943 0.67496003171275 0.00156561616841 32.065 > 73 78 S 0.66824846283276 0.67496003171275 0.00156561616841 32.065 > 73 79 S 0.00158179616609 0.17496003171275 0.33489894950174 32.065 > 73 80 S 0.33491512949943 0.17496003171275 0.33489894950174 32.065 > 73 81 S 0.66824846283276 0.17496003171275 0.33489894950174 32.065 > 73 82 S 0.00158179616609 0.67496003171275 0.33489894950174 32.065 > 73 83 S 0.33491512949943 0.67496003171275 0.33489894950174 32.065 > 73 84 S 0.66824846283276 0.67496003171275 0.33489894950174 32.065 > 73 85 S 0.00158179616609 0.17496003171275 0.66823228283508 32.065 > 73 86 S 0.33491512949943 0.17496003171275 0.66823228283508 32.065 > 73 87 S 0.66824846283276 0.17496003171275 0.66823228283508 32.065 > 73 88 S 0.00158179616609 0.67496003171275 0.66823228283508 32.065 > 73 89 S 0.33491512949943 0.67496003171275 0.66823228283508 32.065 > 73 90 S 0.66824846283276 0.67496003171275 0.66823228283508 32.065 > 73 91 S 0.33175153716724 0.42496003171275 0.16510105049826 32.065 > 91 92 S 0.66508487050057 0.42496003171275 0.16510105049826 32.065 > 91 93 S 0.99841820383391 0.42496003171275 0.16510105049826 32.065 > 91 94 S 0.33175153716724 0.92496003171275 0.16510105049826 32.065 > 91 95 S 0.66508487050057 0.92496003171275 0.16510105049826 32.065 > 91 96 S 0.99841820383391 0.92496003171275 0.16510105049826 32.065 > 91 97 S 0.33175153716724 0.42496003171275 0.49843438383159 32.065 > 91 98 S 0.66508487050057 0.42496003171275 0.49843438383159 32.065 > 91 99 S 0.99841820383391 0.42496003171275 0.49843438383159 32.065 > 91 100 S 0.33175153716724 0.92496003171275 0.49843438383159 32.065 > 91 101 S 0.66508487050057 0.92496003171275 0.49843438383159 32.065 > 91 102 S 0.99841820383391 0.92496003171275 0.49843438383159 32.065 > 91 103 S 0.33175153716724 0.42496003171275 0.83176771716492 32.065 > 91 104 S 0.66508487050057 0.42496003171275 0.83176771716492 32.065 > 91 105 S 0.99841820383391 0.42496003171275 0.83176771716492 32.065 > 91 106 S 0.33175153716724 0.92496003171275 0.83176771716492 32.065 > 91 107 S 0.66508487050057 0.92496003171275 0.83176771716492 32.065 > 91 108 S 0.99841820383391 0.92496003171275 0.83176771716492 32.065 > 91 109 S 0.33175153716724 0.32503996828725 0.33176771716492 32.065 > 109 110 S 0.66508487050057 0.32503996828725 0.33176771716492 32.065 > 109 111 S 0.99841820383391 0.32503996828725 0.33176771716492 32.065 > 109 112 S 0.33175153716724 0.82503996828725 0.33176771716492 32.065 > 109 113 S 0.66508487050057 0.82503996828725 0.33176771716492 32.065 > 109 114 S 0.99841820383391 0.82503996828725 0.33176771716492 32.065 > 109 115 S 0.33175153716724 0.32503996828725 0.66510105049826 32.065 > 109 116 S 0.66508487050057 0.32503996828725 0.66510105049826 32.065 > 109 117 S 0.99841820383391 0.32503996828725 0.66510105049826 32.065 > 109 118 S 0.33175153716724 0.82503996828725 0.66510105049826 32.065 > 109 119 S 0.66508487050057 0.82503996828725 0.66510105049826 32.065 > 109 120 S 0.99841820383391 0.82503996828725 0.66510105049826 32.065 > 109 121 S 0.33175153716724 0.32503996828725 0.99843438383159 32.065 > 109 122 S 0.66508487050057 0.32503996828725 0.99843438383159 32.065 > 109 123 S 0.99841820383391 0.32503996828725 0.99843438383159 32.065 > 109 124 S 0.33175153716724 0.82503996828725 0.99843438383159 32.065 > 109 125 S 0.66508487050057 0.82503996828725 0.99843438383159 32.065 > 109 126 S 0.99841820383391 0.82503996828725 0.99843438383159 32.065 > 109 127 S 0.00158179616609 0.07503996828725 0.16823228283508 32.065 > 127 128 S 0.33491512949943 0.07503996828725 0.16823228283508 32.065 > 127 129 S 0.66824846283276 0.07503996828725 0.16823228283508 32.065 > 127 130 S 0.00158179616609 0.57503996828725 0.16823228283508 32.065 > 127 131 S 0.33491512949943 0.57503996828725 0.16823228283508 32.065 > 127 132 S 0.66824846283276 0.57503996828725 0.16823228283508 32.065 > 127 133 S 0.00158179616609 0.07503996828725 0.50156561616841 32.065 > 127 134 S 0.33491512949943 0.07503996828725 0.50156561616841 32.065 > 127 135 S 0.66824846283276 0.07503996828725 0.50156561616841 32.065 > 127 136 S 0.00158179616609 0.57503996828725 0.50156561616841 32.065 > 127 137 S 0.33491512949943 0.57503996828725 0.50156561616841 32.065 > 127 138 S 0.66824846283276 0.57503996828725 0.50156561616841 32.065 > 127 139 S 0.00158179616609 0.07503996828725 0.83489894950174 32.065 > 127 140 S 0.33491512949943 0.07503996828725 0.83489894950174 32.065 > 127 141 S 0.66824846283276 0.07503996828725 0.83489894950174 32.065 > 127 142 S 0.00158179616609 0.57503996828725 0.83489894950174 32.065 > 127 143 S 0.33491512949943 0.57503996828725 0.83489894950174 32.065 > 127 144 S 0.66824846283276 0.57503996828725 0.83489894950174 32.065 > 127 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py.yaml". --------------------------- Dielectric constant ---------------------------- 9.8228861 0.0000000 -0.0985132 0.0000000 13.2031722 0.0000000 -0.0985124 0.0000000 9.9941847 -------------------------- Born effective charges -------------------------- 1 In 3.0694051 0.0001962 -0.0087645 0.0000400 2.8057395 -0.3058546 -0.0063708 0.4121881 2.6653309 2 In 3.0694051 -0.0001962 -0.0087645 -0.0000400 2.8057395 0.3058546 -0.0063708 -0.4121881 2.6653309 3 In 3.0694051 0.0001962 -0.0087645 0.0000400 2.8057395 -0.3058546 -0.0063708 0.4121881 2.6653309 4 In 3.0694051 -0.0001962 -0.0087645 -0.0000400 2.8057395 0.3058546 -0.0063708 -0.4121881 2.6653309 5 S -3.0694051 0.0014870 0.0087645 -0.0007072 -2.8057395 -0.3656363 0.0063708 -0.5792054 -2.6653309 6 S -3.0694051 -0.0014870 0.0087645 0.0007072 -2.8057395 0.3656363 0.0063708 0.5792054 -2.6653309 7 S -3.0694051 0.0014870 0.0087645 -0.0007072 -2.8057395 -0.3656363 0.0063708 -0.5792054 -2.6653309 8 S -3.0694051 -0.0014870 0.0087645 0.0007072 -2.8057395 0.3656363 0.0063708 0.5792054 -2.6653309 ---------------------------------------------------------------------------- fc3 was read from "fc3.hdf5". fc2 was read from "fc2.hdf5". ----------------------------- Force constants ------------------------------ Max drift of fc3: 0.00000000 (yyy) 0.00000000 (yyy) 0.00000000 (yyy) Max drift of fc2: 0.00000000 (yy) 0.00000000 (yy) --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperature: 0.0 10.0 20.0 30.0 40.0 ... 1000.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 Length for sampling mesh generation: 50.00 Generating grid system ... [ 17 5 12 ] fc3-r2q-transformation over three atoms: True --------------------------- Phonon calculations ---------------------------- Use NAC by Gonze et al. (no real space sum in current implementation) PRB 50, 13035(R) (1994), PRB 55, 10355 (1997) G-cutoff distance: 0.73, Number of G-points: 293, Lambda: 0.25 Running harmonic phonon calculations... -------------------- Lattice thermal conductivity (RTA) -------------------- ======================= Grid point 0 (1/309) ======================= q-point: ( 0.00 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 309 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 1.204 ( 0.000 0.000 0.000) 0.000 1.629 ( 0.000 0.000 0.000) 0.000 1.858 ( 0.000 0.000 0.000) 0.000 1.882 ( 0.000 0.000 0.000) 0.000 2.137 ( 0.000 0.000 0.000) 0.000 2.515 ( 0.000 0.000 0.000) 0.000 2.953 ( 0.000 0.000 0.000) 0.000 4.355 ( 0.000 0.000 0.000) 0.000 4.556 ( 0.000 0.000 0.000) 0.000 5.508 ( 0.000 0.000 0.000) 0.000 6.024 ( 0.000 0.000 0.000) 0.000 6.077 ( 0.000 0.000 0.000) 0.000 6.322 ( 0.000 0.000 0.000) 0.000 6.896 ( 0.000 0.000 0.000) 0.000 7.237 ( 0.000 0.000 0.000) 0.000 7.794 ( 0.000 0.000 0.000) 0.000 7.797 ( 0.000 0.000 0.000) 0.000 7.856 ( 0.000 0.000 0.000) 0.000 8.491 ( 0.000 0.000 0.000) 0.000 9.082 ( 0.000 0.000 0.000) 0.000 9.535 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 1 (2/309) ======================= q-point: ( 0.06 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 309 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.252 ( 5.359 0.000 13.891) 14.889 0.456 ( 13.459 0.000 17.761) 22.285 0.647 ( 29.972 0.000 14.849) 33.448 1.315 ( 12.365 0.000 1.623) 12.471 1.614 ( -0.009 0.000 -1.647) 1.647 1.886 ( 6.646 0.000 -0.932) 6.711 1.970 ( 4.460 0.000 0.573) 4.497 2.125 ( 4.564 0.000 -1.963) 4.969 2.574 ( 0.812 0.000 6.305) 6.357 2.986 ( -4.758 0.000 3.390) 5.843 4.406 ( 2.728 0.000 3.555) 4.481 4.583 ( 1.228 0.000 2.523) 2.806 5.650 ( -14.536 0.000 15.388) 21.169 6.185 ( 8.131 0.000 3.209) 8.741 6.360 ( 3.213 0.000 4.436) 5.477 6.890 ( -1.217 0.000 0.393) 1.279 7.181 ( -3.795 0.000 -3.152) 4.933 7.726 ( 41.248 0.000 -44.543) 60.708 7.808 ( 1.985 0.000 -0.092) 1.987 7.830 ( 4.724 0.000 -1.031) 4.835 7.887 ( 0.824 0.000 3.404) 3.502 8.933 ( -12.394 0.000 10.272) 16.098 9.103 ( 2.054 0.000 0.489) 2.111 9.518 ( -1.118 0.000 -1.307) 1.720 ======================= Grid point 2 (3/309) ======================= q-point: ( 0.12 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 309 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.540 ( 9.849 0.000 11.401) 15.066 0.873 ( 11.914 0.000 15.241) 19.345 1.273 ( 25.431 0.000 13.166) 28.637 1.556 ( 12.456 0.000 0.363) 12.461 1.635 ( 8.231 0.000 3.439) 8.920 1.933 ( -1.676 0.000 -3.597) 3.969 2.020 ( 10.721 0.000 -1.193) 10.787 2.295 ( 13.761 0.000 2.315) 13.955 2.674 ( 0.648 0.000 5.844) 5.880 2.968 ( -1.868 0.000 1.457) 2.369 4.505 ( 3.265 0.000 3.642) 4.891 4.652 ( 1.784 0.000 3.831) 4.226 5.651 ( -7.088 0.000 8.511) 11.076 6.280 ( 2.052 0.000 0.519) 2.117 6.611 ( 13.981 0.000 10.529) 17.502 6.871 ( -2.064 0.000 0.465) 2.116 7.067 ( -4.262 0.000 -4.022) 5.860 7.735 ( 18.691 0.000 -19.757) 27.197 7.846 ( 3.290 0.000 -0.335) 3.307 7.896 ( 6.462 0.000 -1.780) 6.703 7.956 ( 0.808 0.000 4.416) 4.489 8.875 ( -7.625 0.000 3.251) 8.289 9.146 ( 2.807 0.000 0.106) 2.809 9.467 ( -2.110 0.000 -2.563) 3.320 ======================= Grid point 3 (4/309) ======================= q-point: ( 0.18 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 309 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.845 ( 12.348 0.000 8.545) 15.017 1.216 ( 9.397 0.000 11.217) 14.633 1.556 ( 3.872 0.000 1.784) 4.263 1.787 ( 15.557 0.000 3.277) 15.898 1.857 ( -1.821 0.000 -2.768) 3.313 2.021 ( 21.499 0.000 12.597) 24.918 2.156 ( 8.638 0.000 -1.347) 8.742 2.528 ( 13.417 0.000 1.123) 13.464 2.738 ( 0.799 0.000 1.925) 2.084 2.966 ( 0.232 0.000 -0.218) 0.318 4.593 ( 3.100 0.000 2.276) 3.846 4.727 ( 1.289 0.000 3.332) 3.572 5.668 ( -4.066 0.000 6.097) 7.328 6.299 ( 0.359 0.000 -0.001) 0.359 6.838 ( -2.755 0.000 -0.254) 2.766 6.954 ( -3.405 0.000 -4.191) 5.400 6.976 ( 14.327 0.000 10.264) 17.625 7.743 ( 10.621 0.000 -10.976) 15.274 7.892 ( 3.546 0.000 -0.554) 3.589 7.960 ( 5.748 0.000 -2.756) 6.375 8.032 ( 1.162 0.000 4.800) 4.939 8.798 ( -5.830 0.000 0.254) 5.835 9.181 ( 2.323 0.000 -0.802) 2.458 9.386 ( -2.881 0.000 -3.765) 4.741 ======================= Grid point 4 (5/309) ======================= q-point: ( 0.24 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 309 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.132 ( 12.553 0.000 6.015) 13.920 1.447 ( 5.898 0.000 5.510) 8.071 1.631 ( 2.638 0.000 2.593) 3.699 1.823 ( -0.137 0.000 0.654) 0.668 2.008 ( 9.084 0.000 2.274) 9.365 2.215 ( 1.748 0.000 -2.038) 2.685 2.463 ( 15.447 0.000 8.599) 17.679 2.689 ( 8.470 0.000 -4.055) 9.391 2.777 ( 4.512 0.000 0.635) 4.557 2.971 ( 2.905 0.000 -1.857) 3.448 4.657 ( 2.591 0.000 0.757) 2.699 4.772 ( 0.081 0.000 1.524) 1.526 5.694 ( -2.165 0.000 4.316) 4.829 6.292 ( -0.310 0.000 -1.040) 1.085 6.772 ( -3.878 0.000 -2.617) 4.678 6.847 ( -3.010 0.000 -4.733) 5.609 7.293 ( 10.847 0.000 8.329) 13.676 7.754 ( 6.607 0.000 -6.192) 9.055 7.934 ( 3.145 0.000 -0.680) 3.218 7.990 ( 3.023 0.000 -2.245) 3.766 8.120 ( 2.505 0.000 3.842) 4.587 8.710 ( -4.645 0.000 -1.637) 4.925 9.188 ( 1.209 0.000 -2.031) 2.364 9.284 ( -2.996 0.000 -4.523) 5.425 ======================= Grid point 5 (6/309) ======================= q-point: ( 0.29 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 309 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.375 ( 10.639 0.000 3.987) 11.361 1.554 ( 3.455 0.000 1.607) 3.811 1.699 ( 1.512 0.000 2.580) 2.991 1.870 ( 1.614 0.000 3.306) 3.679 2.122 ( 2.754 0.000 1.637) 3.204 2.151 ( -4.911 0.000 -2.976) 5.743 2.656 ( 3.724 0.000 -1.117) 3.888 2.693 ( 4.557 0.000 -7.003) 8.355 2.877 ( 6.296 0.000 -0.139) 6.298 3.030 ( 7.097 0.000 -0.887) 7.152 4.689 ( 1.525 0.000 -0.726) 1.689 4.771 ( -1.051 0.000 -0.521) 1.173 5.719 ( -0.874 0.000 2.663) 2.803 6.265 ( -0.408 0.000 -2.077) 2.116 6.644 ( -5.213 0.000 -6.384) 8.241 6.723 ( -4.283 0.000 -5.997) 7.369 7.523 ( 6.781 0.000 6.194) 9.184 7.778 ( 4.858 0.000 -2.533) 5.478 7.963 ( 1.961 0.000 -1.183) 2.290 7.998 ( 1.556 0.000 -0.778) 1.740 8.204 ( 2.566 0.000 2.620) 3.667 8.614 ( -4.064 0.000 -3.026) 5.067 9.164 ( 0.330 0.000 -2.955) 2.973 9.186 ( -1.831 0.000 -4.026) 4.423 ======================= Grid point 6 (7/309) ======================= q-point: ( 0.35 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 309 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.543 ( 5.083 0.000 2.455) 5.645 1.638 ( 4.534 0.000 2.821) 5.340 1.751 ( 2.619 0.000 1.369) 2.955 1.887 ( -2.631 0.000 -2.959) 3.959 2.059 ( -3.176 0.000 2.222) 3.876 2.142 ( -2.224 0.000 1.207) 2.530 2.616 ( -0.548 0.000 -5.853) 5.879 2.653 ( 2.297 0.000 -6.134) 6.550 2.945 ( 4.263 0.000 -1.449) 4.502 3.094 ( 3.974 0.000 -3.362) 5.205 4.683 ( 0.255 0.000 -1.816) 1.834 4.732 ( -1.558 0.000 -1.948) 2.494 5.738 ( -0.239 0.000 1.308) 1.330 6.230 ( 0.063 0.000 -2.307) 2.308 6.447 ( -6.462 0.000 -9.298) 11.324 6.552 ( -5.967 0.000 -7.473) 9.563 7.667 ( 3.570 0.000 3.915) 5.298 7.837 ( 4.559 0.000 1.003) 4.668 7.951 ( -0.422 0.000 -1.667) 1.720 8.028 ( 1.983 0.000 0.751) 2.121 8.266 ( 2.122 0.000 1.437) 2.563 8.504 ( -4.266 0.000 -4.116) 5.928 9.126 ( 0.188 0.000 -2.957) 2.963 9.129 ( 0.029 0.000 -2.321) 2.321 ======================= Grid point 7 (8/309) ======================= q-point: ( 0.41 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 309 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.583 ( -1.722 0.000 1.005) 1.994 1.733 ( 0.091 0.000 -2.246) 2.248 1.803 ( 2.057 0.000 2.539) 3.267 1.834 ( 6.335 0.000 0.463) 6.352 2.081 ( -1.587 0.000 3.157) 3.533 2.100 ( -5.010 0.000 0.927) 5.095 2.519 ( -1.314 0.000 -5.480) 5.635 2.600 ( 0.152 0.000 -4.039) 4.042 2.970 ( 2.296 0.000 -1.771) 2.900 3.059 ( 0.320 0.000 -5.419) 5.428 4.654 ( -0.470 0.000 -1.877) 1.935 4.681 ( -1.271 0.000 -2.119) 2.471 5.748 ( -0.109 0.000 0.467) 0.480 6.208 ( 0.528 0.000 -1.618) 1.702 6.219 ( -6.236 0.000 -9.077) 11.013 6.362 ( -5.583 0.000 -6.675) 8.702 7.749 ( 1.882 0.000 2.415) 3.062 7.920 ( -0.939 0.000 -1.054) 1.412 7.935 ( 4.544 0.000 3.077) 5.488 8.067 ( 1.527 0.000 0.882) 1.764 8.307 ( 1.483 0.000 0.623) 1.609 8.374 ( -4.871 0.000 -4.771) 6.818 9.095 ( 0.393 0.000 -2.030) 2.068 9.118 ( 0.946 0.000 -0.770) 1.219 ======================= Grid point 8 (9/309) ======================= q-point: ( 0.47 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 309 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.561 ( -1.457 0.000 0.214) 1.473 1.668 ( -1.125 0.000 -1.642) 1.990 1.934 ( 6.289 0.000 -0.023) 6.289 1.943 ( 5.729 0.000 4.051) 7.016 2.027 ( -5.795 0.000 0.520) 5.818 2.062 ( -3.767 0.000 -0.428) 3.792 2.446 ( -0.771 0.000 -2.242) 2.371 2.559 ( -0.299 0.000 -1.394) 1.426 2.973 ( 0.701 0.000 -0.815) 1.075 2.994 ( -0.341 0.000 -2.724) 2.745 4.628 ( -0.299 0.000 -0.787) 0.842 4.646 ( -0.445 0.000 -0.886) 0.991 5.750 ( -0.058 0.000 0.094) 0.110 6.053 ( -2.748 0.000 -3.950) 4.812 6.200 ( 0.317 0.000 -0.550) 0.635 6.233 ( -2.293 0.000 -2.695) 3.538 7.791 ( 0.595 0.000 0.917) 1.093 7.900 ( -0.405 0.000 -0.337) 0.527 8.049 ( 4.090 0.000 3.363) 5.295 8.092 ( 0.571 0.000 0.371) 0.681 8.239 ( -4.319 0.000 -3.995) 5.883 8.328 ( 0.547 0.000 0.168) 0.572 9.082 ( 0.233 0.000 -0.694) 0.732 9.125 ( 0.498 0.000 -0.114) 0.511 ======================= Grid point 17 (10/309) ======================= q-point: ( 0.00 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 309 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.381 ( 0.000 19.662 0.000) 19.662 0.452 ( 0.000 23.470 0.000) 23.470 0.844 ( 0.000 40.478 0.000) 40.478 1.149 ( 0.000 -5.908 0.000) 5.908 1.565 ( 0.000 -4.581 0.000) 4.581 1.861 ( 0.000 0.231 0.000) 0.231 1.880 ( 0.000 -0.263 0.000) 0.263 2.255 ( 0.000 5.150 0.000) 5.150 2.466 ( 0.000 -5.480 0.000) 5.480 2.846 ( 0.000 -11.167 0.000) 11.167 4.338 ( 0.000 -1.485 0.000) 1.485 4.489 ( 0.000 -6.164 0.000) 6.164 5.598 ( 0.000 8.888 0.000) 8.888 6.030 ( 0.000 0.580 0.000) 0.580 6.072 ( 0.000 -0.475 0.000) 0.475 6.242 ( 0.000 -8.121 0.000) 8.121 7.243 ( 0.000 0.560 0.000) 0.560 7.265 ( 0.000 0.026 0.000) 0.026 7.793 ( 0.000 -0.077 0.000) 0.077 7.795 ( 0.000 -0.132 0.000) 0.132 8.529 ( 0.000 4.141 0.000) 4.141 8.939 ( 0.000 -2.068 0.000) 2.068 9.073 ( 0.000 2.247 0.000) 2.247 9.490 ( 0.000 -4.725 0.000) 4.725 ======================= Grid point 18 (11/309) ======================= q-point: ( 0.06 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 511 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.349 ( 5.233 20.686 -6.168) 22.211 0.595 ( 16.683 12.696 6.884) 22.066 1.096 ( 12.387 28.180 14.001) 33.817 1.238 ( 11.722 -7.298 1.242) 13.864 1.516 ( -1.871 -4.090 -1.650) 4.791 1.901 ( 7.135 1.421 -0.242) 7.279 1.970 ( 6.048 -0.229 1.233) 6.176 2.177 ( 1.563 5.174 -3.117) 6.240 2.537 ( 0.739 -4.087 6.432) 7.656 2.854 ( -1.765 -12.687 2.518) 13.055 4.373 ( 2.328 -2.299 3.002) 4.441 4.527 ( 0.551 -5.796 3.396) 6.740 5.685 ( -7.942 4.786 11.173) 14.520 6.159 ( 3.767 -4.998 1.026) 6.342 6.255 ( 10.169 -6.143 7.905) 14.270 6.558 ( 29.033 -18.236 6.144) 34.831 7.189 ( -3.853 0.866 -2.809) 4.846 7.276 ( 5.132 -6.174 -2.884) 8.531 7.811 ( 2.329 0.160 -0.044) 2.335 7.829 ( 4.694 -0.345 -0.897) 4.791 8.414 ( 1.393 15.623 -11.986) 19.740 8.993 ( -1.516 0.316 5.692) 5.899 9.017 ( -3.418 -1.368 -0.929) 3.797 9.477 ( -1.361 -4.585 -0.686) 4.831 ======================= Grid point 19 (12/309) ======================= q-point: ( 0.12 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 511 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.536 ( 14.218 5.757 6.971) 16.849 0.966 ( 15.086 7.742 10.304) 19.842 1.446 ( 9.411 -10.948 1.971) 14.570 1.462 ( 12.514 -3.740 3.102) 13.425 1.592 ( 14.145 17.044 10.175) 24.374 1.985 ( -0.560 3.622 -1.272) 3.880 2.048 ( 10.845 2.886 -0.630) 11.240 2.308 ( 13.052 1.638 2.426) 13.376 2.622 ( 0.376 -5.293 4.128) 6.723 2.886 ( 0.638 -8.584 3.760) 9.393 4.464 ( 3.026 -3.379 3.581) 5.779 4.591 ( 1.159 -5.973 3.871) 7.212 5.705 ( -5.293 5.563 7.104) 10.461 6.195 ( 0.659 -8.155 1.019) 8.245 6.593 ( 15.579 -0.442 10.488) 18.786 6.856 ( 5.089 -3.247 2.298) 6.459 7.079 ( -4.211 1.377 -3.641) 5.734 7.370 ( 12.724 -17.373 -3.506) 21.818 7.855 ( 3.299 0.372 0.049) 3.320 7.893 ( 5.898 -0.709 -1.790) 6.205 8.316 ( 1.974 19.348 -6.264) 20.433 8.925 ( -6.403 4.348 0.603) 7.764 9.067 ( 2.741 -6.371 1.327) 7.062 9.430 ( -2.430 -4.266 -2.071) 5.329 ======================= Grid point 20 (13/309) ======================= q-point: ( 0.18 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 511 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.861 ( 15.331 3.731 6.992) 17.258 1.278 ( 9.311 3.310 7.824) 12.604 1.538 ( 4.325 -3.754 4.681) 7.397 1.743 ( 14.974 -4.237 2.896) 15.829 1.885 ( 2.483 5.715 -0.827) 6.286 2.057 ( 12.265 3.241 7.500) 14.737 2.203 ( 10.305 4.869 1.258) 11.467 2.540 ( 12.807 0.998 1.818) 12.973 2.669 ( 2.447 -5.632 0.478) 6.160 2.955 ( 2.125 -2.139 2.470) 3.897 4.549 ( 2.800 -3.870 2.454) 5.371 4.657 ( 1.025 -6.583 3.150) 7.369 5.726 ( -3.329 5.749 5.315) 8.508 6.212 ( -0.006 -8.098 0.656) 8.125 6.858 ( -0.752 1.539 0.625) 1.823 6.925 ( 1.823 -1.485 0.393) 2.384 7.026 ( 7.890 3.819 4.496) 9.851 7.513 ( 11.127 -14.873 -2.666) 18.765 7.905 ( 3.153 0.398 0.175) 3.183 7.950 ( 5.480 -0.997 -2.364) 6.051 8.288 ( 1.590 18.114 -2.100) 18.304 8.838 ( -4.994 3.745 -0.902) 6.307 9.112 ( 2.160 -6.199 -0.262) 6.569 9.350 ( -3.172 -4.150 -3.482) 6.277 ======================= Grid point 21 (14/309) ======================= q-point: ( 0.24 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 511 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.165 ( 14.316 4.038 4.823) 15.637 1.463 ( 5.704 -0.813 3.998) 7.013 1.683 ( 3.439 6.029 5.436) 8.816 1.862 ( -0.679 3.996 -0.080) 4.054 1.969 ( 9.504 -3.736 2.873) 10.609 2.183 ( 0.473 -3.640 -1.438) 3.942 2.467 ( 13.463 1.352 4.089) 14.135 2.706 ( 7.713 -4.802 -0.011) 9.086 2.739 ( 7.845 4.104 -1.157) 8.929 3.007 ( 3.094 1.925 -0.233) 3.651 4.610 ( 2.155 -4.275 0.929) 4.876 4.699 ( 0.141 -6.852 1.427) 7.000 5.748 ( -1.972 5.442 3.701) 6.870 6.210 ( -0.501 -7.689 -0.518) 7.723 6.797 ( -3.772 1.910 -2.989) 5.178 6.845 ( -3.106 -0.240 -4.608) 5.562 7.306 ( 10.806 1.502 7.813) 13.419 7.622 ( 7.603 -9.315 -1.624) 12.133 7.951 ( 2.567 0.486 0.242) 2.623 7.988 ( 4.086 -0.750 -2.590) 4.895 8.300 ( 1.505 15.646 0.266) 15.721 8.752 ( -3.738 4.131 -2.139) 5.968 9.122 ( 1.000 -6.424 -1.811) 6.749 9.245 ( -3.274 -4.295 -4.459) 7.003 ======================= Grid point 22 (15/309) ======================= q-point: ( 0.29 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 511 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.412 ( 11.378 3.818 2.994) 12.370 1.578 ( 4.301 1.094 2.302) 4.999 1.741 ( -0.102 4.392 0.866) 4.477 1.897 ( 0.611 2.440 2.781) 3.750 2.086 ( 0.049 -3.104 0.491) 3.143 2.131 ( -0.786 -1.974 0.019) 2.124 2.606 ( 6.128 -1.214 -3.548) 7.184 2.778 ( 3.204 2.128 -4.477) 5.902 2.846 ( 7.432 0.534 0.753) 7.489 3.057 ( 5.117 1.702 -1.584) 5.621 4.636 ( 0.971 -4.866 -0.635) 5.002 4.699 ( -0.925 -6.742 -0.509) 6.824 5.766 ( -0.946 4.697 2.051) 5.212 6.184 ( -0.719 -7.367 -1.861) 7.633 6.668 ( -4.912 1.799 -6.364) 8.238 6.718 ( -4.202 -0.468 -6.316) 7.601 7.533 ( 6.965 1.082 6.118) 9.333 7.706 ( 5.462 -5.176 0.113) 7.526 7.989 ( 1.929 0.721 0.317) 2.084 8.001 ( 2.139 0.130 -2.153) 3.038 8.333 ( 1.594 12.840 1.003) 12.978 8.666 ( -3.153 5.198 -3.205) 6.873 9.096 ( 0.109 -6.736 -2.808) 7.299 9.142 ( -2.124 -4.853 -4.211) 6.767 ======================= Grid point 23 (16/309) ======================= q-point: ( 0.35 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 511 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.574 ( 5.176 3.095 1.945) 6.336 1.667 ( 4.060 2.132 1.851) 4.945 1.761 ( 2.151 0.848 1.176) 2.594 1.858 ( -3.968 -2.837 -4.013) 6.316 2.078 ( -1.232 2.667 4.044) 4.999 2.156 ( -1.186 0.962 1.635) 2.238 2.603 ( 2.006 0.392 -5.109) 5.502 2.715 ( -0.388 3.813 -6.429) 7.485 2.931 ( 4.481 -0.654 -1.270) 4.703 3.086 ( 3.097 -0.899 -4.068) 5.191 4.623 ( -0.309 -5.607 -1.780) 5.891 4.662 ( -1.574 -6.622 -1.891) 7.065 5.775 ( -0.423 3.690 0.684) 3.777 6.141 ( -0.763 -7.503 -2.740) 8.024 6.483 ( -5.819 2.267 -8.513) 10.558 6.546 ( -5.351 -0.553 -7.988) 9.630 7.682 ( 3.851 1.499 4.160) 5.864 7.800 ( 4.700 -2.547 2.711) 5.994 7.987 ( 0.514 2.062 -1.875) 2.834 8.028 ( 1.566 -0.096 0.915) 1.816 8.368 ( 1.507 10.613 0.656) 10.740 8.565 ( -3.571 6.317 -4.224) 8.396 9.062 ( 0.460 -6.651 -2.446) 7.101 9.073 ( -0.654 -5.922 -2.973) 6.658 ======================= Grid point 24 (17/309) ======================= q-point: ( 0.41 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 511 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.611 ( -1.455 2.759 0.703) 3.198 1.728 ( -0.816 -0.691 -2.730) 2.932 1.787 ( 2.793 -1.021 3.197) 4.366 1.842 ( 5.461 -0.009 0.739) 5.510 2.116 ( -1.560 3.572 3.379) 5.159 2.135 ( -3.409 3.431 0.896) 4.919 2.538 ( -0.856 1.889 -5.006) 5.419 2.621 ( -1.049 1.985 -4.893) 5.383 2.956 ( 2.131 -1.099 -1.768) 2.979 3.040 ( 0.379 -1.799 -5.613) 5.907 4.587 ( -0.858 -6.249 -1.848) 6.573 4.610 ( -1.390 -6.667 -2.065) 7.116 5.772 ( -0.407 2.559 -0.074) 2.592 6.080 ( -1.789 -7.558 -3.935) 8.707 6.295 ( -4.388 2.637 -6.112) 7.973 6.361 ( -4.459 -0.153 -7.387) 8.630 7.773 ( 2.159 2.440 2.915) 4.372 7.906 ( 2.824 -0.865 3.196) 4.351 7.974 ( 0.994 2.708 -0.465) 2.922 8.061 ( 1.227 -0.640 0.751) 1.575 8.395 ( 1.185 9.215 0.225) 9.293 8.446 ( -4.068 7.449 -4.612) 9.659 9.031 ( 0.110 -6.711 -2.145) 7.046 9.055 ( 0.915 -6.659 -0.820) 6.771 ======================= Grid point 25 (18/309) ======================= q-point: ( 0.47 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 511 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.593 ( -1.216 3.237 0.413) 3.483 1.679 ( -0.581 0.982 -1.310) 1.737 1.896 ( 3.671 -2.766 2.203) 5.097 1.918 ( 2.366 -2.485 0.843) 3.533 2.098 ( -1.568 5.942 0.262) 6.151 2.112 ( -2.406 4.697 0.640) 5.316 2.467 ( -0.905 2.055 -2.350) 3.250 2.562 ( -0.583 0.239 -1.688) 1.801 2.958 ( 0.543 -1.371 -0.526) 1.566 2.976 ( -0.132 -1.597 -2.987) 3.389 4.558 ( -0.424 -6.571 -0.767) 6.629 4.574 ( -0.520 -6.776 -0.877) 6.852 5.765 ( -0.256 1.623 -0.115) 1.647 5.994 ( -1.695 -5.152 -2.891) 6.146 6.212 ( -1.420 0.698 -0.187) 1.593 6.237 ( -1.234 0.224 -4.120) 4.306 7.825 ( 0.724 3.296 1.251) 3.599 7.931 ( -0.172 2.407 -0.152) 2.418 8.038 ( 2.629 -0.846 2.925) 4.022 8.078 ( 0.335 -1.295 -0.441) 1.409 8.336 ( -2.632 9.635 -2.812) 10.376 8.409 ( 0.455 8.584 0.052) 8.596 9.013 ( 0.122 -7.166 -0.730) 7.204 9.060 ( 0.474 -6.765 -0.163) 6.784 ======================= Grid point 34 (19/309) ======================= q-point: ( 0.00 0.40 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 309 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.721 ( 0.000 16.413 0.000) 16.413 0.862 ( 0.000 19.913 0.000) 19.913 0.985 ( 0.000 -11.586 0.000) 11.586 1.160 ( 0.000 -9.151 0.000) 9.151 1.787 ( 0.000 30.005 0.000) 30.005 1.866 ( 0.000 0.364 0.000) 0.364 1.873 ( 0.000 -0.378 0.000) 0.378 2.272 ( 0.000 -17.643 0.000) 17.643 2.380 ( 0.000 8.205 0.000) 8.205 2.583 ( 0.000 -14.209 0.000) 14.209 4.322 ( 0.000 0.432 0.000) 0.432 4.373 ( 0.000 -5.115 0.000) 5.115 5.806 ( 0.000 12.584 0.000) 12.584 6.043 ( 0.000 -11.590 0.000) 11.590 6.044 ( 0.000 0.886 0.000) 0.886 6.061 ( 0.000 -1.538 0.000) 1.538 7.255 ( 0.000 0.622 0.000) 0.622 7.264 ( 0.000 -0.254 0.000) 0.254 7.792 ( 0.000 -0.020 0.000) 0.020 7.793 ( 0.000 -0.109 0.000) 0.109 8.645 ( 0.000 8.099 0.000) 8.099 8.814 ( 0.000 -9.167 0.000) 9.167 9.198 ( 0.000 9.053 0.000) 9.053 9.366 ( 0.000 -8.283 0.000) 8.283 ======================= Grid point 35 (20/309) ======================= q-point: ( 0.06 0.40 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 511 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.756 ( 0.659 20.128 -6.377) 21.125 0.861 ( 12.292 14.844 1.167) 19.308 1.059 ( 7.748 -12.041 -0.399) 14.324 1.144 ( 3.957 -13.601 -2.733) 14.426 1.824 ( 0.584 19.593 6.364) 20.609 1.928 ( 5.225 -0.108 1.933) 5.572 2.001 ( 11.766 10.890 2.404) 16.211 2.276 ( 1.543 1.071 -2.542) 3.160 2.426 ( 1.225 -6.019 7.940) 10.039 2.554 ( -1.980 -16.539 0.416) 16.662 4.352 ( 1.412 0.612 2.701) 3.109 4.409 ( 0.864 -5.451 3.297) 6.429 5.827 ( -3.742 9.468 5.346) 11.499 6.005 ( -1.950 -9.126 2.653) 9.702 6.242 ( 16.292 2.434 6.995) 17.897 6.335 ( 21.867 -7.858 6.669) 24.174 7.209 ( -3.692 1.067 -2.066) 4.364 7.228 ( -2.476 -1.160 -1.737) 3.240 7.815 ( 3.109 0.279 -0.352) 3.142 7.822 ( 3.955 -0.397 -0.663) 4.030 8.631 ( 1.189 10.286 -2.966) 10.771 8.826 ( 1.721 -10.491 -0.466) 10.642 9.173 ( -3.364 10.010 0.496) 10.572 9.352 ( -1.819 -8.546 -0.168) 8.739 ======================= Grid point 36 (21/309) ======================= q-point: ( 0.12 0.40 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 511 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.773 ( 9.384 16.880 0.587) 19.322 1.075 ( 7.376 -8.070 0.503) 10.945 1.186 ( 15.174 -0.078 5.297) 16.072 1.337 ( 16.903 -8.973 2.444) 19.293 1.963 ( 5.504 11.005 5.528) 13.490 2.029 ( 2.912 0.398 1.289) 3.209 2.175 ( 8.577 14.139 0.580) 16.548 2.356 ( 9.479 1.330 1.946) 9.768 2.509 ( 1.791 -3.820 3.433) 5.440 2.660 ( 5.748 -14.568 8.649) 17.891 4.422 ( 1.957 -0.174 3.382) 3.911 4.472 ( 1.060 -5.372 3.592) 6.549 5.844 ( -2.878 8.884 4.617) 10.417 6.021 ( -1.044 -9.757 2.653) 10.165 6.625 ( 17.322 4.087 9.200) 20.035 6.740 ( 16.062 -7.595 6.415) 18.890 7.115 ( -3.453 2.367 -2.672) 4.967 7.177 ( 0.828 -5.106 -1.847) 5.493 7.864 ( 4.017 0.615 -0.591) 4.106 7.877 ( 4.940 -0.823 -1.250) 5.162 8.610 ( 1.853 13.311 -3.193) 13.813 8.839 ( 1.723 -11.150 -1.722) 11.413 9.125 ( -3.792 9.800 0.533) 10.522 9.306 ( -3.037 -8.694 -1.149) 9.280 ======================= Grid point 37 (22/309) ======================= q-point: ( 0.18 0.40 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 511 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.004 ( 14.206 10.667 4.703) 18.377 1.214 ( 9.095 -10.064 2.734) 13.838 1.524 ( 13.879 4.049 9.016) 17.038 1.634 ( 14.947 -6.650 4.877) 17.071 2.023 ( -1.356 6.288 -1.498) 6.605 2.091 ( 2.817 -0.740 1.197) 3.149 2.341 ( 11.003 8.648 2.025) 14.141 2.486 ( 7.774 -6.903 -0.340) 10.402 2.677 ( 9.743 7.791 5.062) 13.463 2.856 ( 6.201 -8.696 5.809) 12.159 4.493 ( 1.827 -1.087 2.577) 3.341 4.533 ( 1.011 -5.307 2.766) 6.069 5.865 ( -2.071 8.748 3.681) 9.714 6.040 ( -0.894 -9.696 2.036) 9.948 6.883 ( 1.217 1.147 1.065) 1.983 6.903 ( 1.048 -0.993 0.214) 1.460 7.117 ( 8.697 6.232 3.428) 11.235 7.272 ( 10.980 -10.593 1.832) 15.366 7.914 ( 3.639 0.626 -0.472) 3.723 7.930 ( 4.480 -1.022 -1.446) 4.817 8.600 ( 1.870 14.799 -2.399) 15.108 8.829 ( 0.701 -8.344 -2.390) 8.708 9.077 ( -2.742 5.853 -0.591) 6.490 9.230 ( -3.669 -8.283 -2.639) 9.436 ======================= Grid point 38 (23/309) ======================= q-point: ( 0.24 0.40 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 511 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.276 ( 13.694 7.060 3.760) 15.859 1.399 ( 9.298 -5.475 3.427) 11.321 1.799 ( 6.489 5.231 7.412) 11.154 1.886 ( 8.548 -4.471 4.895) 10.818 1.965 ( -1.763 6.318 -1.694) 6.775 2.086 ( -1.738 -6.268 -1.788) 6.745 2.524 ( 10.850 4.189 -0.521) 11.642 2.609 ( 9.457 -4.857 -0.972) 10.676 2.862 ( 7.610 8.073 2.214) 11.313 2.991 ( 4.903 -4.308 1.794) 6.769 4.541 ( 1.140 -1.862 1.107) 2.448 4.572 ( 0.395 -5.162 1.227) 5.321 5.880 ( -1.509 8.255 2.275) 8.695 6.046 ( -0.944 -9.252 0.709) 9.327 6.825 ( -3.591 1.025 -3.671) 5.237 6.838 ( -3.338 -0.463 -4.235) 5.412 7.357 ( 10.441 4.185 5.987) 12.743 7.464 ( 9.355 -7.250 2.711) 12.142 7.958 ( 2.817 0.452 -0.159) 2.857 7.971 ( 3.466 -0.891 -1.275) 3.799 8.600 ( 1.713 15.053 -1.446) 15.219 8.801 ( 0.271 -3.383 -2.416) 4.166 9.021 ( -2.277 0.004 -2.336) 3.262 9.128 ( -3.834 -7.711 -4.033) 9.509 ======================= Grid point 39 (24/309) ======================= q-point: ( 0.29 0.40 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 511 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.499 ( 10.476 4.776 2.182) 11.718 1.568 ( 7.559 -2.203 2.584) 8.287 1.834 ( -2.993 4.975 -2.318) 6.251 1.911 ( -3.185 -2.351 -2.431) 4.645 2.054 ( 2.306 0.707 5.119) 5.659 2.088 ( 2.598 -2.337 3.878) 5.220 2.630 ( 7.015 3.456 -3.476) 8.558 2.714 ( 6.994 -5.031 -2.771) 9.050 2.955 ( 3.915 7.110 -0.994) 8.177 3.054 ( 3.589 -2.730 -1.692) 4.817 4.553 ( -0.081 -2.577 -0.537) 2.633 4.575 ( -0.667 -4.898 -0.513) 4.969 5.881 ( -0.988 7.306 0.630) 7.399 6.030 ( -0.919 -8.471 -0.881) 8.566 6.693 ( -4.649 0.912 -6.585) 8.112 6.707 ( -4.244 -0.639 -6.713) 7.967 7.565 ( 7.120 2.308 5.304) 9.174 7.621 ( 6.586 -3.767 3.156) 8.218 7.994 ( 1.932 0.135 0.246) 1.952 7.998 ( 2.224 -0.276 -0.936) 2.428 8.609 ( 1.452 14.866 -0.789) 14.958 8.772 ( 0.091 2.817 -2.472) 3.749 8.946 ( -2.104 -6.194 -3.438) 7.390 9.015 ( -3.087 -8.033 -4.504) 9.713 ======================= Grid point 40 (25/309) ======================= q-point: ( 0.35 0.40 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 511 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.641 ( 5.273 3.553 1.189) 6.469 1.685 ( 4.382 -0.651 0.565) 4.466 1.775 ( -0.537 0.783 -0.314) 1.000 1.804 ( -3.463 -2.422 -3.367) 5.404 2.141 ( -0.095 2.919 4.977) 5.770 2.168 ( 0.507 -0.022 3.367) 3.405 2.644 ( 2.601 3.888 -4.780) 6.688 2.722 ( 1.588 -3.271 -5.311) 6.437 2.969 ( 2.246 4.682 -2.925) 5.959 3.051 ( 1.788 -3.188 -4.458) 5.765 4.526 ( -1.255 -3.216 -1.755) 3.873 4.540 ( -1.601 -4.714 -1.807) 5.296 5.867 ( -0.738 6.060 -0.708) 6.145 5.996 ( -0.937 -7.572 -2.073) 7.906 6.513 ( -5.435 1.144 -8.375) 10.049 6.532 ( -4.866 -0.952 -8.526) 9.863 7.717 ( 4.545 2.104 4.530) 6.753 7.757 ( 5.000 -2.131 4.269) 6.911 8.012 ( 1.169 0.803 -0.667) 1.567 8.023 ( 1.231 -0.418 0.516) 1.399 8.619 ( 1.028 14.648 -0.652) 14.699 8.721 ( -1.720 9.470 -3.664) 10.299 8.886 ( -0.116 -11.628 -2.258) 11.846 8.921 ( -1.757 -9.715 -3.821) 10.586 ======================= Grid point 41 (26/309) ======================= q-point: ( 0.41 0.40 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 511 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.671 ( -0.672 3.053 -0.033) 3.126 1.710 ( -0.216 -1.267 -1.182) 1.747 1.779 ( 2.322 0.755 2.164) 3.263 1.817 ( 3.104 -2.473 1.019) 4.097 2.187 ( -1.348 2.999 3.387) 4.720 2.198 ( -0.918 2.057 1.891) 2.941 2.586 ( -0.767 3.252 -4.981) 5.998 2.638 ( -1.550 -1.190 -5.807) 6.127 2.954 ( 1.236 1.446 -2.831) 3.411 2.998 ( 0.482 -2.588 -5.069) 5.711 4.478 ( -1.471 -3.700 -1.845) 4.388 4.488 ( -1.597 -4.678 -1.950) 5.314 5.840 ( -0.937 4.700 -1.310) 4.968 5.946 ( -1.363 -6.553 -2.670) 7.206 6.328 ( -4.391 1.352 -6.746) 8.162 6.351 ( -3.787 -1.002 -7.609) 8.558 7.829 ( 2.758 3.122 3.763) 5.614 7.879 ( 3.198 -2.105 4.199) 5.682 8.017 ( 0.725 1.810 -0.433) 1.997 8.044 ( 0.856 -1.146 0.253) 1.453 8.622 ( 0.623 13.792 -0.779) 13.828 8.633 ( -2.481 11.777 -3.692) 12.589 8.858 ( -0.588 -11.154 -2.599) 11.468 8.877 ( 0.861 -11.998 -0.702) 12.049 ======================= Grid point 42 (27/309) ======================= q-point: ( 0.47 0.40 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 511 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.663 ( -0.660 3.523 0.409) 3.607 1.695 ( -0.001 0.231 -0.460) 0.515 1.851 ( 2.011 -1.428 1.706) 2.999 1.864 ( 1.227 -2.651 0.730) 3.012 2.198 ( -1.047 3.411 1.215) 3.770 2.199 ( -0.653 3.348 0.319) 3.426 2.512 ( -1.048 2.595 -2.541) 3.781 2.555 ( -1.024 -1.455 -2.523) 3.087 2.937 ( 0.270 -0.345 -0.903) 1.003 2.948 ( 0.151 -1.229 -2.493) 2.784 4.443 ( -0.621 -3.952 -0.765) 4.073 4.450 ( -0.636 -4.689 -0.828) 4.803 5.812 ( -0.612 3.474 -0.713) 3.599 5.893 ( -0.982 -5.124 -1.626) 5.465 6.223 ( -1.626 0.606 -1.656) 2.399 6.235 ( -1.106 -0.466 -3.605) 3.800 7.896 ( 0.933 3.853 1.745) 4.332 7.949 ( 0.694 -1.175 1.379) 1.940 8.031 ( 0.912 0.502 0.807) 1.317 8.052 ( 0.250 -1.380 -0.581) 1.518 8.563 ( -1.160 13.496 -1.742) 13.658 8.622 ( 0.207 12.638 -0.272) 12.642 8.829 ( -0.151 -11.587 -0.887) 11.622 8.882 ( 0.444 -11.746 -0.171) 11.755 ======================= Grid point 85 (28/309) ======================= q-point: ( 0.00 0.00 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.349 ( -0.974 0.000 17.778) 17.805 0.467 ( 1.157 0.000 23.485) 23.513 0.502 ( -1.170 0.000 25.986) 26.012 1.213 ( -3.080 0.000 0.991) 3.235 1.620 ( -1.300 0.000 -0.877) 1.568 1.823 ( -0.070 0.000 -2.195) 2.197 1.915 ( 3.396 0.000 1.855) 3.869 2.062 ( 0.832 0.000 -6.036) 6.093 2.602 ( 1.015 0.000 7.368) 7.437 3.047 ( -0.440 0.000 -1.488) 1.551 4.420 ( -0.404 0.000 6.148) 6.161 4.593 ( -0.092 0.000 3.776) 3.777 6.092 ( -2.431 0.000 7.099) 7.504 6.167 ( -0.216 0.000 8.776) 8.779 6.362 ( -0.295 0.000 4.027) 4.038 6.900 ( 0.146 0.000 0.351) 0.380 6.942 ( -0.377 0.000 0.552) 0.669 7.182 ( 0.518 0.000 -5.093) 5.119 7.767 ( 1.371 0.000 -2.086) 2.497 7.798 ( -0.182 0.000 -0.588) 0.616 7.900 ( 0.514 0.000 4.078) 4.111 9.046 ( 0.281 0.000 -2.183) 2.201 9.099 ( -0.057 0.000 0.908) 0.910 9.512 ( 0.492 0.000 -2.295) 2.347 ======================= Grid point 86 (29/309) ======================= q-point: ( 0.06 0.00 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.558 ( -0.847 0.000 16.637) 16.659 0.834 ( 6.576 0.000 19.612) 20.685 1.024 ( 19.689 0.000 21.837) 29.403 1.328 ( 14.661 0.000 0.525) 14.670 1.593 ( 0.235 0.000 -0.160) 0.285 1.861 ( 7.897 0.000 -1.642) 8.066 1.937 ( -1.499 0.000 -3.277) 3.604 2.105 ( 12.262 0.000 0.132) 12.263 2.716 ( -0.265 0.000 7.480) 7.485 3.005 ( -2.092 0.000 -0.472) 2.144 4.514 ( 0.033 0.000 7.089) 7.089 4.662 ( 0.528 0.000 5.388) 5.414 5.952 ( -22.174 0.000 15.676) 27.155 6.290 ( -0.946 0.000 7.228) 7.290 6.499 ( 8.719 0.000 9.611) 12.977 6.898 ( -1.120 0.000 0.344) 1.172 7.089 ( -2.296 0.000 -5.799) 6.237 7.268 ( 29.131 0.000 -10.458) 30.952 7.780 ( 4.504 0.000 -2.903) 5.359 7.808 ( 3.152 0.000 -1.253) 3.392 7.975 ( 0.638 0.000 5.315) 5.353 8.974 ( -4.513 0.000 -1.847) 4.877 9.118 ( 1.174 0.000 0.921) 1.492 9.472 ( -0.754 0.000 -3.274) 3.360 ======================= Grid point 87 (30/309) ======================= q-point: ( 0.12 0.00 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.787 ( 3.679 0.000 13.703) 14.188 1.168 ( 6.653 0.000 14.159) 15.644 1.509 ( 5.921 0.000 6.677) 8.924 1.554 ( 17.206 0.000 2.590) 17.399 1.774 ( 19.409 0.000 11.495) 22.557 1.865 ( -1.632 0.000 -2.872) 3.303 1.984 ( 11.337 0.000 -2.592) 11.630 2.323 ( 14.549 0.000 0.582) 14.560 2.781 ( -2.524 0.000 4.816) 5.437 2.974 ( -1.277 0.000 -0.586) 1.405 4.600 ( -0.567 0.000 5.996) 6.023 4.742 ( 0.068 0.000 5.209) 5.210 5.882 ( -15.920 0.000 14.661) 21.642 6.332 ( -3.118 0.000 4.560) 5.524 6.831 ( 13.364 0.000 11.886) 17.884 6.875 ( -2.218 0.000 -0.313) 2.240 6.972 ( -2.805 0.000 -5.380) 6.068 7.478 ( 17.309 0.000 -7.957) 19.050 7.814 ( 5.725 0.000 -3.387) 6.651 7.848 ( 5.438 0.000 -2.763) 6.100 8.058 ( 0.272 0.000 5.780) 5.787 8.875 ( -4.872 0.000 -2.366) 5.416 9.150 ( 1.562 0.000 0.347) 1.600 9.401 ( -2.020 0.000 -4.151) 4.616 ======================= Grid point 88 (31/309) ======================= q-point: ( 0.18 0.00 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.034 ( 6.627 0.000 10.801) 12.672 1.401 ( 4.884 0.000 6.893) 8.448 1.597 ( 3.837 0.000 1.736) 4.212 1.829 ( -0.364 0.000 0.442) 0.572 1.845 ( 13.806 0.000 3.103) 14.151 2.102 ( 9.753 0.000 -4.009) 10.545 2.259 ( 19.195 0.000 11.521) 22.387 2.519 ( 11.830 0.000 -2.019) 12.001 2.782 ( -2.841 0.000 2.428) 3.737 2.945 ( -0.448 0.000 -1.744) 1.801 4.661 ( -0.951 0.000 4.538) 4.637 4.795 ( -1.180 0.000 3.449) 3.646 5.859 ( -12.745 0.000 12.992) 18.200 6.331 ( -3.984 0.000 3.101) 5.048 6.812 ( -3.628 0.000 -3.121) 4.786 6.863 ( -2.744 0.000 -4.509) 5.278 7.176 ( 11.854 0.000 10.252) 15.672 7.594 ( 10.501 0.000 -4.691) 11.501 7.855 ( 6.360 0.000 -3.807) 7.412 7.886 ( 5.773 0.000 -4.035) 7.043 8.141 ( 0.024 0.000 6.124) 6.124 8.767 ( -4.497 0.000 -3.093) 5.458 9.166 ( 0.698 0.000 -0.720) 1.003 9.301 ( -2.897 0.000 -4.809) 5.614 ======================= Grid point 89 (32/309) ======================= q-point: ( 0.24 0.00 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.271 ( 7.447 0.000 8.339) 11.180 1.508 ( 3.610 0.000 0.902) 3.720 1.678 ( 3.402 0.000 1.723) 3.814 1.868 ( 1.159 0.000 3.331) 3.527 2.044 ( 8.423 0.000 1.665) 8.586 2.144 ( 3.430 0.000 -4.684) 5.805 2.578 ( 8.047 0.000 3.113) 8.628 2.585 ( 4.831 0.000 -5.835) 7.575 2.813 ( 2.838 0.000 2.412) 3.724 2.939 ( 3.839 0.000 -1.154) 4.009 4.694 ( -1.466 0.000 2.894) 3.244 4.799 ( -2.423 0.000 1.118) 2.669 5.850 ( -10.761 0.000 11.264) 15.578 6.301 ( -4.425 0.000 1.913) 4.821 6.677 ( -4.683 0.000 -7.354) 8.719 6.754 ( -4.143 0.000 -4.715) 6.277 7.452 ( 8.274 0.000 8.035) 11.534 7.677 ( 6.920 0.000 -1.721) 7.131 7.899 ( 7.240 0.000 -4.785) 8.678 7.909 ( 4.349 0.000 -3.595) 5.642 8.222 ( -0.438 0.000 5.881) 5.897 8.657 ( -4.073 0.000 -3.662) 5.477 9.150 ( -0.348 0.000 -1.822) 1.855 9.194 ( -2.505 0.000 -4.518) 5.166 ======================= Grid point 90 (33/309) ======================= q-point: ( 0.29 0.00 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.475 ( 6.156 0.000 6.409) 8.887 1.579 ( 4.968 0.000 1.226) 5.117 1.734 ( 1.723 0.000 0.722) 1.868 1.894 ( -0.618 0.000 -2.736) 2.805 2.109 ( -1.505 0.000 0.382) 1.553 2.143 ( 2.822 0.000 0.772) 2.926 2.564 ( 4.020 0.000 -5.818) 7.072 2.599 ( -0.962 0.000 -3.983) 4.098 2.891 ( 3.289 0.000 1.450) 3.594 3.011 ( 5.330 0.000 -1.432) 5.518 4.695 ( -2.134 0.000 1.226) 2.461 4.759 ( -2.982 0.000 -0.794) 3.086 5.845 ( -9.259 0.000 9.772) 13.461 6.259 ( -4.108 0.000 1.606) 4.411 6.476 ( -5.539 0.000 -10.614) 11.973 6.601 ( -5.943 0.000 -6.666) 8.931 7.637 ( 4.182 0.000 5.569) 6.964 7.768 ( 5.708 0.000 1.521) 5.907 7.910 ( 4.086 0.000 -4.925) 6.400 7.949 ( 6.069 0.000 -3.002) 6.771 8.284 ( -1.168 0.000 5.036) 5.169 8.544 ( -4.102 0.000 -4.104) 5.803 9.113 ( -0.598 0.000 -2.217) 2.296 9.118 ( -0.640 0.000 -2.838) 2.909 ======================= Grid point 91 (34/309) ======================= q-point: ( 0.35 0.00 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.610 ( 0.716 0.000 4.501) 4.558 1.688 ( 5.029 0.000 1.591) 5.275 1.763 ( 3.060 0.000 -0.210) 3.067 1.798 ( -1.135 0.000 -4.506) 4.647 2.125 ( -1.647 0.000 3.613) 3.970 2.155 ( -1.826 0.000 0.168) 1.834 2.515 ( -1.768 0.000 -3.913) 4.294 2.548 ( 2.972 0.000 -4.356) 5.273 2.945 ( 1.413 0.000 1.389) 1.981 3.020 ( 1.342 0.000 -3.976) 4.196 4.669 ( -2.337 0.000 0.267) 2.352 4.699 ( -2.521 0.000 -1.491) 2.929 5.841 ( -8.318 0.000 8.827) 12.129 6.231 ( -3.241 0.000 2.354) 4.005 6.238 ( -4.913 0.000 -11.881) 12.857 6.411 ( -6.163 0.000 -6.929) 9.274 7.742 ( 1.599 0.000 4.052) 4.356 7.883 ( 4.890 0.000 3.369) 5.938 7.897 ( 2.418 0.000 -3.831) 4.531 7.997 ( 5.948 0.000 -3.246) 6.776 8.326 ( -1.556 0.000 4.139) 4.422 8.420 ( -4.684 0.000 -4.409) 6.432 9.081 ( -0.012 0.000 -1.520) 1.520 9.097 ( 1.026 0.000 -0.901) 1.366 ======================= Grid point 92 (35/309) ======================= q-point: ( 0.41 0.00 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.615 ( -4.414 0.000 2.186) 4.926 1.669 ( -0.657 0.000 -2.897) 2.971 1.837 ( 6.092 0.000 -0.154) 6.094 1.873 ( 6.573 0.000 3.002) 7.226 2.103 ( -4.151 0.000 -0.705) 4.210 2.118 ( -3.779 0.000 0.486) 3.810 2.460 ( -1.705 0.000 -0.103) 1.708 2.536 ( 1.602 0.000 -2.115) 2.654 2.978 ( -0.303 0.000 2.502) 2.520 2.980 ( 0.372 0.000 -2.194) 2.225 4.643 ( -1.755 0.000 0.607) 1.857 4.655 ( -1.259 0.000 -0.486) 1.350 5.837 ( -7.913 0.000 8.399) 11.540 6.043 ( -1.140 0.000 -8.590) 8.665 6.227 ( -2.743 0.000 3.591) 4.519 6.258 ( -3.504 0.000 -3.903) 5.245 7.799 ( -0.278 0.000 2.720) 2.735 7.882 ( 1.714 0.000 -2.739) 3.231 8.003 ( 4.641 0.000 3.778) 5.984 8.033 ( 5.160 0.000 -3.679) 6.337 8.288 ( -5.037 0.000 -4.017) 6.442 8.353 ( -1.860 0.000 3.475) 3.941 9.074 ( 0.457 0.000 -0.150) 0.481 9.111 ( 1.193 0.000 0.091) 1.196 ======================= Grid point 93 (36/309) ======================= q-point: ( 0.47 0.00 -0.92) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.579 ( -3.281 0.000 1.634) 3.666 1.656 ( 1.258 0.000 0.356) 1.307 1.918 ( 6.134 0.000 -1.726) 6.372 1.977 ( 1.916 0.000 -1.395) 2.370 2.027 ( -4.503 0.000 -0.525) 4.533 2.032 ( -3.013 0.000 -1.787) 3.503 2.468 ( -1.139 0.000 4.549) 4.690 2.546 ( 1.583 0.000 0.331) 1.617 2.999 ( 1.376 0.000 3.198) 3.481 3.008 ( -1.712 0.000 4.112) 4.454 4.640 ( -0.807 0.000 1.968) 2.127 4.651 ( -0.186 0.000 1.438) 1.450 5.834 ( -7.751 0.000 8.312) 11.365 6.002 ( 4.913 0.000 -1.009) 5.016 6.220 ( 1.051 0.000 1.349) 1.710 6.242 ( -3.100 0.000 4.747) 5.670 7.807 ( -1.703 0.000 0.755) 1.863 7.877 ( 1.972 0.000 -2.004) 2.812 8.048 ( 3.915 0.000 -4.171) 5.721 8.077 ( -1.077 0.000 -1.495) 1.843 8.215 ( 0.990 0.000 2.503) 2.692 8.364 ( -2.520 0.000 2.897) 3.840 9.087 ( 0.249 0.000 1.231) 1.256 9.127 ( 0.344 0.000 0.358) 0.496 ======================= Grid point 94 (37/309) ======================= q-point: (-0.47 0.00 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.571 ( -0.590 0.000 1.236) 1.369 1.716 ( 3.552 0.000 3.090) 4.708 1.844 ( -6.027 0.000 -5.756) 8.334 1.917 ( -3.695 0.000 -1.969) 4.187 2.012 ( 4.454 0.000 -0.704) 4.510 2.040 ( 1.892 0.000 -2.425) 3.076 2.545 ( -0.141 0.000 7.586) 7.588 2.597 ( 2.465 0.000 2.816) 3.743 3.035 ( -3.345 0.000 5.051) 6.058 3.090 ( 0.833 0.000 6.584) 6.636 4.670 ( -0.363 0.000 3.451) 3.470 4.684 ( 0.328 0.000 2.988) 3.006 5.832 ( -7.862 0.000 8.266) 11.408 6.147 ( 8.983 0.000 5.668) 10.622 6.262 ( -3.742 0.000 5.704) 6.822 6.320 ( 4.939 0.000 6.122) 7.866 7.773 ( -2.642 0.000 -0.978) 2.817 7.888 ( 2.879 0.000 -1.611) 3.299 7.983 ( -4.244 0.000 -3.131) 5.274 8.037 ( 2.596 0.000 -4.419) 5.125 8.332 ( 4.541 0.000 5.279) 6.963 8.355 ( -3.435 0.000 2.296) 4.132 9.113 ( -0.171 0.000 2.423) 2.429 9.132 ( -0.437 0.000 0.742) 0.861 ======================= Grid point 95 (38/309) ======================= q-point: (-0.41 0.00 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.576 ( -0.958 0.000 0.224) 0.984 1.687 ( -4.749 0.000 -4.008) 6.214 1.815 ( -6.055 0.000 -1.659) 6.278 1.843 ( 5.548 0.000 3.486) 6.552 2.010 ( 0.898 0.000 -3.690) 3.797 2.074 ( 5.155 0.000 -1.557) 5.385 2.651 ( -0.350 0.000 7.695) 7.703 2.687 ( 1.796 0.000 5.162) 5.465 3.038 ( -5.477 0.000 4.865) 7.326 3.168 ( -2.467 0.000 5.366) 5.906 4.714 ( -1.134 0.000 4.125) 4.278 4.734 ( 0.297 0.000 3.282) 3.296 5.822 ( -8.347 0.000 7.865) 11.469 6.287 ( -3.973 0.000 6.312) 7.458 6.381 ( 8.888 0.000 7.654) 11.730 6.507 ( 6.089 0.000 7.953) 10.016 7.702 ( -3.661 0.000 -2.607) 4.494 7.892 ( -3.692 0.000 -1.093) 3.850 7.918 ( 3.871 0.000 -1.524) 4.160 8.009 ( 1.526 0.000 -3.997) 4.278 8.323 ( -4.408 0.000 1.620) 4.696 8.466 ( 4.113 0.000 4.506) 6.101 9.143 ( -0.204 0.000 1.831) 1.843 9.148 ( -0.337 0.000 3.327) 3.344 ======================= Grid point 96 (39/309) ======================= q-point: (-0.35 0.00 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.511 ( -8.089 0.000 -0.978) 8.148 1.593 ( -3.043 0.000 -1.637) 3.455 1.713 ( -3.158 0.000 -2.442) 3.992 1.878 ( -1.662 0.000 -2.896) 3.339 2.060 ( 7.857 0.000 1.064) 7.929 2.109 ( 2.483 0.000 -2.153) 3.286 2.717 ( -2.857 0.000 4.043) 4.950 2.776 ( -1.073 0.000 6.578) 6.665 2.998 ( -8.026 0.000 3.800) 8.880 3.146 ( -7.014 0.000 2.129) 7.330 4.738 ( -2.965 0.000 3.685) 4.730 4.774 ( -0.331 0.000 2.314) 2.338 5.795 ( -8.800 0.000 6.866) 11.162 6.314 ( -3.822 0.000 6.117) 7.213 6.592 ( 6.455 0.000 5.817) 8.689 6.692 ( 4.768 0.000 6.644) 8.178 7.585 ( -5.709 0.000 -4.559) 7.306 7.850 ( -3.005 0.000 2.205) 3.727 7.954 ( 4.415 0.000 -2.935) 5.302 7.980 ( 0.268 0.000 -1.629) 1.651 8.267 ( -5.366 0.000 0.859) 5.434 8.574 ( 3.551 0.000 2.974) 4.632 9.184 ( 1.208 0.000 3.300) 3.514 9.190 ( -0.539 0.000 3.535) 3.576 ======================= Grid point 97 (40/309) ======================= q-point: (-0.29 0.00 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.316 ( -14.271 0.000 -2.346) 14.462 1.512 ( -5.765 0.000 -2.801) 6.409 1.648 ( -1.667 0.000 -2.352) 2.883 1.817 ( -0.322 0.000 -1.658) 1.689 2.078 ( -2.412 0.000 -2.775) 3.677 2.176 ( 6.194 0.000 -0.748) 6.239 2.621 ( -11.201 0.000 -4.617) 12.116 2.818 ( -5.224 0.000 5.579) 7.643 2.902 ( -10.261 0.000 2.539) 10.571 3.056 ( -6.910 0.000 1.703) 7.117 4.722 ( -4.925 0.000 2.556) 5.548 4.781 ( -1.485 0.000 0.601) 1.602 5.748 ( -8.527 0.000 5.363) 10.073 6.335 ( -3.689 0.000 5.073) 6.273 6.728 ( 4.121 0.000 2.737) 4.947 6.825 ( 3.350 0.000 4.249) 5.410 7.401 ( -9.196 0.000 -6.368) 11.185 7.860 ( -3.082 0.000 5.843) 6.606 7.945 ( 1.656 0.000 -3.701) 4.054 7.990 ( 0.981 0.000 0.159) 0.993 8.188 ( -6.179 0.000 0.191) 6.182 8.654 ( 3.690 0.000 0.933) 3.806 9.222 ( -1.273 0.000 2.802) 3.078 9.265 ( 2.683 0.000 3.928) 4.757 ======================= Grid point 98 (41/309) ======================= q-point: (-0.24 0.00 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.037 ( -17.154 0.000 -3.754) 17.559 1.317 ( -10.938 0.000 -7.150) 13.068 1.598 ( -2.250 0.000 -0.571) 2.322 1.839 ( 2.339 0.000 2.004) 3.080 1.956 ( -8.898 0.000 -2.841) 9.341 2.209 ( 1.255 0.000 -2.733) 3.008 2.263 ( -20.512 0.000 -11.342) 23.439 2.714 ( -12.686 0.000 -0.245) 12.688 2.812 ( -7.874 0.000 2.996) 8.425 2.996 ( -3.770 0.000 0.518) 3.806 4.663 ( -6.267 0.000 1.195) 6.380 4.745 ( -2.772 0.000 -1.186) 3.015 5.691 ( -7.313 0.000 3.588) 8.145 6.341 ( -3.698 0.000 3.892) 5.369 6.798 ( 2.811 0.000 0.431) 2.844 6.920 ( 3.590 0.000 2.589) 4.426 7.133 ( -13.533 0.000 -8.009) 15.725 7.914 ( 0.224 0.000 -2.845) 2.854 7.915 ( -4.332 0.000 10.411) 11.277 7.995 ( -0.529 0.000 -0.188) 0.561 8.092 ( -6.546 0.000 -0.122) 6.547 8.710 ( 4.703 0.000 -1.926) 5.082 9.224 ( -2.410 0.000 1.569) 2.876 9.360 ( 3.196 0.000 3.202) 4.524 ======================= Grid point 99 (42/309) ======================= q-point: (-0.18 0.00 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.712 ( -18.281 0.000 -4.740) 18.886 1.007 ( -14.933 0.000 -9.435) 17.664 1.546 ( -10.312 0.000 0.691) 10.335 1.715 ( -17.478 0.000 -4.269) 17.992 1.795 ( -15.483 0.000 -9.344) 18.084 1.919 ( 2.815 0.000 3.476) 4.473 2.144 ( -4.484 0.000 -2.896) 5.338 2.487 ( -14.492 0.000 -2.672) 14.736 2.707 ( -7.411 0.000 -1.295) 7.523 2.951 ( -1.213 0.000 -1.402) 1.854 4.572 ( -6.838 0.000 -0.173) 6.840 4.674 ( -3.380 0.000 -2.022) 3.939 5.630 ( -5.541 0.000 1.662) 5.785 6.334 ( -3.843 0.000 3.393) 5.127 6.789 ( -16.742 0.000 -8.600) 18.822 6.835 ( 2.393 0.000 -0.448) 2.434 7.013 ( 5.010 0.000 1.772) 5.315 7.876 ( -0.819 0.000 -2.058) 2.215 7.963 ( -2.599 0.000 -1.260) 2.889 7.996 ( -6.029 0.000 0.121) 6.030 8.024 ( -6.259 0.000 17.748) 18.820 8.736 ( 6.333 0.000 -6.841) 9.323 9.195 ( -3.357 0.000 0.596) 3.410 9.441 ( 2.963 0.000 1.783) 3.458 ======================= Grid point 100 (43/309) ======================= q-point: (-0.12 0.00 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.386 ( -17.516 0.000 -2.561) 17.702 0.633 ( -18.484 0.000 -7.674) 20.014 1.086 ( -33.824 0.000 -4.868) 34.172 1.509 ( -15.141 0.000 -2.378) 15.327 1.628 ( -0.443 0.000 1.272) 1.347 1.981 ( -2.817 0.000 0.714) 2.906 2.031 ( -4.204 0.000 -0.066) 4.204 2.236 ( -11.597 0.000 -3.593) 12.141 2.579 ( -4.619 0.000 -3.142) 5.586 2.930 ( 0.923 0.000 -1.244) 1.549 4.464 ( -6.372 0.000 -0.621) 6.402 4.603 ( -2.805 0.000 -1.129) 3.024 5.570 ( -4.112 0.000 0.158) 4.115 6.320 ( -5.927 0.000 4.514) 7.451 6.437 ( -13.972 0.000 -7.062) 15.655 6.862 ( 2.104 0.000 -0.383) 2.138 7.115 ( 6.088 0.000 0.670) 6.125 7.838 ( -1.636 0.000 -0.688) 1.775 7.894 ( -2.896 0.000 -1.763) 3.390 7.913 ( -5.360 0.000 -0.300) 5.368 8.249 ( -5.783 0.000 30.820) 31.358 8.681 ( 7.494 0.000 -19.094) 20.512 9.147 ( -3.586 0.000 0.294) 3.598 9.495 ( 2.411 0.000 0.292) 2.429 ======================= Grid point 101 (44/309) ======================= q-point: (-0.06 0.00 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.199 ( -11.614 0.000 11.265) 16.179 0.323 ( -18.061 0.000 8.883) 20.127 0.566 ( -34.399 0.000 7.727) 35.257 1.317 ( -11.963 0.000 5.553) 13.189 1.633 ( -0.396 0.000 0.034) 0.398 1.896 ( -4.079 0.000 -0.141) 4.081 1.931 ( -7.411 0.000 -2.700) 7.887 2.125 ( -0.154 0.000 -2.991) 2.995 2.524 ( -0.710 0.000 2.072) 2.190 2.960 ( 2.406 0.000 4.814) 5.381 4.390 ( -3.725 0.000 1.986) 4.222 4.570 ( -1.439 0.000 1.182) 1.862 5.571 ( 1.877 0.000 13.019) 13.154 6.175 ( -11.351 0.000 2.218) 11.565 6.336 ( -1.478 0.000 2.077) 2.549 6.886 ( 1.359 0.000 0.019) 1.359 7.192 ( 4.748 0.000 -2.063) 5.177 7.799 ( -2.166 0.000 -1.067) 2.415 7.833 ( -3.368 0.000 -0.787) 3.459 7.862 ( -0.644 0.000 1.094) 1.269 8.165 ( -24.031 0.000 -63.747) 68.126 8.766 ( 14.052 0.000 31.576) 34.561 9.104 ( -2.593 0.000 0.536) 2.647 9.520 ( 1.585 0.000 -1.094) 1.926 ======================= Grid point 102 (45/309) ======================= q-point: ( 0.00 0.20 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 510 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.319 ( -4.840 18.753 0.125) 19.368 0.505 ( -1.355 13.566 11.037) 17.541 1.091 ( 1.721 27.450 16.746) 32.200 1.160 ( -2.968 -5.614 1.233) 6.468 1.546 ( -2.242 -1.929 -0.555) 3.009 1.833 ( 0.297 1.004 -1.689) 1.988 1.906 ( 3.042 -0.860 1.554) 3.523 2.135 ( 0.871 6.617 -6.277) 9.162 2.565 ( 1.139 -4.198 6.722) 8.006 2.888 ( -0.584 -14.094 2.150) 14.269 4.385 ( -0.396 -2.227 5.428) 5.881 4.550 ( -0.024 -5.335 4.422) 6.929 6.048 ( -3.482 -19.545 27.009) 33.520 6.100 ( 0.651 0.741 7.294) 7.360 6.160 ( -0.554 -0.692 8.611) 8.657 6.311 ( -0.920 -8.476 7.699) 11.487 7.195 ( 0.433 1.276 -4.624) 4.817 7.218 ( 0.635 2.139 -4.269) 4.817 7.769 ( 1.251 0.187 -1.957) 2.331 7.793 ( -0.048 -0.419 -0.745) 0.856 8.336 ( 0.325 19.964 -10.018) 22.338 8.995 ( -0.233 -8.365 1.618) 8.524 9.069 ( 0.484 3.775 -0.146) 3.809 9.477 ( 0.537 -4.290 -1.732) 4.658 ======================= Grid point 103 (46/309) ======================= q-point: ( 0.06 0.20 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 510 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.457 ( 3.488 -0.079 15.399) 15.790 0.800 ( 14.517 5.084 13.637) 20.556 1.253 ( 11.806 -4.103 1.867) 12.637 1.354 ( 7.946 -4.512 6.972) 11.494 1.555 ( 0.430 18.031 8.496) 19.937 1.887 ( 8.612 2.566 -1.275) 9.076 1.974 ( 1.619 1.616 -0.551) 2.353 2.145 ( 9.064 4.913 0.094) 10.310 2.656 ( -0.541 -6.053 5.072) 7.916 2.909 ( -0.571 -9.787 3.402) 10.377 4.474 ( 0.034 -3.132 6.943) 7.617 4.613 ( -0.304 -5.198 5.265) 7.405 5.949 ( -18.434 0.522 15.047) 23.801 6.237 ( -3.720 -5.627 6.693) 9.503 6.451 ( 11.837 -2.909 11.790) 16.958 6.710 ( 18.163 -13.370 8.153) 23.982 7.105 ( -2.444 1.833 -5.415) 6.218 7.197 ( 6.083 -2.408 -4.609) 8.003 7.786 ( 4.967 0.194 -2.878) 5.744 7.806 ( 3.300 -0.334 -1.283) 3.556 8.265 ( 1.270 19.639 -3.132) 19.928 8.980 ( -1.780 -3.163 -2.678) 4.511 9.065 ( -0.703 -0.617 2.062) 2.264 9.441 ( -0.953 -3.720 -2.958) 4.847 ======================= Grid point 104 (47/309) ======================= q-point: ( 0.12 0.20 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 510 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.738 ( 7.599 -0.520 12.773) 14.871 1.180 ( 10.733 0.859 10.461) 15.012 1.471 ( 11.004 -8.911 2.468) 14.373 1.544 ( 11.479 -6.350 5.611) 14.268 1.792 ( 9.135 14.262 6.601) 18.178 1.978 ( 3.243 5.380 1.560) 6.472 2.030 ( 11.467 5.330 -0.522) 12.656 2.351 ( 13.608 3.442 2.253) 14.216 2.683 ( -1.901 -8.429 2.190) 8.914 2.960 ( 0.005 -2.914 3.752) 4.750 4.560 ( -0.625 -3.505 6.077) 7.043 4.679 ( -0.578 -6.114 5.002) 7.921 5.910 ( -13.673 3.059 13.496) 19.454 6.260 ( -4.124 -6.655 5.422) 9.524 6.806 ( 11.620 -0.899 10.548) 15.719 6.892 ( 1.498 -0.184 1.117) 1.878 6.998 ( -1.679 2.613 -3.969) 5.040 7.311 ( 13.587 -11.607 -1.922) 17.972 7.826 ( 6.392 0.375 -3.818) 7.455 7.848 ( 5.121 -0.233 -2.081) 5.533 8.266 ( 0.921 16.769 0.405) 16.799 8.893 ( -3.699 0.881 -3.185) 4.960 9.093 ( 0.754 -4.242 1.144) 4.458 9.369 ( -2.267 -3.622 -4.009) 5.859 ======================= Grid point 105 (48/309) ======================= q-point: ( 0.18 0.20 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 510 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.020 ( 9.698 0.913 9.257) 13.438 1.391 ( 6.708 -3.285 3.716) 8.342 1.663 ( 4.595 4.979 6.458) 9.360 1.810 ( 13.325 -3.177 4.024) 14.277 1.857 ( 1.097 4.023 -0.687) 4.226 2.104 ( 7.776 -0.289 -2.423) 8.150 2.276 ( 14.996 2.448 4.985) 15.992 2.568 ( 11.253 3.141 1.223) 11.747 2.683 ( -0.018 -5.272 1.345) 5.441 2.994 ( -0.413 1.989 1.504) 2.528 4.619 ( -1.137 -3.774 4.545) 6.016 4.723 ( -1.446 -6.749 3.438) 7.712 5.897 ( -11.474 3.850 11.873) 16.954 6.260 ( -4.688 -6.576 4.058) 9.039 6.832 ( -3.390 1.467 -3.681) 5.215 6.865 ( -2.964 0.160 -4.014) 4.993 7.186 ( 11.758 1.263 9.626) 15.248 7.481 ( 10.431 -8.708 -0.306) 13.591 7.869 ( 6.995 0.501 -4.641) 8.409 7.894 ( 5.291 0.193 -2.671) 5.930 8.296 ( 0.417 14.056 2.450) 14.274 8.792 ( -3.583 2.296 -3.461) 5.485 9.107 ( 0.133 -5.348 -0.256) 5.356 9.267 ( -3.164 -3.807 -4.800) 6.895 ======================= Grid point 106 (49/309) ======================= q-point: ( 0.24 0.20 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 510 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.274 ( 9.796 1.628 6.496) 11.866 1.516 ( 5.566 -1.190 1.456) 5.875 1.737 ( 1.095 6.047 -0.104) 6.146 1.901 ( 1.190 2.739 2.697) 4.024 2.023 ( 8.315 -1.605 2.923) 8.958 2.127 ( 1.600 -2.111 -3.207) 4.160 2.479 ( 8.597 -2.930 -1.939) 9.287 2.690 ( 5.907 -1.253 -2.017) 6.367 2.764 ( 5.145 3.191 3.489) 6.988 3.002 ( 1.238 3.727 -0.243) 3.935 4.648 ( -1.764 -4.268 2.785) 5.393 4.727 ( -2.438 -6.775 1.287) 7.314 5.887 ( -10.074 3.690 10.139) 14.762 6.231 ( -5.157 -6.398 2.624) 8.627 6.696 ( -4.333 1.478 -7.341) 8.652 6.750 ( -4.446 -0.509 -5.178) 6.844 7.459 ( 8.423 0.779 7.953) 11.610 7.614 ( 7.132 -4.815 1.018) 8.665 7.906 ( 7.009 0.512 -5.325) 8.818 7.931 ( 4.670 1.017 -2.596) 5.439 8.340 ( -0.185 11.680 3.480) 12.188 8.694 ( -3.140 3.721 -3.667) 6.096 9.088 ( -0.829 -6.036 -1.540) 6.284 9.154 ( -2.842 -4.310 -4.635) 6.938 ======================= Grid point 107 (50/309) ======================= q-point: ( 0.29 0.20 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 510 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.483 ( 7.993 1.592 4.432) 9.277 1.607 ( 4.994 1.348 1.126) 5.294 1.748 ( 1.100 1.461 -0.280) 1.851 1.879 ( -2.125 -2.075 -5.024) 5.836 2.118 ( -0.388 1.872 3.602) 4.078 2.149 ( 3.017 0.672 1.356) 3.376 2.529 ( 4.364 -0.304 -3.481) 5.591 2.682 ( 0.348 3.432 -5.324) 6.343 2.871 ( 3.785 -0.136 1.767) 4.180 3.025 ( 2.656 0.911 -1.911) 3.396 4.642 ( -2.521 -4.971 1.063) 5.674 4.689 ( -3.002 -6.504 -0.563) 7.186 5.874 ( -8.855 2.957 8.638) 12.719 6.183 ( -5.111 -6.566 1.558) 8.465 6.507 ( -4.947 2.108 -9.771) 11.153 6.587 ( -5.838 -1.283 -7.174) 9.338 7.649 ( 4.484 1.139 5.792) 7.412 7.738 ( 5.899 -2.195 3.288) 7.101 7.927 ( 5.288 1.242 -5.098) 7.449 7.967 ( 4.930 1.053 -2.611) 5.677 8.380 ( -0.936 9.868 3.464) 10.500 8.595 ( -3.365 5.293 -3.954) 7.415 9.050 ( -0.689 -6.372 -1.885) 6.680 9.069 ( -1.273 -5.293 -3.164) 6.297 ======================= Grid point 108 (51/309) ======================= q-point: ( 0.35 0.20 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 510 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.618 ( 2.471 1.216 2.884) 3.988 1.699 ( 3.596 0.167 0.111) 3.601 1.758 ( 1.873 -0.637 -1.472) 2.465 1.788 ( 1.111 -0.722 -1.611) 2.086 2.157 ( -1.392 3.409 3.234) 4.901 2.180 ( -1.219 2.344 1.121) 2.870 2.525 ( 0.328 1.558 -2.293) 2.792 2.598 ( -0.318 3.658 -5.398) 6.528 2.929 ( 1.611 -1.202 1.089) 2.287 3.007 ( 0.476 -1.295 -3.920) 4.156 4.608 ( -2.722 -5.724 0.139) 6.340 4.631 ( -2.698 -6.360 -1.287) 7.028 5.859 ( -7.989 1.955 7.648) 11.231 6.115 ( -4.886 -6.670 -1.336) 8.375 6.313 ( -3.726 2.725 -7.286) 8.626 6.396 ( -5.686 -1.369 -7.233) 9.301 7.764 ( 2.026 2.130 4.462) 5.343 7.871 ( 4.359 -0.586 4.096) 6.010 7.930 ( 3.813 2.256 -3.715) 5.782 8.003 ( 4.991 0.312 -3.097) 5.882 8.407 ( -1.280 8.608 3.056) 9.224 8.483 ( -4.117 6.603 -4.140) 8.814 9.020 ( -0.307 -6.347 -1.575) 6.547 9.037 ( 0.770 -6.401 -0.887) 6.508 ======================= Grid point 109 (52/309) ======================= q-point: ( 0.41 0.20 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 510 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.634 ( -3.019 2.001 1.667) 3.987 1.673 ( 0.111 0.501 -2.214) 2.272 1.828 ( 5.182 -1.061 -0.255) 5.295 1.864 ( 5.528 -1.270 1.895) 5.980 2.138 ( -3.205 3.811 -0.493) 5.004 2.161 ( -3.056 3.914 0.686) 5.013 2.488 ( -2.259 2.598 0.280) 3.454 2.550 ( 0.554 1.233 -2.026) 2.436 2.959 ( 0.314 -1.730 0.408) 1.805 2.964 ( -0.144 -1.462 -0.236) 1.488 4.575 ( -2.026 -6.287 0.567) 6.630 4.586 ( -1.520 -6.489 -0.386) 6.676 5.845 ( -7.380 0.881 7.052) 10.246 6.004 ( -2.325 -3.583 -4.595) 6.274 6.230 ( -2.084 0.166 -0.230) 2.104 6.251 ( -3.037 -0.667 -2.881) 4.238 7.831 ( 0.023 3.107 2.904) 4.253 7.911 ( 1.997 2.387 -2.532) 4.012 8.004 ( 3.968 -0.116 2.744) 4.826 8.030 ( 4.363 -0.591 -3.040) 5.350 8.368 ( -3.821 8.440 -3.137) 9.781 8.427 ( -1.472 7.978 2.742) 8.563 9.007 ( 0.210 -6.929 -0.206) 6.935 9.049 ( 1.054 -6.621 0.134) 6.706 ======================= Grid point 110 (53/309) ======================= q-point: ( 0.47 0.20 -0.92) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 510 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.603 ( -2.431 2.487 0.615) 3.532 1.673 ( 0.872 1.578 0.739) 1.948 1.878 ( 3.569 -2.913 -2.703) 5.341 1.926 ( 0.538 -3.593 -1.384) 3.888 2.089 ( -0.527 5.049 -1.158) 5.206 2.110 ( -2.548 5.988 -0.838) 6.561 2.492 ( -1.328 2.260 4.651) 5.339 2.556 ( 0.892 1.019 1.516) 2.033 2.973 ( 0.471 -2.053 2.383) 3.180 2.999 ( -0.596 -1.192 4.644) 4.831 4.570 ( -0.917 -6.599 1.922) 6.934 4.580 ( -0.341 -6.687 1.514) 6.865 5.836 ( -6.329 0.407 6.888) 9.363 5.980 ( 2.297 -2.575 1.661) 3.830 6.198 ( 0.176 -0.489 0.491) 0.715 6.256 ( -0.738 0.056 4.584) 4.644 7.839 ( -1.520 3.059 0.013) 3.416 7.910 ( 1.858 2.747 -1.741) 3.746 8.027 ( 2.418 -1.292 -4.021) 4.866 8.067 ( 0.354 -1.232 -0.671) 1.447 8.325 ( 0.618 10.481 1.949) 10.679 8.438 ( -1.998 7.880 2.468) 8.496 9.018 ( 0.191 -7.206 1.226) 7.312 9.064 ( 0.279 -6.662 0.512) 6.687 ======================= Grid point 111 (54/309) ======================= q-point: (-0.47 0.20 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 510 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.594 ( 0.044 2.486 0.627) 2.564 1.715 ( 2.308 -0.068 2.250) 3.224 1.814 ( -3.733 -2.136 -5.104) 6.674 1.890 ( -0.848 -2.778 -2.539) 3.858 2.074 ( 0.961 4.461 -2.283) 5.103 2.094 ( 1.373 5.639 -0.930) 5.878 2.565 ( 0.139 1.789 6.390) 6.637 2.624 ( 1.694 2.673 5.552) 6.391 3.009 ( -2.087 -2.123 4.148) 5.106 3.081 ( -0.097 -1.178 7.255) 7.351 4.599 ( -0.220 -6.664 3.348) 7.461 4.613 ( 0.300 -6.731 3.058) 7.399 5.845 ( -6.353 1.507 7.907) 10.255 6.090 ( 2.392 -5.501 6.992) 9.213 6.257 ( 3.597 1.104 4.294) 5.709 6.348 ( 2.684 0.913 7.070) 7.618 7.796 ( -2.556 2.367 -1.647) 3.853 7.907 ( 0.782 0.901 -2.707) 2.958 7.982 ( -1.073 0.485 -2.431) 2.701 8.038 ( 1.459 -0.176 -4.000) 4.261 8.417 ( 3.519 8.607 5.060) 10.587 8.434 ( -2.758 8.364 2.161) 9.068 9.045 ( 0.032 -7.028 2.375) 7.419 9.071 ( -0.543 -6.523 1.073) 6.632 ======================= Grid point 112 (55/309) ======================= q-point: (-0.41 0.20 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 510 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.600 ( -0.507 2.682 -0.744) 2.829 1.700 ( -2.573 0.978 -2.695) 3.852 1.810 ( 3.379 -2.677 1.924) 4.721 1.815 ( -3.095 -0.729 -1.056) 3.350 2.043 ( 0.532 3.316 -3.813) 5.081 2.111 ( 2.661 3.250 -1.533) 4.472 2.651 ( -0.372 0.982 5.998) 6.089 2.742 ( 1.039 4.200 7.750) 8.875 3.016 ( -4.561 -1.630 3.883) 6.208 3.160 ( -2.680 -0.984 6.387) 6.996 4.645 ( -0.658 -6.409 3.955) 7.559 4.663 ( 0.291 -6.632 3.381) 7.450 5.852 ( -7.379 3.066 7.876) 11.219 6.187 ( -2.489 -7.508 7.308) 10.769 6.427 ( 7.398 2.551 6.985) 10.489 6.516 ( 4.962 0.442 8.203) 9.597 7.719 ( -3.783 1.706 -2.855) 5.037 7.844 ( -2.948 -2.493 -2.697) 4.710 7.973 ( 2.282 2.516 -1.236) 3.615 8.007 ( 1.681 -0.199 -3.964) 4.310 8.413 ( -3.470 9.547 1.732) 10.305 8.539 ( 3.375 7.370 4.746) 9.393 9.080 ( 0.108 -6.554 2.084) 6.878 9.088 ( -0.471 -6.346 3.373) 7.202 ======================= Grid point 113 (56/309) ======================= q-point: (-0.35 0.20 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 510 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.533 ( -5.521 2.617 -2.164) 6.482 1.637 ( -5.461 2.871 -1.581) 6.369 1.733 ( -0.473 2.298 -1.228) 2.648 1.889 ( 0.314 0.564 -1.393) 1.535 2.034 ( 4.806 -1.353 -0.174) 4.996 2.114 ( 1.109 -0.069 -2.681) 2.902 2.699 ( -3.536 0.022 4.422) 5.662 2.843 ( -1.480 4.097 6.748) 8.031 2.968 ( -7.813 -1.511 2.171) 8.249 3.160 ( -6.331 0.701 3.621) 7.326 4.676 ( -2.295 -5.849 3.453) 7.170 4.704 ( -0.432 -6.539 2.435) 6.991 5.837 ( -8.077 4.259 6.850) 11.415 6.232 ( -3.792 -7.280 6.512) 10.478 6.621 ( 6.060 2.099 5.772) 8.628 6.692 ( 4.321 -0.088 6.739) 8.006 7.598 ( -5.880 1.385 -4.495) 7.530 7.774 ( -3.656 -4.980 -0.128) 6.179 7.974 ( 2.260 0.469 -4.108) 4.712 8.003 ( 1.753 0.844 -0.142) 1.951 8.379 ( -3.895 11.647 1.467) 12.368 8.640 ( 2.745 6.508 3.253) 7.776 9.117 ( -0.014 -6.787 3.289) 7.542 9.141 ( 0.904 -5.343 3.802) 6.619 ======================= Grid point 114 (57/309) ======================= q-point: (-0.29 0.20 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 510 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.360 ( -13.413 4.221 -2.575) 14.296 1.518 ( -5.020 -0.162 -3.478) 6.109 1.709 ( -2.891 6.312 -2.788) 7.481 1.844 ( 0.804 2.802 -1.386) 3.228 2.049 ( -3.621 -2.927 -2.881) 5.475 2.140 ( 5.771 -3.781 -0.204) 6.902 2.626 ( -10.374 1.190 -2.043) 10.640 2.846 ( -9.655 -4.178 2.362) 10.782 2.866 ( -6.925 4.337 3.333) 8.825 3.092 ( -7.136 2.110 1.960) 7.695 4.666 ( -4.286 -5.217 2.272) 7.124 4.711 ( -1.657 -6.555 0.774) 6.805 5.800 ( -7.869 5.181 5.263) 10.792 6.253 ( -4.048 -7.632 5.107) 10.035 6.755 ( 4.062 2.143 2.958) 5.463 6.822 ( 3.236 -0.306 4.211) 5.320 7.416 ( -9.184 1.716 -5.944) 11.073 7.725 ( -4.858 -8.848 1.877) 10.267 7.950 ( 1.250 0.541 -3.170) 3.450 8.022 ( 0.424 -0.676 0.140) 0.810 8.344 ( -3.601 14.820 2.007) 15.383 8.712 ( 2.851 5.682 1.413) 6.512 9.153 ( -1.246 -6.743 2.924) 7.454 9.223 ( 2.813 -4.699 3.839) 6.688 ======================= Grid point 115 (58/309) ======================= q-point: (-0.24 0.20 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 510 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.083 ( -17.452 4.725 -3.670) 18.449 1.368 ( -8.011 2.903 -5.530) 10.158 1.583 ( -5.064 -0.365 -3.760) 6.318 1.879 ( 1.128 2.158 -0.211) 2.444 1.918 ( -7.929 -1.970 -1.022) 8.233 2.167 ( -2.187 -2.913 -2.976) 4.703 2.339 ( -14.774 6.713 -8.027) 18.104 2.713 ( -11.686 -1.812 0.619) 11.842 2.772 ( -9.453 -1.170 1.667) 9.670 3.007 ( -6.081 -0.040 -0.286) 6.088 4.612 ( -5.738 -4.684 0.920) 7.464 4.676 ( -2.858 -6.453 -0.906) 7.116 5.749 ( -6.759 5.909 3.471) 9.626 6.252 ( -4.046 -8.332 3.628) 9.947 6.828 ( 2.666 2.416 0.622) 3.651 6.912 ( 2.950 -0.802 2.098) 3.708 7.161 ( -12.770 3.064 -6.931) 14.849 7.667 ( -7.513 -14.462 2.782) 16.533 7.922 ( -0.059 0.793 -2.296) 2.429 8.013 ( -1.899 -1.735 0.132) 2.576 8.339 ( -2.609 17.721 4.270) 18.414 8.767 ( 4.107 5.628 -0.866) 7.021 9.155 ( -2.662 -6.698 1.532) 7.369 9.318 ( 3.420 -4.675 2.857) 6.459 ======================= Grid point 116 (59/309) ======================= q-point: (-0.18 0.20 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 510 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.760 ( -18.669 6.289 -2.866) 19.907 1.118 ( -12.691 9.272 -7.844) 17.566 1.499 ( -3.050 -10.169 -0.005) 10.616 1.695 ( -14.510 -4.725 -1.927) 15.381 1.813 ( -21.365 11.782 -7.631) 25.564 1.975 ( 0.958 3.787 0.522) 3.941 2.165 ( -4.250 2.196 -3.653) 6.019 2.499 ( -14.721 1.363 -2.253) 14.955 2.657 ( -6.859 -4.985 -0.766) 8.514 2.903 ( -4.625 -5.323 -2.570) 7.505 4.525 ( -6.359 -4.099 -0.273) 7.570 4.609 ( -3.326 -6.108 -1.773) 7.177 5.695 ( -5.155 6.503 1.698) 8.470 6.235 ( -3.799 -9.132 2.722) 10.258 6.781 ( -14.708 0.662 -6.392) 16.050 6.874 ( -0.585 1.933 -1.559) 2.551 7.029 ( 3.816 1.897 1.224) 4.434 7.569 ( -10.821 -20.929 2.648) 23.710 7.886 ( -1.353 0.995 -1.329) 2.142 7.971 ( -3.695 -1.477 -0.067) 3.980 8.389 ( -1.971 17.518 8.271) 19.472 8.810 ( 6.268 7.490 -4.234) 10.645 9.117 ( -3.913 -7.277 0.314) 8.268 9.396 ( 3.224 -4.903 1.278) 6.006 ======================= Grid point 117 (60/309) ======================= q-point: (-0.12 0.20 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 510 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.516 ( -12.736 14.504 4.820) 19.895 0.806 ( -15.540 13.329 -5.786) 21.275 1.317 ( -22.754 13.825 -6.787) 27.476 1.440 ( -14.786 -5.025 0.876) 15.641 1.530 ( -3.267 -2.672 1.411) 4.450 1.993 ( -3.594 0.749 -0.879) 3.775 2.054 ( -4.478 2.498 -0.207) 5.132 2.255 ( -10.375 2.268 -3.005) 11.037 2.542 ( -4.617 -3.820 -3.121) 6.756 2.831 ( -0.838 -10.455 -1.084) 10.545 4.425 ( -5.803 -3.150 -0.521) 6.624 4.540 ( -2.832 -5.891 -1.153) 6.638 5.644 ( -3.671 7.261 0.496) 8.152 6.217 ( -3.232 -10.175 2.302) 10.922 6.432 ( -18.072 1.224 -4.818) 18.744 6.821 ( -7.987 -5.865 -0.924) 9.952 7.123 ( 5.932 0.822 0.596) 6.018 7.422 ( -11.909 -22.751 1.360) 25.715 7.847 ( -2.304 0.779 -0.473) 2.477 7.904 ( -4.652 -0.852 -0.594) 4.767 8.500 ( -1.373 10.091 10.191) 14.407 8.840 ( 8.895 13.903 -7.203) 18.008 9.056 ( -4.188 -8.399 0.181) 9.388 9.448 ( 2.658 -5.077 -0.091) 5.732 ======================= Grid point 118 (61/309) ======================= q-point: (-0.06 0.20 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 510 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.475 ( -5.360 21.369 -1.960) 22.118 0.549 ( -15.053 15.441 5.377) 22.224 0.978 ( -14.646 31.144 5.845) 34.908 1.260 ( -12.638 -5.897 3.884) 14.477 1.551 ( 0.999 -4.310 1.449) 4.656 1.900 ( -3.926 0.274 -0.293) 3.947 1.932 ( -8.153 0.119 -2.444) 8.512 2.190 ( 3.229 5.784 -3.914) 7.694 2.481 ( -0.991 -4.744 2.569) 5.485 2.844 ( 0.893 -11.666 2.374) 11.939 4.361 ( -2.995 -2.003 1.614) 3.948 4.507 ( -1.415 -6.001 1.841) 6.435 5.638 ( -0.217 7.174 8.260) 10.942 6.165 ( -8.115 -4.270 -0.656) 9.193 6.210 ( -8.226 -6.864 5.900) 12.230 6.531 ( -32.027 -18.647 3.972) 37.272 7.200 ( 4.682 0.688 -1.800) 5.063 7.287 ( -4.794 -7.705 -1.873) 9.266 7.802 ( -2.392 0.247 -0.923) 2.576 7.829 ( -3.367 -0.402 -0.761) 3.476 8.505 ( -0.928 7.817 -9.499) 12.337 8.936 ( 4.846 7.607 4.705) 10.173 9.025 ( 1.414 -4.046 -0.169) 4.290 9.475 ( 1.790 -4.858 -0.772) 5.234 ======================= Grid point 119 (62/309) ======================= q-point: ( 0.00 0.40 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 510 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.747 ( -2.819 22.617 -7.817) 24.095 0.773 ( -2.197 14.102 5.176) 15.182 1.007 ( -2.469 -10.582 2.361) 11.119 1.115 ( -1.511 -15.504 -4.300) 16.160 1.856 ( 2.730 1.953 -0.460) 3.388 1.884 ( 2.974 -1.003 0.767) 3.232 1.909 ( -1.760 28.767 10.453) 30.657 2.247 ( 0.889 0.951 -2.294) 2.638 2.456 ( 1.049 -5.527 6.800) 8.825 2.576 ( -0.605 -16.735 0.684) 16.760 4.368 ( -0.368 0.926 4.752) 4.855 4.432 ( -0.163 -5.778 5.055) 7.678 5.972 ( -1.551 5.473 14.665) 15.730 6.119 ( 0.398 1.132 7.670) 7.764 6.131 ( -7.516 -9.052 8.630) 14.592 6.144 ( 4.316 -2.125 8.197) 9.505 7.218 ( 0.492 1.043 -3.650) 3.827 7.230 ( 0.580 -0.196 -3.314) 3.370 7.774 ( 0.860 0.421 -1.603) 1.867 7.784 ( 0.363 -0.565 -1.139) 1.322 8.605 ( -0.054 11.668 -3.183) 12.094 8.814 ( -0.237 -10.772 -0.217) 10.777 9.194 ( 0.626 8.668 -0.586) 8.710 9.357 ( 0.627 -8.118 -1.081) 8.214 ======================= Grid point 120 (63/309) ======================= q-point: ( 0.06 0.40 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 510 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.682 ( 3.072 19.211 1.514) 19.514 0.940 ( 10.935 7.236 6.348) 14.569 1.067 ( 3.276 -17.314 0.708) 17.635 1.122 ( 11.902 -8.513 3.073) 14.953 1.914 ( 5.261 4.568 1.502) 7.127 1.964 ( 5.776 -1.188 1.248) 6.028 2.080 ( 4.446 22.280 4.631) 23.186 2.268 ( 4.135 5.228 2.445) 7.100 2.523 ( -0.382 -5.635 2.625) 6.228 2.659 ( 2.144 -15.783 10.039) 18.828 4.441 ( -0.417 0.398 6.137) 6.164 4.500 ( -0.735 -5.598 5.582) 7.939 5.999 ( -11.546 4.861 11.803) 17.212 6.113 ( -7.370 -6.830 8.457) 13.133 6.441 ( 15.190 1.851 12.418) 19.707 6.521 ( 18.502 -6.948 11.434) 22.833 7.141 ( -2.396 1.798 -4.599) 5.488 7.169 ( -1.041 -1.240 -4.152) 4.457 7.790 ( 4.457 0.319 -2.353) 5.050 7.798 ( 3.818 -0.466 -1.751) 4.226 8.573 ( 0.968 13.986 -2.354) 14.215 8.812 ( 0.833 -11.679 -1.020) 11.753 9.170 ( -2.059 8.549 -0.938) 8.843 9.330 ( -1.299 -7.838 -2.112) 8.221 ======================= Grid point 121 (64/309) ======================= q-point: ( 0.12 0.40 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 510 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.853 ( 9.463 11.912 7.128) 16.800 1.104 ( 7.091 -11.867 2.684) 14.082 1.344 ( 16.786 0.443 10.458) 19.782 1.421 ( 16.819 -5.994 6.682) 19.065 2.009 ( 3.306 5.161 -1.052) 6.219 2.038 ( 4.152 1.221 -0.412) 4.348 2.194 ( 8.666 11.727 1.020) 14.617 2.388 ( 5.629 -5.983 0.928) 8.267 2.612 ( 3.880 7.687 7.473) 11.401 2.832 ( 2.849 -10.884 8.615) 14.170 4.512 ( -1.005 -0.554 5.624) 5.740 4.559 ( -1.196 -5.391 5.033) 7.472 5.995 ( -9.685 5.953 10.649) 15.577 6.123 ( -6.448 -7.443 7.676) 12.486 6.813 ( 11.199 1.705 9.129) 14.548 6.860 ( 7.218 -2.746 4.811) 9.098 7.056 ( 0.444 3.495 -2.597) 4.377 7.142 ( 6.093 -6.359 -0.905) 8.854 7.832 ( 5.914 0.344 -3.110) 6.691 7.840 ( 5.362 -0.496 -2.335) 5.869 8.566 ( 1.257 14.625 -1.265) 14.733 8.804 ( 0.726 -10.371 -1.898) 10.569 9.117 ( -2.918 6.771 -1.142) 7.461 9.263 ( -2.789 -7.493 -3.227) 8.622 ======================= Grid point 122 (65/309) ======================= q-point: ( 0.18 0.40 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 510 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.107 ( 11.648 7.920 5.953) 15.292 1.273 ( 9.450 -8.610 3.203) 13.179 1.713 ( 12.042 1.350 9.792) 15.580 1.750 ( 13.276 -2.777 6.979) 15.253 1.976 ( -1.204 6.831 -3.343) 7.699 2.073 ( 1.796 -3.352 -2.886) 4.774 2.353 ( 11.217 5.522 -0.579) 12.516 2.478 ( 7.246 -7.732 -0.476) 10.608 2.788 ( 5.297 10.935 6.149) 13.618 2.961 ( 1.855 -6.000 4.889) 7.959 4.560 ( -1.573 -1.356 4.162) 4.651 4.597 ( -1.747 -5.276 3.602) 6.623 5.994 ( -8.945 6.232 9.225) 14.281 6.123 ( -6.502 -7.464 6.328) 11.749 6.854 ( -3.153 0.845 -4.022) 5.180 6.864 ( -3.184 -0.287 -3.651) 4.853 7.231 ( 11.504 3.785 7.650) 14.325 7.331 ( 11.074 -6.895 4.340) 13.748 7.877 ( 6.310 0.531 -3.656) 7.312 7.889 ( 5.601 -0.595 -2.652) 6.226 8.574 ( 1.206 14.172 -0.332) 14.227 8.782 ( 0.387 -6.376 -2.471) 6.849 9.053 ( -3.259 2.466 -1.628) 4.399 9.162 ( -3.813 -6.958 -4.163) 8.960 ======================= Grid point 123 (66/309) ======================= q-point: ( 0.24 0.40 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 510 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.346 ( 11.184 5.609 3.812) 13.079 1.453 ( 9.217 -5.074 2.252) 10.759 1.852 ( -1.119 5.344 -3.217) 6.337 1.921 ( 0.588 -1.558 -1.961) 2.572 2.017 ( 6.763 1.436 6.044) 9.183 2.067 ( 2.806 -3.623 2.375) 5.162 2.490 ( 9.336 3.705 -2.312) 10.307 2.588 ( 8.168 -6.143 -1.353) 10.309 2.909 ( 2.761 8.396 2.457) 9.174 3.021 ( 0.730 -2.542 1.170) 2.892 4.576 ( -2.284 -2.137 2.310) 3.889 4.602 ( -2.455 -4.970 1.693) 5.796 5.978 ( -8.474 5.831 7.533) 12.750 6.100 ( -6.667 -7.090 4.704) 10.810 6.719 ( -4.308 1.005 -7.060) 8.331 6.736 ( -4.620 -0.840 -6.233) 7.804 7.483 ( 8.494 1.929 7.004) 11.177 7.534 ( 7.965 -3.554 4.533) 9.829 7.919 ( 6.098 0.792 -3.895) 7.279 7.933 ( 5.268 -0.579 -2.753) 5.972 8.592 ( 0.952 13.409 0.458) 13.451 8.753 ( 0.456 -0.783 -2.532) 2.689 8.974 ( -3.672 -2.901 -2.251) 5.193 9.043 ( -3.979 -6.887 -4.459) 9.118 ======================= Grid point 124 (67/309) ======================= q-point: ( 0.29 0.40 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 510 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.537 ( 8.805 3.735 2.077) 9.787 1.599 ( 7.210 -2.251 0.955) 7.613 1.780 ( -0.848 1.861 -3.158) 3.762 1.824 ( -2.510 -2.990 -5.672) 6.886 2.162 ( 2.519 1.721 4.571) 5.496 2.170 ( 1.450 1.047 4.942) 5.256 2.564 ( 5.258 3.887 -2.863) 7.138 2.655 ( 4.402 -4.834 -3.369) 7.355 2.940 ( 0.267 5.763 -0.408) 5.783 3.020 ( -0.075 -2.087 -1.840) 2.783 4.555 ( -3.075 -2.877 0.563) 4.248 4.571 ( -3.109 -4.590 -0.050) 5.544 5.949 ( -7.794 4.943 6.060) 11.041 6.056 ( -6.451 -6.480 3.337) 9.734 6.537 ( -4.939 1.220 -9.136) 10.457 6.561 ( -5.426 -1.376 -8.233) 9.956 7.674 ( 5.309 1.433 5.930) 8.087 7.702 ( 6.005 -1.612 5.250) 8.138 7.951 ( 5.240 1.261 -3.844) 6.620 7.970 ( 4.789 -0.647 -2.802) 5.586 8.611 ( 0.283 13.222 0.860) 13.253 8.720 ( -0.497 6.282 -2.826) 6.906 8.893 ( -2.627 -8.775 -1.877) 9.350 8.934 ( -2.869 -8.392 -3.642) 9.587 ======================= Grid point 125 (68/309) ======================= q-point: ( 0.35 0.40 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 510 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.654 ( 3.658 2.265 0.752) 4.368 1.687 ( 3.134 -1.172 -0.541) 3.390 1.748 ( 1.644 0.050 -1.637) 2.320 1.768 ( 2.672 -1.540 -0.906) 3.214 2.224 ( -0.544 2.508 2.505) 3.586 2.229 ( -1.159 2.078 3.433) 4.177 2.570 ( 0.555 3.182 -2.237) 3.929 2.625 ( -0.314 -1.520 -4.560) 4.817 2.932 ( 0.176 1.951 -0.696) 2.079 2.976 ( -0.694 -2.071 -3.146) 3.830 4.507 ( -3.213 -3.503 -0.260) 4.760 4.516 ( -3.100 -4.374 -0.808) 5.421 5.913 ( -7.106 3.732 4.929) 9.420 5.999 ( -5.966 -5.529 1.786) 8.328 6.346 ( -3.970 1.213 -7.940) 8.960 6.369 ( -4.695 -1.395 -7.782) 9.195 7.811 ( 3.077 2.608 5.082) 6.488 7.852 ( 4.062 -1.654 5.257) 6.846 7.970 ( 4.198 1.890 -3.576) 5.830 7.998 ( 4.216 -0.984 -3.064) 5.304 8.622 ( -0.480 13.175 0.890) 13.214 8.653 ( -2.576 10.956 -3.042) 11.659 8.856 ( -0.858 -10.941 -1.454) 11.071 8.868 ( -0.394 -11.192 -1.096) 11.253 ======================= Grid point 126 (69/309) ======================= q-point: ( 0.41 0.40 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 510 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.679 ( -0.754 2.079 0.411) 2.250 1.688 ( 0.680 0.817 -0.666) 1.254 1.805 ( 4.221 -0.724 -0.135) 4.285 1.825 ( 4.200 -2.451 0.322) 4.874 2.219 ( -1.994 3.523 -0.067) 4.049 2.231 ( -2.115 2.377 0.646) 3.247 2.536 ( -2.461 2.134 0.255) 3.267 2.562 ( -1.250 -0.439 -1.437) 1.954 2.933 ( 0.127 -0.567 0.093) 0.588 2.938 ( -0.093 -0.974 -0.160) 0.992 4.464 ( -2.325 -3.927 0.340) 4.576 4.469 ( -2.056 -4.373 -0.063) 4.832 5.874 ( -6.032 2.327 4.102) 7.656 5.932 ( -4.255 -3.744 0.414) 5.683 6.232 ( -1.691 0.121 -2.873) 3.335 6.238 ( -2.118 -0.551 -2.492) 3.317 7.898 ( 0.726 3.505 2.950) 4.638 7.940 ( 1.513 -0.209 0.416) 1.583 7.997 ( 3.648 -0.025 -0.065) 3.649 8.012 ( 3.519 -1.122 -3.211) 4.894 8.578 ( -2.140 12.979 -1.494) 13.239 8.630 ( -0.778 12.460 1.296) 12.552 8.828 ( -0.313 -11.592 -0.517) 11.607 8.874 ( 0.673 -11.520 0.413) 11.547 ======================= Grid point 127 (70/309) ======================= q-point: ( 0.47 0.40 -0.92) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 510 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.661 ( -0.724 3.277 -0.460) 3.387 1.697 ( 0.091 0.136 0.541) 0.566 1.834 ( 2.047 -0.999 -2.729) 3.554 1.859 ( 0.810 -3.142 -1.704) 3.665 2.183 ( -0.451 3.984 -1.669) 4.342 2.201 ( -0.944 2.540 -0.974) 2.880 2.536 ( -1.092 2.256 4.283) 4.962 2.567 ( -0.471 -0.509 4.209) 4.265 2.948 ( 0.251 0.015 2.391) 2.404 2.970 ( -0.146 -1.732 4.164) 4.512 4.454 ( -0.964 -4.058 1.793) 4.540 4.459 ( -0.714 -4.546 1.681) 4.899 5.859 ( -3.931 2.222 5.117) 6.824 5.916 ( -1.341 -3.674 3.906) 5.527 6.210 ( 0.724 1.440 1.439) 2.161 6.240 ( 0.378 -1.490 3.481) 3.805 7.904 ( -0.966 3.398 -1.244) 3.745 7.943 ( 0.582 -0.093 -1.851) 1.942 8.014 ( 1.951 0.230 -2.611) 3.267 8.036 ( 1.397 -1.757 -0.693) 2.349 8.564 ( 0.094 13.995 1.882) 14.122 8.638 ( -0.994 12.129 1.753) 12.296 8.832 ( 0.187 -11.785 1.242) 11.852 8.888 ( 0.019 -11.557 0.775) 11.583 ======================= Grid point 128 (71/309) ======================= q-point: (-0.47 0.40 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 510 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.656 ( 0.732 3.747 -0.041) 3.818 1.708 ( 0.524 -1.270 0.847) 1.614 1.787 ( -1.225 0.004 -4.227) 4.401 1.826 ( 0.153 -3.567 -3.119) 4.741 2.158 ( 0.312 3.829 -2.487) 4.577 2.181 ( 0.206 2.050 -1.490) 2.543 2.611 ( 0.508 3.160 6.342) 7.104 2.657 ( 0.681 -0.523 7.942) 7.988 2.993 ( -0.956 1.350 4.499) 4.793 3.043 ( -0.660 -2.841 6.943) 7.530 4.482 ( 0.061 -3.999 3.192) 5.116 4.490 ( 0.218 -4.679 3.147) 5.644 5.893 ( -3.783 3.678 7.474) 9.149 5.981 ( -1.415 -5.595 7.272) 9.284 6.295 ( 4.239 2.496 5.469) 7.356 6.338 ( 3.231 -1.771 6.744) 7.685 7.850 ( -2.428 3.028 -2.782) 4.775 7.897 ( -1.848 -1.773 -3.554) 4.381 8.004 ( 1.418 1.408 -2.197) 2.970 8.027 ( 1.307 -0.982 -3.030) 3.443 8.624 ( 1.734 12.625 4.340) 13.463 8.646 ( -1.362 13.179 2.009) 13.401 8.865 ( 0.504 -11.547 2.744) 11.879 8.896 ( -0.793 -11.789 1.319) 11.889 ======================= Grid point 129 (72/309) ======================= q-point: (-0.41 0.40 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 510 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.670 ( -0.101 4.192 -1.256) 4.377 1.712 ( -0.457 0.056 -0.589) 0.748 1.764 ( 2.945 -1.599 1.085) 3.522 1.779 ( -0.573 -2.863 -2.438) 3.804 2.117 ( -0.364 3.858 -3.550) 5.256 2.155 ( -0.322 0.392 -2.458) 2.509 2.700 ( -0.766 4.075 6.152) 7.419 2.773 ( -0.580 -2.177 7.760) 8.081 3.032 ( -2.780 4.119 4.865) 6.955 3.119 ( -2.571 -3.765 6.958) 8.318 4.533 ( 0.104 -3.805 3.659) 5.280 4.542 ( 0.325 -4.650 3.541) 5.854 5.931 ( -5.440 5.360 7.906) 10.992 6.048 ( -3.632 -7.007 7.790) 11.089 6.469 ( 6.268 2.202 7.476) 10.002 6.506 ( 5.011 -1.506 8.049) 9.600 7.759 ( -4.037 2.374 -3.393) 5.783 7.802 ( -3.917 -2.174 -3.560) 5.722 7.999 ( 1.963 0.566 -2.355) 3.117 8.004 ( 1.815 -0.127 -3.575) 4.011 8.648 ( -1.792 14.251 1.886) 14.486 8.717 ( 1.840 10.944 4.448) 11.956 8.904 ( -0.437 -12.019 2.226) 12.231 8.925 ( 0.638 -10.484 4.171) 11.301 ======================= Grid point 130 (73/309) ======================= q-point: (-0.35 0.40 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 510 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.598 ( -4.363 3.760 -3.056) 6.521 1.652 ( -5.845 -1.395 -3.020) 6.726 1.795 ( 3.733 3.826 1.749) 5.624 1.864 ( 4.708 -3.178 2.371) 6.155 2.050 ( -1.266 2.668 -4.038) 5.002 2.097 ( -1.850 -1.809 -3.768) 4.571 2.737 ( -4.414 3.894 4.522) 7.422 2.824 ( -4.850 -4.591 4.953) 8.315 3.036 ( -4.868 6.931 3.823) 9.292 3.141 ( -5.311 -3.380 4.686) 7.848 4.574 ( -1.086 -3.447 2.976) 4.681 4.585 ( -0.616 -4.579 2.698) 5.350 5.943 ( -6.519 6.830 6.866) 11.674 6.084 ( -4.882 -8.055 6.829) 11.634 6.655 ( 5.353 1.627 6.235) 8.377 6.682 ( 4.426 -1.107 6.634) 8.052 7.636 ( -5.936 2.555 -3.926) 7.562 7.693 ( -5.179 -3.645 -2.370) 6.762 7.983 ( 1.784 0.649 -3.254) 3.768 7.998 ( 1.669 -0.821 -1.924) 2.676 8.645 ( -2.104 14.907 1.915) 15.176 8.783 ( 0.495 6.562 2.583) 7.070 8.949 ( 0.638 -9.286 4.154) 10.192 9.004 ( 1.811 -8.694 4.454) 9.935 ======================= Grid point 131 (74/309) ======================= q-point: (-0.29 0.40 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 510 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.445 ( -10.811 4.123 -3.418) 12.065 1.500 ( -7.165 -1.806 -4.083) 8.442 1.837 ( -2.985 6.294 -3.592) 7.837 1.902 ( 2.251 1.564 -1.412) 3.083 1.989 ( -4.217 -1.645 -2.279) 5.068 2.049 ( 3.610 -5.395 0.284) 6.497 2.678 ( -9.150 4.028 1.001) 10.047 2.760 ( -9.359 -4.601 1.949) 10.609 2.980 ( -8.160 7.081 1.760) 10.947 3.087 ( -7.775 -3.232 1.791) 8.608 4.576 ( -2.900 -2.933 1.685) 4.456 4.592 ( -2.051 -4.615 1.173) 5.185 5.927 ( -6.519 8.073 5.156) 11.587 6.090 ( -5.137 -9.140 5.138) 11.676 6.790 ( 3.840 1.485 3.504) 5.406 6.812 ( 3.368 -0.868 3.973) 5.280 7.471 ( -8.716 4.271 -4.411) 10.662 7.576 ( -7.226 -6.931 -1.614) 10.142 7.966 ( 0.897 1.139 -2.362) 2.771 7.993 ( 0.479 -1.749 -1.253) 2.204 8.641 ( -2.201 15.188 2.458) 15.542 8.815 ( 0.134 1.202 1.861) 2.220 9.016 ( 0.630 -4.165 3.504) 5.480 9.098 ( 3.057 -7.976 3.760) 9.333 ======================= Grid point 132 (75/309) ======================= q-point: (-0.24 0.40 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 510 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.199 ( -14.589 7.189 -3.874) 16.719 1.331 ( -8.546 -6.112 -3.164) 10.973 1.649 ( -9.571 6.758 -7.342) 13.827 1.787 ( -9.012 -7.286 -5.134) 12.676 2.001 ( 2.355 5.900 1.707) 6.578 2.100 ( 1.248 -4.477 -0.240) 4.654 2.493 ( -12.157 8.544 -3.453) 15.255 2.626 ( -10.307 -5.938 0.640) 11.913 2.831 ( -12.545 6.233 -1.027) 14.046 2.957 ( -10.066 -5.579 -1.451) 11.600 4.535 ( -4.330 -2.263 0.374) 4.900 4.558 ( -3.208 -4.677 -0.282) 5.678 5.893 ( -5.707 9.007 3.334) 11.173 6.073 ( -4.793 -10.040 3.369) 11.624 6.868 ( 2.413 1.666 0.958) 3.085 6.893 ( 2.335 -1.147 1.419) 2.964 7.254 ( -11.644 7.009 -4.635) 14.360 7.425 ( -10.275 -11.263 -1.495) 15.319 7.943 ( -0.521 1.436 -1.434) 2.095 7.975 ( -1.187 -2.004 -0.606) 2.407 8.648 ( -2.284 14.700 3.429) 15.267 8.845 ( 0.402 -2.844 1.932) 3.462 9.055 ( 0.481 1.264 1.060) 1.718 9.189 ( 3.572 -8.669 2.097) 9.607 ======================= Grid point 133 (76/309) ======================= q-point: (-0.18 0.40 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 510 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.943 ( -13.501 12.365 -0.819) 18.326 1.179 ( -7.541 -10.075 -0.674) 12.602 1.381 ( -13.728 6.513 -5.431) 16.136 1.555 ( -13.658 -9.292 -3.450) 16.875 2.039 ( 0.118 2.789 -0.583) 2.851 2.041 ( -6.825 5.103 -2.321) 8.832 2.281 ( -7.486 12.464 -3.837) 15.037 2.493 ( -8.203 -6.860 0.486) 10.704 2.593 ( -13.461 3.591 -3.747) 14.427 2.751 ( -11.687 -10.365 -4.537) 16.267 4.464 ( -4.863 -1.381 -0.534) 5.084 4.495 ( -3.609 -4.700 -1.115) 6.030 5.851 ( -4.423 9.661 1.768) 10.771 6.043 ( -4.015 -10.665 1.988) 11.568 6.821 ( -12.032 3.279 -4.106) 13.130 6.876 ( -4.696 -1.797 -1.806) 5.342 7.091 ( -0.820 5.171 -0.269) 5.242 7.251 ( -8.975 -12.650 -0.664) 15.525 7.910 ( -1.993 1.467 -0.693) 2.569 7.940 ( -2.802 -1.722 -0.265) 3.300 8.664 ( -2.521 12.752 3.905) 13.573 8.873 ( -0.705 -7.807 2.057) 8.104 9.068 ( 2.220 8.378 -1.493) 8.795 9.259 ( 3.674 -9.546 0.329) 10.234 ======================= Grid point 134 (77/309) ======================= q-point: (-0.12 0.40 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 510 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.834 ( -5.293 17.557 5.992) 19.292 1.051 ( -11.728 9.391 -2.239) 15.190 1.168 ( -7.707 -10.966 3.090) 13.755 1.308 ( -14.686 -10.753 -0.800) 18.220 1.858 ( -8.072 17.193 -3.615) 19.335 1.990 ( -4.487 -1.608 -2.427) 5.349 2.167 ( -8.363 13.332 -0.433) 15.744 2.326 ( -6.972 5.028 -1.378) 8.706 2.446 ( -5.565 -6.073 -3.449) 8.930 2.544 ( -4.179 -19.656 -1.913) 20.186 4.385 ( -4.254 -0.290 -0.471) 4.290 4.429 ( -3.206 -4.837 -0.817) 5.860 5.813 ( -2.794 10.245 0.834) 10.652 6.012 ( -2.808 -10.922 0.999) 11.322 6.496 ( -20.547 5.788 -3.047) 21.563 6.649 ( -20.843 -10.229 -2.061) 23.308 7.145 ( 5.137 1.642 0.285) 5.401 7.197 ( 1.226 -4.888 0.074) 5.040 7.864 ( -3.102 1.031 -0.420) 3.296 7.884 ( -3.911 -1.100 -0.456) 4.088 8.673 ( -2.327 9.703 2.378) 10.258 8.867 ( -2.864 -10.697 0.998) 11.119 9.099 ( 5.088 12.702 -1.635) 13.780 9.309 ( 3.436 -9.560 -0.600) 10.176 ======================= Grid point 135 (78/309) ======================= q-point: (-0.06 0.40 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 510 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.840 ( -12.582 15.274 1.807) 19.871 0.864 ( -1.559 18.980 0.016) 19.044 1.094 ( -12.214 -11.045 2.900) 16.721 1.167 ( -1.671 -10.933 -0.243) 11.063 1.774 ( -0.502 20.156 1.996) 20.261 1.896 ( -3.278 -1.093 -1.192) 3.655 1.978 ( -11.775 9.697 0.213) 15.255 2.290 ( -1.618 -5.245 -4.845) 7.321 2.358 ( 1.077 -0.108 5.129) 5.242 2.560 ( 2.293 -16.208 0.600) 16.381 4.341 ( -2.125 0.433 1.542) 2.660 4.392 ( -1.762 -5.070 1.787) 5.657 5.813 ( 0.136 10.559 3.945) 11.272 6.001 ( -0.038 -9.258 2.007) 9.473 6.212 ( -16.641 2.532 4.247) 17.360 6.305 ( -23.290 -7.937 4.006) 24.929 7.215 ( 4.411 0.844 -1.459) 4.722 7.231 ( 3.232 -1.131 -1.384) 3.693 7.809 ( -2.750 0.476 -0.925) 2.940 7.820 ( -3.110 -0.583 -0.820) 3.269 8.651 ( -1.396 8.841 -1.430) 9.064 8.832 ( -2.223 -9.859 0.147) 10.108 9.162 ( 4.286 10.433 -0.402) 11.286 9.345 ( 2.424 -8.737 -0.697) 9.094 ======================= Grid point 170 (79/309) ======================= q-point: ( 0.00 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 309 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.682 ( 0.559 0.000 16.503) 16.513 0.894 ( 1.084 0.000 20.182) 20.211 1.001 ( -0.809 0.000 25.371) 25.384 1.245 ( -5.116 0.000 2.366) 5.637 1.600 ( -0.973 0.000 -0.992) 1.390 1.782 ( 1.034 0.000 -2.115) 2.354 1.936 ( 8.985 0.000 -0.626) 9.007 1.960 ( -3.281 0.000 -2.821) 4.327 2.754 ( 1.124 0.000 7.689) 7.770 3.020 ( -0.845 0.000 -1.131) 1.411 4.565 ( -0.429 0.000 8.258) 8.269 4.693 ( -0.060 0.000 6.222) 6.222 6.290 ( -2.145 0.000 12.898) 13.075 6.393 ( -0.914 0.000 14.005) 14.035 6.468 ( -0.424 0.000 6.533) 6.547 6.905 ( 0.384 0.000 0.024) 0.385 6.954 ( -1.018 0.000 0.603) 1.183 7.069 ( 0.345 0.000 -6.005) 6.015 7.717 ( 0.833 0.000 -3.022) 3.135 7.774 ( 0.541 0.000 -1.848) 1.926 7.995 ( 0.807 0.000 5.493) 5.552 8.990 ( -0.121 0.000 -3.661) 3.663 9.117 ( -0.077 0.000 1.001) 1.004 9.453 ( 0.682 0.000 -3.672) 3.735 ======================= Grid point 171 (80/309) ======================= q-point: ( 0.06 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 309 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.876 ( -2.868 0.000 15.925) 16.181 1.176 ( 3.518 0.000 14.947) 15.355 1.339 ( 11.440 0.000 2.557) 11.722 1.444 ( 11.024 0.000 17.434) 20.627 1.627 ( 6.477 0.000 5.264) 8.346 1.822 ( 7.720 0.000 -2.511) 8.118 1.883 ( -2.809 0.000 -1.593) 3.229 2.111 ( 13.806 0.000 0.215) 13.808 2.844 ( -1.582 0.000 5.452) 5.677 2.991 ( -1.322 0.000 -0.825) 1.558 4.661 ( -1.691 0.000 7.773) 7.955 4.779 ( -0.399 0.000 6.371) 6.384 6.264 ( -21.044 0.000 16.442) 26.706 6.445 ( -7.119 0.000 8.362) 10.982 6.718 ( 10.970 0.000 12.598) 16.704 6.898 ( -1.075 0.000 -0.564) 1.214 6.977 ( -1.914 0.000 -5.299) 5.634 7.164 ( 19.673 0.000 -1.950) 19.770 7.706 ( 4.420 0.000 -4.574) 6.361 7.772 ( 3.104 0.000 -2.536) 4.008 8.084 ( 0.645 0.000 5.861) 5.896 8.911 ( -2.558 0.000 -4.411) 5.099 9.138 ( 0.709 0.000 1.156) 1.356 9.398 ( -0.826 0.000 -4.179) 4.260 ======================= Grid point 172 (81/309) ======================= q-point: ( 0.12 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 309 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.057 ( 0.059 0.000 13.904) 13.904 1.379 ( 3.229 0.000 6.687) 7.426 1.514 ( 8.410 0.000 -0.607) 8.432 1.683 ( 9.674 0.000 6.448) 11.626 1.845 ( -1.290 0.000 1.177) 1.747 1.920 ( 10.541 0.000 -3.913) 11.244 2.044 ( 18.761 0.000 14.619) 23.784 2.320 ( 13.520 0.000 -0.550) 13.531 2.854 ( -4.092 0.000 2.663) 4.882 2.954 ( -1.675 0.000 -1.433) 2.205 4.725 ( -2.864 0.000 6.640) 7.231 4.842 ( -1.748 0.000 4.747) 5.059 6.188 ( -18.870 0.000 16.164) 24.847 6.441 ( -6.920 0.000 6.271) 9.339 6.844 ( -3.263 0.000 -3.591) 4.852 6.880 ( -2.587 0.000 -3.209) 4.121 7.061 ( 11.689 0.000 11.773) 16.590 7.393 ( 14.033 0.000 -1.416) 14.104 7.718 ( 6.822 0.000 -6.131) 9.173 7.791 ( 4.696 0.000 -3.351) 5.769 8.174 ( 0.385 0.000 6.172) 6.184 8.803 ( -3.257 0.000 -4.737) 5.749 9.159 ( 0.191 0.000 0.614) 0.643 9.314 ( -2.344 0.000 -4.629) 5.189 ======================= Grid point 173 (82/309) ======================= q-point: ( 0.18 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 309 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.254 ( 2.659 0.000 11.713) 12.011 1.458 ( 3.015 0.000 -0.511) 3.058 1.612 ( 5.992 0.000 -0.005) 5.992 1.873 ( 0.524 0.000 2.501) 2.556 1.914 ( 10.281 0.000 3.897) 10.995 2.013 ( 9.338 0.000 -4.362) 10.307 2.447 ( 13.132 0.000 7.494) 15.120 2.467 ( 8.043 0.000 -2.672) 8.475 2.825 ( -2.353 0.000 1.864) 3.001 2.908 ( -0.608 0.000 -1.780) 1.881 4.758 ( -3.597 0.000 5.157) 6.288 4.852 ( -3.255 0.000 2.230) 3.945 6.137 ( -16.491 0.000 14.783) 22.147 6.410 ( -7.274 0.000 4.862) 8.750 6.708 ( -5.165 0.000 -6.785) 8.527 6.792 ( -4.005 0.000 -3.592) 5.380 7.368 ( 9.585 0.000 9.617) 13.578 7.554 ( 9.060 0.000 0.297) 9.065 7.740 ( 8.282 0.000 -7.176) 10.959 7.819 ( 5.331 0.000 -3.641) 6.455 8.262 ( -0.118 0.000 6.258) 6.259 8.689 ( -3.282 0.000 -4.799) 5.814 9.155 ( -1.058 0.000 -0.407) 1.133 9.209 ( -2.949 0.000 -4.525) 5.401 ======================= Grid point 174 (83/309) ======================= q-point: ( 0.24 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 309 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.449 ( 3.557 0.000 9.798) 10.423 1.503 ( 5.310 0.000 -0.742) 5.362 1.689 ( 4.431 0.000 -0.474) 4.456 1.874 ( 0.553 0.000 -4.939) 4.970 2.079 ( 6.342 0.000 1.983) 6.645 2.087 ( 4.725 0.000 0.157) 4.728 2.492 ( 2.152 0.000 -2.925) 3.631 2.588 ( 1.002 0.000 -1.685) 1.960 2.857 ( 2.463 0.000 2.035) 3.195 2.927 ( 4.661 0.000 -0.339) 4.673 4.757 ( -4.211 0.000 3.285) 5.341 4.810 ( -4.088 0.000 -0.119) 4.090 6.097 ( -14.623 0.000 13.460) 19.875 6.364 ( -7.196 0.000 4.407) 8.438 6.505 ( -6.577 0.000 -10.119) 12.069 6.653 ( -5.939 0.000 -5.807) 8.306 7.601 ( 5.772 0.000 7.392) 9.379 7.686 ( 6.728 0.000 2.431) 7.154 7.768 ( 8.574 0.000 -7.269) 11.240 7.851 ( 5.512 0.000 -3.449) 6.502 8.335 ( -1.189 0.000 5.752) 5.874 8.575 ( -3.319 0.000 -4.689) 5.745 9.118 ( -1.727 0.000 -3.126) 3.572 9.121 ( -1.763 0.000 -1.128) 2.093 ======================= Grid point 175 (84/309) ======================= q-point: ( 0.29 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 309 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.607 ( 7.127 0.000 1.671) 7.321 1.619 ( 2.485 0.000 8.219) 8.586 1.723 ( 2.200 0.000 -1.665) 2.759 1.772 ( -0.126 0.000 -8.347) 8.348 2.153 ( 1.152 0.000 2.588) 2.833 2.158 ( 1.663 0.000 0.716) 1.811 2.489 ( 1.716 0.000 -1.364) 2.193 2.526 ( -2.177 0.000 -3.110) 3.796 2.927 ( 2.637 0.000 2.156) 3.406 2.970 ( 2.830 0.000 -2.693) 3.907 4.726 ( -4.289 0.000 1.698) 4.613 4.738 ( -3.713 0.000 -1.407) 3.970 6.070 ( -13.092 0.000 12.792) 18.305 6.247 ( -6.253 0.000 -12.732) 14.185 6.325 ( -6.327 0.000 5.055) 8.099 6.467 ( -6.723 0.000 -6.861) 9.606 7.744 ( 2.089 0.000 5.664) 6.037 7.794 ( 7.226 0.000 -6.207) 9.526 7.825 ( 5.651 0.000 3.882) 6.856 7.888 ( 5.760 0.000 -3.508) 6.744 8.382 ( -2.176 0.000 4.857) 5.323 8.460 ( -3.824 0.000 -4.546) 5.941 9.081 ( 0.391 0.000 -0.980) 1.056 9.083 ( -1.198 0.000 -0.826) 1.455 ======================= Grid point 176 (85/309) ======================= q-point: ( 0.35 0.00 -0.83) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 309 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.651 ( 0.439 0.000 -4.172) 4.195 1.695 ( -3.281 0.000 2.025) 3.855 1.760 ( 4.130 0.000 2.009) 4.593 1.775 ( 8.114 0.000 0.911) 8.165 2.144 ( -2.347 0.000 -1.677) 2.885 2.172 ( -2.393 0.000 0.846) 2.538 2.487 ( -1.081 0.000 1.434) 1.796 2.505 ( 1.223 0.000 0.389) 1.284 2.955 ( 1.297 0.000 -2.324) 2.661 2.992 ( 1.136 0.000 3.287) 3.478 4.676 ( -2.026 0.000 -0.759) 2.163 4.687 ( -3.338 0.000 1.345) 3.599 6.007 ( -2.330 0.000 -11.450) 11.684 6.055 ( -12.226 0.000 12.618) 17.570 6.294 ( -4.782 0.000 -4.852) 6.813 6.317 ( -5.214 0.000 6.349) 8.216 7.811 ( 5.057 0.000 -4.713) 6.912 7.827 ( -0.499 0.000 4.535) 4.563 7.925 ( 5.864 0.000 -3.919) 7.053 7.954 ( 4.863 0.000 3.766) 6.151 8.337 ( -4.511 0.000 -4.102) 6.097 8.407 ( -2.423 0.000 4.045) 4.716 9.070 ( -0.043 0.000 0.422) 0.424 9.093 ( 1.351 0.000 0.411) 1.412 ======================= Grid point 177 (86/309) ======================= q-point: ( 0.41 0.00 -0.83) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 309 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.632 ( 1.887 0.000 -0.922) 2.100 1.658 ( -4.462 0.000 1.790) 4.808 1.831 ( 3.487 0.000 -0.017) 3.488 1.896 ( 6.869 0.000 -0.788) 6.914 2.070 ( -2.595 0.000 -2.706) 3.749 2.097 ( -5.861 0.000 -2.500) 6.372 2.523 ( -1.561 0.000 6.457) 6.643 2.534 ( 0.442 0.000 2.018) 2.066 2.985 ( 2.867 0.000 2.733) 3.961 3.053 ( -0.353 0.000 4.757) 4.770 4.664 ( -0.309 0.000 1.496) 1.528 4.672 ( -1.768 0.000 2.336) 2.930 5.908 ( 4.918 0.000 -4.782) 6.860 6.048 ( -11.847 0.000 12.704) 17.371 6.218 ( -0.373 0.000 -0.085) 0.383 6.339 ( -4.859 0.000 7.599) 9.019 7.818 ( 3.730 0.000 -3.787) 5.315 7.849 ( -2.632 0.000 2.309) 3.501 7.952 ( 5.139 0.000 -4.243) 6.664 8.061 ( 2.768 0.000 1.220) 3.025 8.237 ( -2.558 0.000 -0.374) 2.585 8.421 ( -2.575 0.000 3.315) 4.198 9.090 ( 0.462 0.000 1.768) 1.828 9.120 ( 0.915 0.000 0.818) 1.228 ======================= Grid point 178 (87/309) ======================= q-point: ( 0.47 0.00 -0.83) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 309 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.622 ( -4.267 0.000 2.723) 5.062 1.677 ( 3.336 0.000 1.660) 3.726 1.870 ( 4.357 0.000 -2.988) 5.283 1.897 ( -3.842 0.000 -5.770) 6.932 1.998 ( 0.784 0.000 -2.210) 2.345 2.009 ( -1.603 0.000 -1.217) 2.013 2.582 ( 1.374 0.000 3.520) 3.779 2.610 ( -1.724 0.000 9.560) 9.714 3.102 ( 2.946 0.000 6.816) 7.425 3.109 ( -1.913 0.000 5.681) 5.994 4.699 ( -0.538 0.000 3.904) 3.941 4.700 ( 0.181 0.000 3.579) 3.583 6.022 ( 10.808 0.000 3.120) 11.250 6.048 ( -11.829 0.000 12.981) 17.562 6.284 ( 4.207 0.000 5.149) 6.649 6.374 ( -5.348 0.000 8.515) 10.055 7.818 ( -3.725 0.000 0.294) 3.736 7.823 ( 3.733 0.000 -3.565) 5.162 7.961 ( 3.862 0.000 -4.311) 5.788 8.021 ( -3.162 0.000 -3.370) 4.622 8.301 ( 3.674 0.000 5.340) 6.481 8.419 ( -3.111 0.000 2.606) 4.058 9.127 ( 0.252 0.000 2.758) 2.769 9.140 ( 0.077 0.000 1.003) 1.006 ======================= Grid point 179 (88/309) ======================= q-point: (-0.47 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 309 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.606 ( -2.724 0.000 2.359) 3.604 1.735 ( -4.902 0.000 -5.118) 7.087 1.776 ( 5.094 0.000 2.842) 5.834 1.858 ( -0.318 0.000 -3.862) 3.875 1.981 ( 0.791 0.000 -3.380) 3.471 2.004 ( 2.364 0.000 -0.322) 2.386 2.678 ( 2.898 0.000 5.649) 6.349 2.719 ( -2.014 0.000 9.821) 10.025 3.144 ( -4.014 0.000 5.696) 6.968 3.222 ( -0.096 0.000 6.500) 6.501 4.754 ( -0.585 0.000 4.976) 5.011 4.757 ( -0.237 0.000 4.337) 4.343 6.046 ( -12.445 0.000 13.088) 18.060 6.270 ( 11.561 0.000 6.952) 13.490 6.409 ( -6.062 0.000 9.086) 10.923 6.460 ( 6.262 0.000 8.007) 10.165 7.749 ( -4.308 0.000 -1.632) 4.607 7.835 ( 4.682 0.000 -3.884) 6.083 7.935 ( -3.073 0.000 -1.669) 3.497 7.954 ( 2.758 0.000 -3.700) 4.615 8.398 ( -3.977 0.000 1.924) 4.418 8.432 ( 3.983 0.000 4.819) 6.252 9.155 ( -0.158 0.000 1.627) 1.635 9.171 ( -0.039 0.000 3.424) 3.424 ======================= Grid point 180 (89/309) ======================= q-point: (-0.41 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 309 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.589 ( -3.404 0.000 0.984) 3.543 1.627 ( -2.870 0.000 -1.843) 3.411 1.767 ( -4.698 0.000 -3.183) 5.675 1.877 ( 1.336 0.000 -0.515) 1.432 1.956 ( 4.701 0.000 -1.624) 4.974 2.046 ( 3.842 0.000 -1.355) 4.074 2.797 ( -3.776 0.000 6.912) 7.876 2.806 ( 1.861 0.000 7.210) 7.446 3.138 ( -6.719 0.000 5.021) 8.387 3.254 ( -4.998 0.000 3.417) 6.054 4.803 ( -1.134 0.000 3.750) 3.917 4.804 ( -2.173 0.000 4.915) 5.374 6.027 ( -13.652 0.000 12.498) 18.509 6.439 ( -6.611 0.000 8.988) 11.158 6.516 ( 8.415 0.000 6.292) 10.507 6.656 ( 5.234 0.000 7.236) 8.930 7.644 ( -5.251 0.000 -3.455) 6.285 7.853 ( 5.428 0.000 -4.615) 7.124 7.894 ( -1.807 0.000 1.188) 2.163 7.951 ( 2.307 0.000 -1.915) 2.998 8.352 ( -5.003 0.000 1.195) 5.144 8.542 ( 3.221 0.000 3.180) 4.526 9.187 ( 0.699 0.000 2.677) 2.767 9.217 ( -0.278 0.000 3.571) 3.582 ======================= Grid point 181 (90/309) ======================= q-point: (-0.35 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 309 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.497 ( -10.237 0.000 -0.579) 10.253 1.577 ( -3.860 0.000 -0.026) 3.860 1.665 ( -2.836 0.000 -2.301) 3.652 1.820 ( -1.895 0.000 -2.437) 3.087 2.056 ( 8.213 0.000 -1.839) 8.416 2.063 ( 1.650 0.000 -2.443) 2.948 2.760 ( -9.335 0.000 0.417) 9.345 2.907 ( -1.987 0.000 6.813) 7.097 3.076 ( -9.778 0.000 3.914) 10.532 3.182 ( -8.098 0.000 1.574) 8.249 4.815 ( -4.562 0.000 3.975) 6.051 4.820 ( -2.388 0.000 2.351) 3.351 5.977 ( -14.569 0.000 10.973) 18.239 6.454 ( -6.891 0.000 7.942) 10.515 6.680 ( 4.710 0.000 3.521) 5.881 6.799 ( 3.288 0.000 4.318) 5.428 7.494 ( -7.498 0.000 -4.844) 8.927 7.866 ( 4.660 0.000 -4.590) 6.541 7.915 ( -0.500 0.000 4.266) 4.295 7.971 ( 2.132 0.000 -0.237) 2.145 8.281 ( -5.951 0.000 0.405) 5.965 8.613 ( 2.565 0.000 0.992) 2.750 9.250 ( 2.087 0.000 3.277) 3.885 9.254 ( -0.846 0.000 2.895) 3.016 ======================= Grid point 182 (91/309) ======================= q-point: (-0.29 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 309 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.281 ( -16.378 0.000 -1.202) 16.422 1.451 ( -10.591 0.000 -3.210) 11.067 1.616 ( -1.089 0.000 -0.983) 1.467 1.815 ( 2.062 0.000 1.416) 2.501 2.021 ( -2.556 0.000 -2.928) 3.887 2.121 ( 6.360 0.000 -4.763) 7.946 2.507 ( -18.768 0.000 -6.113) 19.739 2.898 ( -9.984 0.000 2.851) 10.383 2.969 ( -10.076 0.000 3.752) 10.752 3.084 ( -7.160 0.000 1.060) 7.238 4.776 ( -6.753 0.000 2.708) 7.275 4.794 ( -3.835 0.000 0.645) 3.889 5.895 ( -14.212 0.000 8.659) 16.642 6.450 ( -6.696 0.000 6.289) 9.186 6.762 ( 2.580 0.000 0.967) 2.755 6.882 ( 2.887 0.000 1.741) 3.372 7.281 ( -11.385 0.000 -5.843) 12.797 7.867 ( 2.977 0.000 -3.628) 4.693 7.995 ( 0.349 0.000 7.782) 7.790 7.997 ( 0.863 0.000 0.383) 0.944 8.188 ( -6.493 0.000 -0.322) 6.501 8.645 ( 2.464 0.000 -1.923) 3.126 9.266 ( -1.841 0.000 1.686) 2.496 9.330 ( 2.956 0.000 2.667) 3.981 ======================= Grid point 183 (92/309) ======================= q-point: (-0.24 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 309 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.992 ( -20.131 0.000 -0.607) 20.140 1.196 ( -15.418 0.000 -4.762) 16.137 1.603 ( -0.394 0.000 0.655) 0.765 1.893 ( 3.221 0.000 3.483) 4.744 1.907 ( -7.946 0.000 -2.264) 8.263 2.070 ( -26.444 0.000 -6.953) 27.343 2.114 ( 3.339 0.000 -6.785) 7.562 2.708 ( -15.878 0.000 -0.498) 15.886 2.857 ( -11.105 0.000 1.538) 11.211 2.997 ( -5.337 0.000 0.020) 5.337 4.691 ( -8.194 0.000 1.365) 8.307 4.728 ( -4.727 0.000 -0.514) 4.755 5.794 ( -12.397 0.000 5.806) 13.689 6.429 ( -5.797 0.000 4.467) 7.319 6.798 ( 2.120 0.000 -0.270) 2.137 6.947 ( 4.253 0.000 0.349) 4.267 6.997 ( -15.994 0.000 -5.467) 16.902 7.856 ( 1.214 0.000 -2.396) 2.686 7.998 ( -1.566 0.000 0.257) 1.587 8.083 ( -6.277 0.000 -0.925) 6.344 8.142 ( 1.395 0.000 11.996) 12.077 8.629 ( 2.537 0.000 -6.270) 6.764 9.246 ( -2.894 0.000 0.722) 2.983 9.403 ( 3.125 0.000 1.179) 3.340 ======================= Grid point 184 (93/309) ======================= q-point: (-0.18 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 309 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.688 ( -21.370 0.000 2.685) 21.538 0.887 ( -18.579 0.000 -2.200) 18.709 1.555 ( -29.782 0.000 -1.261) 29.809 1.618 ( -1.034 0.000 -1.545) 1.859 1.745 ( -13.737 0.000 2.894) 14.038 1.988 ( 2.148 0.000 3.549) 4.148 2.043 ( 0.469 0.000 -7.067) 7.082 2.436 ( -17.012 0.000 -2.618) 17.212 2.691 ( -11.021 0.000 -0.341) 11.026 2.942 ( -2.534 0.000 1.171) 2.791 4.577 ( -8.401 0.000 0.527) 8.418 4.653 ( -4.272 0.000 -0.138) 4.274 5.690 ( -9.474 0.000 3.278) 10.025 6.400 ( -4.009 0.000 1.723) 4.364 6.680 ( -19.200 0.000 -0.939) 19.223 6.826 ( 2.344 0.000 -0.391) 2.376 7.021 ( 5.946 0.000 -0.743) 5.992 7.843 ( 0.053 0.000 -0.686) 0.688 7.951 ( -4.704 0.000 -0.341) 4.716 7.983 ( -4.824 0.000 -1.420) 5.029 8.365 ( 5.649 0.000 10.843) 12.226 8.535 ( -0.315 0.000 -9.021) 9.027 9.204 ( -3.598 0.000 0.437) 3.625 9.453 ( 2.981 0.000 -0.465) 3.017 ======================= Grid point 185 (94/309) ======================= q-point: (-0.12 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 309 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.476 ( -16.941 0.000 9.639) 19.491 0.637 ( -17.518 0.000 7.920) 19.225 1.103 ( -31.800 0.000 6.513) 32.460 1.570 ( -13.160 0.000 8.283) 15.550 1.645 ( -3.022 0.000 0.548) 3.071 1.933 ( -1.565 0.000 -5.642) 5.855 2.026 ( -4.283 0.000 -0.331) 4.296 2.170 ( -10.873 0.000 -2.598) 11.179 2.575 ( -4.734 0.000 2.558) 5.381 2.962 ( 0.435 0.000 3.882) 3.906 4.478 ( -6.177 0.000 2.092) 6.522 4.610 ( -2.693 0.000 1.824) 3.252 5.637 ( -3.325 0.000 6.103) 6.950 6.329 ( -5.390 0.000 -2.564) 5.969 6.468 ( -14.645 0.000 9.208) 17.300 6.858 ( 2.308 0.000 -0.094) 2.310 7.092 ( 6.195 0.000 -2.716) 6.765 7.836 ( -2.141 0.000 0.157) 2.147 7.871 ( -3.582 0.000 -0.800) 3.670 7.900 ( -3.612 0.000 -0.354) 3.629 8.155 ( -10.319 0.000 -29.878) 31.609 8.729 ( 8.604 0.000 15.374) 17.618 9.156 ( -3.616 0.000 0.513) 3.652 9.479 ( 2.601 0.000 -1.897) 3.219 ======================= Grid point 186 (95/309) ======================= q-point: (-0.06 0.00 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 309 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.468 ( -5.284 0.000 14.538) 15.468 0.646 ( -7.054 0.000 19.859) 21.074 0.864 ( -22.401 0.000 20.143) 30.125 1.420 ( -19.148 0.000 3.954) 19.552 1.628 ( -0.342 0.000 -0.692) 0.771 1.854 ( -2.649 0.000 -3.812) 4.642 1.890 ( -2.678 0.000 -2.257) 3.502 2.052 ( -3.870 0.000 -2.647) 4.689 2.626 ( 1.167 0.000 7.162) 7.257 3.026 ( 1.531 0.000 0.955) 1.805 4.475 ( -1.905 0.000 6.224) 6.509 4.626 ( -0.981 0.000 4.377) 4.485 5.890 ( 17.625 0.000 15.954) 23.774 6.262 ( -4.320 0.000 6.408) 7.728 6.439 ( -7.246 0.000 8.251) 10.981 6.889 ( 1.625 0.000 0.123) 1.630 7.116 ( 3.873 0.000 -5.140) 6.435 7.397 ( -36.340 0.000 -17.988) 40.548 7.768 ( -3.046 0.000 -1.928) 3.605 7.810 ( -2.158 0.000 -1.651) 2.717 7.917 ( 0.325 0.000 4.270) 4.282 8.976 ( 6.830 0.000 1.019) 6.905 9.119 ( -2.138 0.000 0.795) 2.281 9.479 ( 1.846 0.000 -2.976) 3.502 ======================= Grid point 187 (96/309) ======================= q-point: ( 0.00 0.20 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 511 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.589 ( -3.102 -7.092 21.640) 22.983 0.751 ( -0.260 6.866 13.628) 15.262 1.199 ( -4.611 -4.773 2.810) 7.207 1.328 ( 0.976 -3.324 6.215) 7.115 1.616 ( -1.266 19.380 8.717) 21.288 1.801 ( 1.228 1.978 -1.656) 2.857 1.928 ( 4.330 -1.350 0.551) 4.568 2.061 ( 1.358 9.190 -1.091) 9.353 2.683 ( 0.880 -7.020 4.958) 8.639 2.937 ( -0.610 -8.774 3.522) 9.474 4.525 ( -0.505 -3.214 8.253) 8.871 4.648 ( 0.013 -4.822 5.635) 7.416 6.300 ( -2.559 1.038 12.985) 13.275 6.370 ( -0.154 -9.079 10.240) 13.686 6.383 ( -0.817 -1.012 13.882) 13.942 6.545 ( -1.704 -15.337 13.029) 20.196 7.087 ( 0.439 2.405 -5.857) 6.347 7.125 ( 0.606 3.169 -4.993) 5.944 7.721 ( 0.837 0.416 -2.928) 3.073 7.767 ( 0.565 -0.703 -1.978) 2.174 8.239 ( 0.683 18.622 -1.015) 18.662 8.978 ( -0.506 -4.661 -2.839) 5.481 9.077 ( 0.477 0.331 0.934) 1.100 9.424 ( 0.737 -3.470 -3.511) 4.991 ======================= Grid point 188 (97/309) ======================= q-point: ( 0.06 0.20 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 511 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.798 ( -3.572 -4.935 17.895) 18.904 1.086 ( 11.167 -1.392 14.595) 18.430 1.292 ( 10.360 -4.919 2.939) 11.839 1.449 ( 7.018 -13.787 5.674) 16.478 1.752 ( 2.287 20.809 7.483) 22.231 1.854 ( 8.352 3.475 -2.106) 9.288 1.970 ( 1.650 3.333 0.686) 3.782 2.180 ( 10.658 9.093 3.843) 14.528 2.726 ( -1.619 -9.720 2.410) 10.144 2.989 ( -0.486 -2.519 4.495) 5.176 4.621 ( -1.672 -3.510 7.815) 8.729 4.722 ( -0.778 -5.565 5.784) 8.064 6.253 ( -19.356 -0.767 16.028) 25.143 6.396 ( -8.433 -4.405 9.147) 13.198 6.696 ( 11.416 -1.308 13.217) 17.513 6.845 ( 8.448 -5.447 5.247) 11.339 7.000 ( -1.683 2.359 -4.996) 5.776 7.118 ( 8.915 -2.761 -2.908) 9.775 7.713 ( 4.583 0.653 -4.453) 6.423 7.768 ( 3.632 -0.628 -2.675) 4.555 8.260 ( 0.839 15.137 1.817) 15.269 8.911 ( -1.773 -1.505 -4.369) 4.949 9.096 ( 0.077 -2.230 1.472) 2.673 9.370 ( -0.933 -3.279 -4.184) 5.397 ======================= Grid point 189 (98/309) ======================= q-point: ( 0.12 0.20 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 511 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.000 ( 1.580 -2.821 13.751) 14.126 1.318 ( 5.559 -5.377 4.098) 8.753 1.561 ( 13.337 0.492 5.375) 14.388 1.682 ( 8.404 -3.700 8.232) 12.332 1.826 ( 2.311 5.250 -0.059) 5.736 1.954 ( 9.290 3.176 -3.398) 10.390 2.104 ( 11.162 3.630 4.688) 12.639 2.408 ( 11.394 7.820 3.800) 14.332 2.717 ( -2.590 -7.901 1.834) 8.515 3.024 ( -1.670 2.215 2.610) 3.809 4.684 ( -2.862 -3.736 6.463) 7.995 4.774 ( -2.017 -6.384 4.549) 8.094 6.197 ( -17.171 1.054 15.377) 23.074 6.389 ( -7.914 -4.653 7.390) 11.785 6.858 ( -3.013 1.029 -3.706) 4.886 6.887 ( -2.410 0.498 -2.426) 3.456 7.070 ( 11.439 1.012 10.758) 15.736 7.310 ( 12.996 -6.870 1.897) 14.822 7.729 ( 6.851 1.000 -5.922) 9.111 7.795 ( 5.458 -0.227 -3.574) 6.528 8.306 ( 0.566 12.318 3.349) 12.778 8.815 ( -2.504 0.593 -4.756) 5.407 9.113 ( -0.472 -3.887 0.994) 4.040 9.283 ( -2.518 -3.412 -4.697) 6.328 ======================= Grid point 190 (99/309) ======================= q-point: ( 0.18 0.20 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 511 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.213 ( 4.597 -1.647 10.391) 11.481 1.437 ( 5.602 -3.502 1.646) 6.808 1.694 ( 3.897 7.116 -2.837) 8.595 1.885 ( 3.640 0.168 2.523) 4.432 1.911 ( 7.906 0.758 4.582) 9.170 2.035 ( 7.874 1.306 -3.012) 8.531 2.330 ( 11.021 -4.414 1.198) 11.932 2.583 ( 7.619 0.269 -0.329) 7.631 2.739 ( 1.032 1.377 4.558) 4.872 3.013 ( -2.080 5.125 0.391) 5.545 4.713 ( -3.637 -4.192 4.814) 7.346 4.781 ( -3.321 -6.603 2.349) 7.755 6.154 ( -15.454 1.717 13.786) 20.780 6.358 ( -8.237 -4.661 5.756) 11.077 6.724 ( -4.965 1.325 -6.555) 8.330 6.789 ( -4.397 -0.432 -4.314) 6.175 7.373 ( 9.711 0.521 9.501) 13.596 7.506 ( 8.911 -3.976 2.786) 10.148 7.754 ( 8.114 1.358 -6.757) 10.646 7.829 ( 6.177 0.259 -4.163) 7.454 8.364 ( 0.078 10.079 4.289) 10.954 8.713 ( -2.473 2.303 -4.584) 5.695 9.103 ( -1.680 -4.900 -0.091) 5.180 9.174 ( -3.218 -3.770 -4.635) 6.786 ======================= Grid point 191 (100/309) ======================= q-point: ( 0.24 0.20 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 511 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.412 ( 5.748 -0.989 7.246) 9.302 1.535 ( 5.210 0.138 1.406) 5.398 1.707 ( 3.542 2.088 -2.553) 4.840 1.863 ( -0.236 -1.741 -6.827) 7.049 2.081 ( 6.292 0.979 2.851) 6.977 2.120 ( 3.875 3.041 1.972) 5.306 2.447 ( 4.910 -1.944 -0.174) 5.284 2.632 ( 3.091 -0.342 -3.876) 4.970 2.838 ( 2.763 2.552 3.642) 5.235 2.993 ( 0.284 4.122 -0.890) 4.227 4.706 ( -4.318 -4.824 2.889) 7.090 4.742 ( -4.067 -6.331 0.160) 7.526 6.112 ( -13.985 1.434 12.259) 18.653 6.302 ( -8.345 -4.984 4.145) 10.567 6.534 ( -6.128 2.058 -8.716) 10.852 6.638 ( -6.113 -1.570 -6.283) 8.905 7.610 ( 6.125 0.731 7.517) 9.723 7.663 ( 6.751 -1.698 3.935) 7.996 7.785 ( 8.322 1.699 -6.733) 10.838 7.865 ( 6.274 0.566 -4.258) 7.604 8.419 ( -0.958 8.516 4.424) 9.644 8.616 ( -2.525 4.216 -4.261) 6.504 9.063 ( -2.227 -5.527 -1.349) 6.109 9.077 ( -2.214 -4.632 -2.835) 5.865 ======================= Grid point 192 (101/309) ======================= q-point: ( 0.29 0.20 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 511 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.578 ( 5.606 -0.701 4.642) 7.312 1.642 ( 4.241 -0.116 3.042) 5.221 1.715 ( 2.406 -0.520 -4.019) 4.713 1.760 ( 0.521 -1.377 -5.062) 5.272 2.173 ( 1.952 2.047 1.535) 3.218 2.188 ( 1.229 3.358 2.031) 4.112 2.501 ( 1.864 1.610 1.113) 2.702 2.579 ( -0.778 3.280 -5.004) 6.034 2.912 ( 2.050 -0.407 2.331) 3.131 2.980 ( 0.575 0.642 -2.706) 2.840 4.667 ( -4.428 -5.548 1.260) 7.210 4.674 ( -3.836 -5.948 -1.018) 7.151 6.074 ( -12.509 0.438 11.109) 16.735 6.197 ( -7.506 -3.895 -4.288) 9.482 6.350 ( -5.798 1.552 -2.104) 6.360 6.448 ( -6.672 -1.881 -6.701) 9.641 7.760 ( 2.650 1.520 5.821) 6.574 7.815 ( 7.533 1.826 -5.903) 9.743 7.823 ( 5.537 -0.028 4.878) 7.379 7.898 ( 6.052 0.491 -4.345) 7.467 8.454 ( -1.954 7.537 3.979) 8.744 8.517 ( -3.332 6.000 -4.056) 7.973 9.024 ( -0.111 -5.828 -1.250) 5.962 9.027 ( -1.490 -5.815 -0.543) 6.027 ======================= Grid point 193 (102/309) ======================= q-point: ( 0.35 0.20 -0.83) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 511 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.646 ( 1.461 -0.052 -3.403) 3.704 1.685 ( -0.915 -0.655 3.214) 3.405 1.756 ( 4.016 -0.355 -0.264) 4.041 1.781 ( 6.080 -0.357 1.193) 6.206 2.177 ( -2.081 3.375 -0.892) 4.065 2.200 ( -1.698 2.882 0.088) 3.346 2.518 ( -0.717 2.791 -0.950) 3.034 2.540 ( -0.152 2.931 2.658) 3.960 2.943 ( 0.683 -1.007 -1.910) 2.265 2.974 ( 0.805 -1.602 2.984) 3.481 4.613 ( -2.344 -5.960 -0.559) 6.429 4.622 ( -3.487 -6.087 1.118) 7.103 6.002 ( -3.539 -0.367 -8.761) 9.456 6.040 ( -10.593 -1.386 9.252) 14.133 6.285 ( -5.413 -0.782 -2.494) 6.011 6.304 ( -4.802 -1.195 4.837) 6.920 7.834 ( 5.125 2.109 -4.826) 7.349 7.854 ( 0.361 2.516 4.355) 5.042 7.925 ( 5.630 -0.012 -4.370) 7.127 7.963 ( 4.640 0.366 4.061) 6.177 8.409 ( -3.926 7.719 -3.269) 9.257 8.474 ( -2.152 7.023 3.509) 8.140 9.008 ( -0.370 -6.500 0.390) 6.522 9.033 ( 1.084 -6.268 0.460) 6.378 ======================= Grid point 194 (103/309) ======================= q-point: ( 0.41 0.20 -0.83) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 511 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.641 ( 0.296 1.034 -0.513) 1.192 1.677 ( -2.160 1.655 1.844) 3.288 1.807 ( 3.081 -1.914 -1.181) 3.815 1.876 ( 4.972 -2.235 -1.076) 5.556 2.109 ( -2.777 4.016 -2.578) 5.521 2.144 ( -3.107 4.081 -2.180) 5.573 2.529 ( -0.102 1.370 2.954) 3.258 2.583 ( -1.709 3.610 6.170) 7.350 2.965 ( 2.321 -1.711 2.274) 3.672 3.035 ( 0.013 -1.719 5.082) 5.365 4.596 ( -0.731 -6.355 1.507) 6.572 4.605 ( -1.813 -6.387 2.301) 7.027 5.909 ( 2.568 0.239 -2.965) 3.929 6.025 ( -7.257 -2.447 8.833) 11.690 6.223 ( -3.092 0.736 2.599) 4.106 6.325 ( -4.047 -1.448 7.427) 8.581 7.836 ( 3.016 1.874 -3.784) 5.189 7.884 ( -0.540 2.626 0.477) 2.723 7.947 ( 4.097 -0.032 -3.334) 5.282 8.053 ( 1.677 -1.064 0.647) 2.089 8.340 ( -1.424 10.333 0.661) 10.451 8.486 ( -2.237 6.978 3.088) 7.952 9.023 ( 0.188 -6.964 1.807) 7.197 9.059 ( 0.850 -6.446 0.937) 6.569 ======================= Grid point 195 (104/309) ======================= q-point: ( 0.47 0.20 -0.83) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 511 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.625 ( -2.676 0.797 1.748) 3.295 1.697 ( 1.174 1.444 1.378) 2.316 1.814 ( 1.306 -3.580 -3.532) 5.196 1.865 ( -0.372 -3.096 -4.360) 5.360 2.053 ( 0.306 4.581 -2.506) 5.230 2.085 ( -0.690 6.081 -1.580) 6.321 2.585 ( 0.861 1.303 4.439) 4.706 2.670 ( -1.481 4.569 9.951) 11.049 3.047 ( 0.803 -3.363 4.595) 5.750 3.123 ( 0.364 -0.448 7.630) 7.652 4.624 ( -0.320 -6.806 3.562) 7.688 4.633 ( -0.293 -6.502 3.859) 7.567 5.981 ( 1.007 -1.400 6.790) 7.006 6.083 ( -0.827 -0.041 9.542) 9.578 6.259 ( 0.183 -0.288 5.696) 5.707 6.384 ( -2.292 -0.166 8.304) 8.616 7.817 ( -0.094 1.267 -2.353) 2.674 7.866 ( 0.850 2.225 -2.892) 3.746 7.952 ( 2.498 -0.171 -3.129) 4.007 8.020 ( -1.911 -0.455 -3.456) 3.975 8.399 ( 2.716 9.833 4.973) 11.349 8.489 ( -2.668 7.421 2.691) 8.333 9.057 ( 0.123 -7.079 2.581) 7.536 9.082 ( 0.122 -6.290 1.516) 6.471 ======================= Grid point 196 (105/309) ======================= q-point: (-0.47 0.20 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 511 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.616 ( -2.027 1.309 1.455) 2.817 1.720 ( -2.098 -0.975 -3.645) 4.317 1.760 ( 3.037 -1.472 1.854) 3.850 1.826 ( 0.800 -3.033 -3.790) 4.920 2.021 ( -0.023 4.098 -2.973) 5.063 2.076 ( 1.182 5.594 -0.992) 5.803 2.676 ( 1.493 1.245 5.804) 6.121 2.795 ( -1.278 5.697 10.759) 12.241 3.095 ( -2.453 -3.480 4.331) 6.073 3.231 ( -1.147 -0.111 7.718) 7.803 4.677 ( -0.302 -6.957 4.482) 8.281 4.689 ( -0.389 -6.577 4.706) 8.097 6.049 ( -9.363 0.740 12.484) 15.622 6.255 ( 2.723 -3.560 9.632) 10.624 6.371 ( 3.184 0.705 7.322) 8.016 6.499 ( 2.785 1.063 8.242) 8.765 7.761 ( -3.524 1.346 -1.997) 4.269 7.837 ( 1.662 -0.115 -4.214) 4.532 7.942 ( -0.178 0.467 -2.027) 2.088 7.950 ( 1.976 -0.245 -4.459) 4.884 8.476 ( -3.011 8.480 2.179) 9.259 8.519 ( 2.895 8.443 5.036) 10.248 9.090 ( 0.052 -6.652 2.110) 6.978 9.113 ( -0.215 -6.189 3.353) 7.042 ======================= Grid point 197 (106/309) ======================= q-point: (-0.41 0.20 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 511 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.577 ( -3.083 0.669 -1.176) 3.367 1.679 ( -0.681 3.352 0.217) 3.427 1.755 ( -3.034 -1.426 -3.470) 4.825 1.857 ( 4.169 -2.229 1.283) 4.899 1.978 ( 0.909 2.916 -2.728) 4.095 2.079 ( 1.331 2.715 -1.730) 3.484 2.765 ( -1.202 0.300 5.812) 5.943 2.910 ( -1.901 6.391 9.089) 11.272 3.087 ( -5.713 -3.526 3.049) 7.374 3.274 ( -5.169 0.890 5.189) 7.378 4.726 ( -1.246 -6.863 4.031) 8.057 4.739 ( -1.559 -6.413 4.444) 7.957 6.054 ( -12.451 2.813 12.286) 17.717 6.356 ( -5.697 -6.417 9.849) 13.062 6.556 ( 6.979 2.708 6.263) 9.761 6.665 ( 4.380 0.285 6.990) 8.254 7.659 ( -5.254 1.534 -3.415) 6.451 7.804 ( -0.356 -3.398 -1.608) 3.776 7.905 ( 2.320 0.539 -4.290) 4.907 7.958 ( 3.248 -0.326 -1.761) 3.709 8.450 ( -3.987 10.179 1.971) 11.108 8.620 ( 2.503 7.621 3.429) 8.724 9.128 ( 0.685 -6.260 2.870) 6.921 9.161 ( -0.215 -5.876 3.799) 7.001 ======================= Grid point 198 (107/309) ======================= q-point: (-0.35 0.20 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 511 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.499 ( -6.357 1.051 -1.255) 6.565 1.595 ( -7.533 0.369 -2.537) 7.957 1.723 ( 0.216 5.664 -0.023) 5.668 1.839 ( -2.056 1.939 -2.678) 3.894 2.035 ( 7.207 -2.053 -1.026) 7.563 2.059 ( -0.328 -0.680 -2.490) 2.602 2.761 ( -7.821 0.858 1.753) 8.060 2.972 ( -4.513 5.817 6.278) 9.676 3.008 ( -9.003 -4.893 2.104) 10.460 3.226 ( -8.275 2.475 3.070) 9.167 4.744 ( -3.083 -6.561 3.037) 7.859 4.756 ( -3.219 -6.177 3.033) 7.597 6.015 ( -13.720 3.907 10.694) 17.829 6.381 ( -7.443 -6.565 8.426) 13.018 6.710 ( 4.454 2.365 3.606) 6.199 6.798 ( 3.077 -0.232 4.168) 5.186 7.510 ( -7.478 1.854 -4.544) 8.945 7.785 ( -1.830 -7.078 1.041) 7.385 7.891 ( 3.175 0.536 -3.895) 5.054 7.989 ( 3.250 -1.259 -1.179) 3.679 8.417 ( -4.111 12.987 2.325) 13.819 8.685 ( 1.887 6.875 1.306) 7.248 9.183 ( 0.111 -6.509 3.343) 7.318 9.210 ( 1.094 -4.970 3.128) 5.973 ======================= Grid point 199 (108/309) ======================= q-point: (-0.29 0.20 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 511 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.314 ( -14.893 3.162 -1.945) 15.348 1.458 ( -7.163 -0.278 -2.591) 7.622 1.646 ( -5.842 3.579 -3.043) 7.496 1.842 ( 2.975 2.481 0.526) 3.910 1.992 ( -3.324 -2.549 -2.690) 4.978 2.109 ( 5.418 -1.590 -2.952) 6.372 2.552 ( -17.007 4.744 -4.519) 18.225 2.894 ( -10.527 -5.278 2.328) 12.004 2.929 ( -9.676 2.833 2.760) 10.453 3.128 ( -9.011 2.294 1.702) 9.453 4.713 ( -5.859 -5.865 2.298) 8.603 4.727 ( -4.055 -6.190 0.869) 7.451 5.941 ( -13.407 4.691 8.315) 16.459 6.369 ( -7.566 -7.390 6.388) 12.355 6.793 ( 2.670 2.473 1.121) 3.808 6.878 ( 2.704 -0.496 1.619) 3.190 7.306 ( -11.057 2.832 -5.240) 12.560 7.768 ( -3.986 -12.219 2.331) 13.062 7.888 ( 2.340 0.801 -2.811) 3.744 8.011 ( 1.567 -2.390 -1.164) 3.086 8.405 ( -2.831 16.332 4.138) 17.084 8.714 ( 2.061 6.718 -1.302) 7.146 9.202 ( -2.182 -6.361 2.008) 7.018 9.283 ( 3.028 -5.018 2.335) 6.309 ======================= Grid point 200 (109/309) ======================= q-point: (-0.24 0.20 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 511 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.036 ( -18.932 4.504 -0.698) 19.473 1.267 ( -12.088 6.097 -4.318) 14.211 1.547 ( -3.615 -5.378 -0.393) 6.492 1.830 ( -5.541 -5.544 -2.886) 8.353 1.950 ( 0.595 3.729 2.592) 4.580 2.094 ( -5.642 0.650 -3.684) 6.770 2.188 ( -15.473 9.278 -6.973) 19.342 2.724 ( -15.571 1.077 0.239) 15.610 2.791 ( -10.110 -5.141 0.365) 11.348 3.002 ( -9.292 -0.727 -0.019) 9.321 4.636 ( -7.595 -5.101 1.239) 9.233 4.664 ( -4.640 -5.990 -0.360) 7.586 5.848 ( -11.581 5.398 5.458) 13.894 6.334 ( -6.628 -8.633 4.144) 11.645 6.832 ( 1.782 2.586 -0.071) 3.141 6.922 ( 0.119 -1.503 -0.866) 1.738 7.053 ( -11.521 5.012 -3.677) 13.091 7.717 ( -7.255 -18.197 2.006) 19.692 7.881 ( 0.763 1.062 -1.549) 2.027 8.000 ( -0.760 -2.196 -1.254) 2.641 8.457 ( -0.769 16.797 7.638) 18.468 8.709 ( 3.167 8.249 -5.226) 10.265 9.178 ( -3.555 -6.719 0.823) 7.646 9.353 ( 3.245 -5.379 0.793) 6.332 ======================= Grid point 201 (110/309) ======================= q-point: (-0.18 0.20 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 511 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.774 ( -17.678 8.867 4.163) 20.211 1.008 ( -15.083 10.872 -2.568) 18.770 1.503 ( -4.552 -10.516 0.168) 11.460 1.662 ( -11.971 -3.435 -1.525) 12.547 1.746 ( -24.795 13.218 2.384) 28.199 2.010 ( 0.688 1.949 2.287) 3.082 2.060 ( 0.612 2.147 -6.353) 6.733 2.456 ( -17.289 2.193 -2.312) 17.580 2.645 ( -9.554 -4.848 -0.388) 10.721 2.881 ( -6.112 -6.593 0.896) 9.035 4.530 ( -7.809 -4.167 0.569) 8.869 4.591 ( -4.275 -5.714 -0.035) 7.136 5.752 ( -8.636 6.136 2.957) 10.999 6.287 ( -4.847 -10.016 1.418) 11.217 6.702 ( -18.831 2.514 -0.207) 18.999 6.854 ( 0.729 1.675 -0.579) 1.916 7.034 ( 5.221 1.434 -0.719) 5.462 7.602 ( -10.635 -23.336 0.613) 25.653 7.868 ( -0.801 1.099 -0.437) 1.429 7.955 ( -2.943 -1.333 -1.404) 3.522 8.568 ( -1.553 7.251 6.019) 9.551 8.681 ( 7.145 17.384 -5.739) 19.652 9.125 ( -4.469 -7.687 0.382) 8.900 9.401 ( 3.158 -5.542 -0.609) 6.407 ======================= Grid point 202 (111/309) ======================= q-point: (-0.12 0.20 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 511 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.622 ( -13.261 14.055 3.816) 19.697 0.804 ( -14.043 13.577 6.919) 20.722 1.289 ( -20.564 12.030 3.963) 24.152 1.517 ( -13.565 -9.293 3.791) 16.875 1.579 ( -6.099 3.424 5.824) 9.102 1.943 ( -2.312 0.775 -4.277) 4.923 2.040 ( -4.793 1.800 -0.833) 5.187 2.199 ( -9.602 3.085 -2.329) 10.351 2.534 ( -4.634 -4.212 2.138) 6.617 2.862 ( -1.444 -10.504 3.835) 11.275 4.440 ( -5.719 -3.122 2.055) 6.832 4.549 ( -2.666 -5.752 1.982) 6.643 5.701 ( -3.259 6.373 4.950) 8.703 6.227 ( -3.470 -9.669 -0.708) 10.298 6.470 ( -17.927 1.428 7.995) 19.681 6.827 ( -6.434 -4.638 1.466) 8.066 7.102 ( 6.101 0.966 -2.518) 6.670 7.417 ( -12.860 -22.613 -1.668) 26.067 7.840 ( -2.600 0.447 -0.273) 2.652 7.877 ( -4.033 -0.545 -1.867) 4.477 8.463 ( -1.889 13.090 -11.815) 17.734 8.850 ( 8.587 11.422 6.655) 15.763 9.064 ( -4.170 -8.500 0.537) 9.483 9.432 ( 2.892 -5.102 -1.517) 6.058 ======================= Grid point 203 (112/309) ======================= q-point: (-0.06 0.20 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 511 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.478 ( -11.857 10.230 7.396) 17.319 0.718 ( -14.793 9.821 11.025) 20.901 1.207 ( -6.358 16.829 12.733) 22.040 1.345 ( -16.422 -7.879 4.163) 18.684 1.579 ( -2.462 3.034 2.381) 4.576 1.875 ( -4.820 2.254 -2.576) 5.912 1.896 ( -2.835 0.023 -0.851) 2.960 2.103 ( -1.600 5.271 -3.102) 6.322 2.580 ( 1.437 -4.736 6.078) 7.838 2.905 ( -0.337 -12.022 3.131) 12.427 4.437 ( -1.910 -2.777 5.977) 6.862 4.576 ( -0.146 -5.296 4.626) 7.033 5.890 ( 12.542 1.105 14.756) 19.397 6.214 ( -0.320 -5.633 5.424) 7.826 6.380 ( -12.796 -2.963 11.017) 17.143 6.672 ( -22.600 -15.031 8.647) 28.486 7.130 ( 4.022 1.432 -4.854) 6.464 7.221 ( -5.956 -4.538 -4.248) 8.609 7.774 ( -3.273 0.262 -1.961) 3.825 7.806 ( -2.310 -0.492 -1.586) 2.845 8.292 ( -1.023 20.699 -7.455) 22.024 9.007 ( 2.758 -0.894 -1.636) 3.329 9.034 ( 0.397 -2.952 3.209) 4.379 9.443 ( 2.166 -4.206 -2.513) 5.357 ======================= Grid point 204 (113/309) ======================= q-point: ( 0.00 0.40 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 511 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.713 ( -3.974 16.336 6.495) 18.024 0.909 ( -2.116 9.209 8.504) 12.713 1.055 ( -2.277 -16.948 0.736) 17.116 1.080 ( -2.995 -9.505 4.242) 10.831 1.844 ( 2.927 2.682 -0.862) 4.062 1.892 ( 3.562 -2.377 -0.015) 4.282 2.089 ( -0.580 21.972 4.642) 22.465 2.243 ( 1.818 7.326 3.557) 8.345 2.540 ( 0.322 -4.682 3.701) 5.977 2.702 ( 0.074 -15.531 10.606) 18.807 4.488 ( -0.442 0.152 7.161) 7.177 4.542 ( -0.127 -5.247 5.990) 7.964 6.267 ( -2.037 -0.005 14.244) 14.389 6.326 ( -0.124 1.658 13.236) 13.340 6.347 ( -7.731 -7.189 12.755) 16.557 6.359 ( 4.004 -2.020 13.500) 14.225 7.127 ( 0.561 1.675 -5.372) 5.655 7.146 ( 0.727 -0.238 -5.104) 5.161 7.732 ( 0.792 0.823 -2.661) 2.896 7.750 ( 0.683 -1.001 -2.298) 2.598 8.553 ( 0.202 14.777 -1.810) 14.889 8.803 ( -0.272 -12.011 -0.912) 12.049 9.172 ( 0.702 7.680 -1.611) 7.879 9.320 ( 0.806 -7.346 -2.727) 7.877 ======================= Grid point 205 (114/309) ======================= q-point: ( 0.06 0.40 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 511 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.833 ( 0.120 9.117 12.568) 15.527 1.054 ( 1.960 -9.207 5.607) 10.956 1.173 ( 12.974 -1.411 10.455) 16.722 1.246 ( 11.735 -6.595 8.828) 16.097 1.909 ( 7.140 3.455 -1.651) 8.102 1.962 ( 5.667 -1.813 -1.398) 6.112 2.121 ( 2.120 15.669 0.229) 15.813 2.333 ( 3.013 -2.415 2.134) 4.412 2.628 ( 0.758 6.737 8.690) 11.022 2.858 ( 1.040 -11.523 9.835) 15.185 4.572 ( -1.632 -0.768 6.936) 7.167 4.612 ( -1.355 -4.917 5.763) 7.696 6.257 ( -14.887 1.617 14.184) 20.626 6.313 ( -11.430 -4.049 11.524) 16.728 6.693 ( 12.716 1.169 13.152) 18.331 6.744 ( 13.425 -4.369 11.026) 17.913 7.044 ( -1.166 2.158 -5.009) 5.577 7.080 ( 0.896 -1.743 -4.633) 5.031 7.729 ( 4.436 1.043 -3.850) 5.965 7.750 ( 4.100 -1.140 -3.146) 5.292 8.546 ( 0.791 14.503 -0.517) 14.533 8.787 ( 0.252 -10.888 -1.570) 11.003 9.142 ( -1.387 6.285 -1.651) 6.644 9.274 ( -1.196 -6.746 -3.540) 7.712 ======================= Grid point 206 (115/309) ======================= q-point: ( 0.12 0.40 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 511 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.027 ( 4.474 5.821 10.356) 12.695 1.179 ( 5.378 -8.967 5.114) 11.639 1.556 ( 15.426 0.292 10.127) 18.456 1.593 ( 14.399 -3.758 10.714) 18.337 1.953 ( 2.196 5.019 -4.276) 6.950 2.000 ( 4.880 0.208 -3.496) 6.007 2.201 ( 8.314 8.368 -0.293) 11.800 2.389 ( 4.303 -9.775 -0.677) 10.701 2.777 ( 1.970 12.562 8.875) 15.507 2.982 ( 0.127 -7.165 6.655) 9.780 4.624 ( -2.810 -1.545 5.610) 6.462 4.655 ( -2.516 -4.860 4.651) 7.182 6.232 ( -13.686 2.744 13.012) 19.083 6.300 ( -10.428 -4.438 9.979) 15.100 6.876 ( -2.546 0.904 -2.958) 4.006 6.889 ( -2.189 -0.390 -2.029) 3.010 7.106 ( 11.253 3.053 8.434) 14.390 7.188 ( 11.893 -5.687 5.724) 14.372 7.752 ( 6.548 1.432 -5.001) 8.363 7.779 ( 6.095 -1.308 -4.062) 7.441 8.558 ( 0.937 13.270 0.337) 13.307 8.763 ( 0.205 -7.528 -2.401) 7.904 9.091 ( -2.768 3.026 -1.299) 4.302 9.190 ( -2.974 -6.076 -4.025) 7.872 ======================= Grid point 207 (116/309) ======================= q-point: ( 0.18 0.40 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 511 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.238 ( 7.003 4.133 7.549) 11.096 1.341 ( 7.388 -6.085 4.082) 10.405 1.809 ( 5.047 4.551 -2.983) 7.422 1.868 ( 5.815 -1.933 1.335) 6.271 1.950 ( 5.376 3.218 3.610) 7.232 2.018 ( 5.081 -3.229 0.485) 6.040 2.333 ( 10.017 4.723 -1.003) 11.120 2.464 ( 7.230 -8.214 -1.111) 10.999 2.902 ( 1.127 10.511 5.472) 11.904 3.039 ( -1.280 -3.036 3.057) 4.494 4.641 ( -3.653 -2.307 3.814) 5.764 4.661 ( -3.501 -4.660 2.809) 6.470 6.198 ( -13.064 3.035 11.224) 17.489 6.268 ( -10.424 -4.469 8.176) 13.982 6.749 ( -4.916 1.357 -6.180) 8.013 6.774 ( -4.868 -1.169 -5.497) 7.435 7.391 ( 9.745 1.595 8.591) 13.089 7.436 ( 9.335 -3.174 6.275) 11.687 7.785 ( 7.616 1.840 -5.674) 9.673 7.817 ( 6.988 -1.389 -4.719) 8.546 8.582 ( 0.942 11.623 1.093) 11.712 8.732 ( 0.395 -2.655 -2.676) 3.791 9.023 ( -4.019 -1.308 -1.260) 4.410 9.080 ( -4.154 -5.518 -4.104) 8.035 ======================= Grid point 208 (117/309) ======================= q-point: ( 0.24 0.40 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 511 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.433 ( 7.299 2.850 5.103) 9.351 1.497 ( 7.077 -3.424 2.710) 8.316 1.754 ( 0.972 2.725 -5.885) 6.558 1.810 ( -0.710 -3.274 -7.776) 8.466 2.124 ( 5.652 3.042 4.797) 8.014 2.161 ( 4.327 0.092 4.684) 6.378 2.456 ( 7.626 3.288 -0.683) 8.333 2.553 ( 6.847 -6.054 -2.188) 9.397 2.952 ( -1.089 6.994 1.943) 7.340 3.032 ( -2.132 -0.841 -0.027) 2.292 4.619 ( -4.364 -3.093 1.878) 5.669 4.628 ( -4.140 -4.206 0.856) 5.963 6.149 ( -12.333 2.639 9.459) 15.765 6.213 ( -10.268 -4.214 6.348) 12.786 6.568 ( -6.083 1.707 -7.995) 10.190 6.602 ( -6.240 -1.979 -7.210) 9.738 7.623 ( 6.733 0.688 7.297) 9.952 7.638 ( 6.926 -0.978 6.036) 9.239 7.823 ( 7.785 2.115 -5.745) 9.904 7.857 ( 7.130 -1.327 -4.958) 8.786 8.613 ( 0.518 10.601 1.642) 10.740 8.704 ( 0.504 2.982 -2.500) 3.924 8.940 ( -4.538 -5.560 -1.279) 7.289 8.966 ( -3.993 -6.285 -3.210) 8.109 ======================= Grid point 209 (118/309) ======================= q-point: ( 0.29 0.40 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 511 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.588 ( 5.900 1.485 3.024) 6.794 1.620 ( 5.252 -1.686 1.250) 5.656 1.709 ( 1.704 0.041 -4.211) 4.543 1.727 ( 1.713 -1.770 -3.144) 3.994 2.230 ( 1.900 3.146 2.576) 4.488 2.248 ( 1.273 1.807 2.120) 3.062 2.537 ( 3.377 2.226 0.439) 4.068 2.587 ( 2.605 -2.327 -3.374) 4.857 2.943 ( -1.584 3.134 0.714) 3.584 2.984 ( -2.229 -0.704 -1.873) 2.996 4.566 ( -4.326 -3.687 0.057) 5.684 4.568 ( -4.322 -3.856 0.051) 5.792 6.090 ( -11.061 1.403 7.194) 13.269 6.130 ( -9.269 -2.962 2.238) 9.985 6.376 ( -5.886 1.404 -5.405) 8.114 6.408 ( -6.354 -2.082 -6.353) 9.223 7.791 ( 4.001 1.634 6.101) 7.477 7.815 ( 5.505 -0.809 5.851) 8.074 7.857 ( 6.888 2.235 -5.396) 9.031 7.891 ( 6.610 -1.254 -5.070) 8.425 8.639 ( -0.383 10.967 1.866) 11.131 8.667 ( -1.249 9.028 -2.527) 9.458 8.875 ( -1.992 -9.449 -0.323) 9.662 8.881 ( -3.000 -9.020 -1.536) 9.629 ======================= Grid point 210 (119/309) ======================= q-point: ( 0.35 0.40 -0.83) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 511 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.660 ( 2.413 1.448 -1.459) 3.170 1.680 ( 1.683 -0.200 1.414) 2.207 1.742 ( 3.724 -0.618 0.132) 3.777 1.757 ( 4.627 -1.788 0.712) 5.011 2.247 ( -1.539 3.123 -0.444) 3.510 2.258 ( -1.141 2.152 -0.741) 2.546 2.563 ( -0.362 1.573 -1.109) 1.959 2.577 ( -0.471 0.386 2.793) 2.859 2.935 ( -0.709 0.346 -0.484) 0.926 2.948 ( -0.365 -0.983 1.851) 2.127 4.507 ( -3.027 -3.712 -0.051) 4.790 4.512 ( -3.520 -4.152 0.579) 5.474 5.999 ( -5.781 0.226 -3.140) 6.583 6.013 ( -7.972 -1.230 2.965) 8.594 6.274 ( -5.408 -0.192 0.618) 5.447 6.282 ( -4.813 -0.971 2.632) 5.571 7.877 ( 5.317 2.251 -5.059) 7.676 7.901 ( 2.262 1.245 0.760) 2.692 7.921 ( 5.043 0.298 -1.375) 5.235 7.953 ( 3.487 -1.532 4.189) 5.662 8.607 ( -2.494 12.457 -1.324) 12.773 8.654 ( -1.024 11.497 2.047) 11.723 8.837 ( -1.288 -11.372 -0.002) 11.444 8.870 ( 0.214 -10.782 0.878) 10.820 ======================= Grid point 211 (120/309) ======================= q-point: ( 0.41 0.40 -0.83) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 511 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.671 ( -0.130 1.986 -0.209) 2.001 1.699 ( 0.107 -0.177 0.675) 0.706 1.784 ( 2.264 0.327 -1.369) 2.666 1.823 ( 2.893 -3.018 -0.934) 4.283 2.190 ( -1.939 3.629 -2.711) 4.928 2.210 ( -1.435 1.866 -2.348) 3.325 2.572 ( -0.585 3.057 3.611) 4.767 2.619 ( -1.642 -0.742 6.458) 6.705 2.953 ( 1.113 1.145 2.731) 3.163 2.995 ( 0.388 -2.527 4.798) 5.437 4.484 ( -1.493 -3.927 1.706) 4.534 4.489 ( -1.810 -4.338 2.085) 5.142 5.925 ( -0.574 1.660 0.294) 1.781 5.970 ( -2.942 -2.973 3.828) 5.670 6.248 ( -4.121 1.900 5.543) 7.164 6.289 ( -3.648 -2.282 6.870) 8.107 7.876 ( 3.372 2.134 -4.556) 6.057 7.905 ( 3.009 -0.615 -4.271) 5.261 7.972 ( 0.943 2.560 0.652) 2.805 8.021 ( 0.775 -2.346 0.724) 2.574 8.581 ( -0.886 14.290 1.821) 14.432 8.667 ( -1.225 11.467 2.319) 11.763 8.840 ( -0.161 -12.135 1.822) 12.273 8.891 ( 0.391 -11.070 1.218) 11.144 ======================= Grid point 212 (121/309) ======================= q-point: ( 0.47 0.40 -0.83) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 511 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.659 ( -0.964 2.782 0.431) 2.975 1.709 ( -0.005 -1.272 0.693) 1.449 1.767 ( 0.475 -0.220 -3.784) 3.820 1.804 ( -0.298 -3.121 -3.586) 4.764 2.142 ( 0.079 4.095 -2.474) 4.785 2.170 ( 0.057 1.791 -1.973) 2.665 2.639 ( 0.357 4.327 6.119) 7.503 2.712 ( -0.816 -1.628 9.476) 9.649 3.025 ( 0.605 2.085 5.184) 5.620 3.089 ( 0.422 -3.190 7.691) 8.337 4.506 ( -0.506 -4.028 3.541) 5.387 4.513 ( -0.536 -4.593 3.777) 5.970 5.985 ( 0.138 1.772 7.506) 7.714 6.038 ( 0.314 -3.495 8.270) 8.983 6.296 ( -1.038 3.272 7.275) 8.044 6.355 ( -1.013 -2.684 8.077) 8.571 7.852 ( 0.802 1.980 -3.736) 4.303 7.879 ( 1.465 -0.693 -4.448) 4.734 7.969 ( 0.475 1.697 -2.091) 2.735 8.001 ( -0.765 -1.525 -2.805) 3.283 8.630 ( 1.061 13.668 4.543) 14.443 8.680 ( -1.384 12.138 2.362) 12.443 8.876 ( 0.202 -11.815 3.185) 12.239 8.912 ( -0.128 -11.447 1.706) 11.574 ======================= Grid point 213 (122/309) ======================= q-point: (-0.47 0.40 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 511 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.661 ( -0.043 3.348 0.040) 3.348 1.711 ( -0.451 -0.561 -2.078) 2.200 1.730 ( 1.836 -1.128 0.788) 2.295 1.758 ( 0.650 -3.561 -3.433) 4.989 2.108 ( -0.418 4.373 -2.580) 5.095 2.147 ( -0.068 0.925 -1.880) 2.096 2.737 ( 0.535 5.146 6.589) 8.377 2.834 ( -0.849 -3.283 9.332) 9.929 3.097 ( -1.568 4.790 6.006) 7.841 3.196 ( -1.509 -3.990 8.329) 9.358 4.558 ( -0.188 -4.017 4.367) 5.937 4.567 ( -0.285 -4.763 4.590) 6.620 6.085 ( -5.612 3.118 11.770) 13.407 6.162 ( -2.911 -5.036 11.081) 12.515 6.424 ( 4.492 3.603 7.573) 9.514 6.483 ( 3.335 -2.397 8.039) 9.027 7.794 ( -2.574 1.905 -2.908) 4.326 7.824 ( -1.252 -1.201 -3.802) 4.179 7.946 ( 2.223 0.090 -3.805) 4.408 7.948 ( 1.151 -0.078 -4.573) 4.716 8.688 ( -1.755 12.917 2.252) 13.229 8.718 ( 1.611 12.077 4.664) 13.047 8.920 ( -0.077 -11.122 2.692) 11.443 8.946 ( 0.024 -11.257 4.037) 11.959 ======================= Grid point 214 (123/309) ======================= q-point: (-0.41 0.40 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 511 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.621 ( -1.939 3.669 -2.590) 4.892 1.693 ( -2.043 -3.199 -2.828) 4.734 1.750 ( 3.092 2.456 1.025) 4.080 1.804 ( 4.741 -3.118 2.108) 6.054 2.054 ( -1.794 4.319 -2.953) 5.531 2.106 ( -1.626 -0.637 -2.518) 3.064 2.813 ( -1.973 4.696 5.465) 7.471 2.917 ( -3.192 -5.298 6.525) 8.990 3.134 ( -4.368 7.710 5.664) 10.517 3.253 ( -4.846 -3.817 6.581) 9.020 4.609 ( -0.876 -3.891 3.907) 5.583 4.619 ( -1.072 -4.752 4.189) 6.424 6.128 ( -9.972 4.943 11.759) 16.191 6.234 ( -7.499 -6.310 10.971) 14.710 6.607 ( 5.823 2.693 6.535) 9.158 6.651 ( 4.597 -1.804 6.719) 8.339 7.697 ( -4.891 2.415 -3.093) 6.271 7.746 ( -3.468 -2.856 -2.227) 5.014 7.917 ( 3.341 0.885 -4.837) 5.945 7.938 ( 3.617 -1.315 -3.715) 5.349 8.689 ( -2.075 13.744 2.181) 14.070 8.789 ( 0.799 8.681 2.731) 9.136 8.966 ( 0.420 -9.803 4.059) 10.618 9.012 ( 0.579 -9.332 4.552) 10.400 ======================= Grid point 215 (124/309) ======================= q-point: (-0.35 0.40 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 511 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.537 ( -4.721 2.673 -2.836) 6.122 1.582 ( -6.502 -1.705 -3.673) 7.660 1.828 ( 3.523 4.653 1.213) 5.961 1.874 ( 0.438 0.445 -1.544) 1.665 2.001 ( 1.378 -0.368 -1.109) 1.807 2.031 ( -3.298 -2.273 -2.637) 4.796 2.808 ( -6.805 4.090 2.604) 8.355 2.901 ( -7.488 -5.537 2.722) 9.702 3.117 ( -7.524 8.001 4.598) 11.906 3.228 ( -8.227 -2.944 4.170) 9.682 4.631 ( -2.378 -3.749 2.699) 5.195 4.640 ( -2.712 -4.542 2.889) 6.027 6.114 ( -11.736 6.367 10.051) 16.712 6.245 ( -9.401 -7.480 9.274) 15.176 6.752 ( 3.973 2.030 3.846) 5.890 6.784 ( 3.291 -1.308 3.982) 5.329 7.565 ( -6.902 4.041 -3.394) 8.688 7.660 ( -5.108 -6.046 -1.186) 8.003 7.912 ( 3.630 1.568 -3.784) 5.473 7.949 ( 3.552 -2.331 -2.844) 5.113 8.689 ( -2.086 14.308 2.594) 14.690 8.820 ( 0.219 4.594 1.280) 4.774 9.034 ( 0.307 -6.912 4.270) 8.130 9.083 ( 1.534 -7.814 3.524) 8.708 ======================= Grid point 216 (125/309) ======================= q-point: (-0.29 0.40 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 511 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.378 ( -11.556 3.248 -3.006) 12.374 1.430 ( -7.208 -2.321 -2.687) 8.035 1.741 ( -7.798 6.034 -4.938) 11.027 1.844 ( -2.685 -3.845 -4.231) 6.316 1.984 ( 0.863 2.974 0.958) 3.242 2.057 ( 3.890 -3.834 -0.084) 5.463 2.668 ( -12.691 6.797 -1.550) 14.480 2.786 ( -10.300 -5.949 0.695) 11.915 3.021 ( -12.051 6.359 2.200) 13.803 3.123 ( -11.327 -3.290 1.860) 11.941 4.610 ( -4.262 -3.572 1.547) 5.772 4.616 ( -4.244 -4.147 1.326) 6.080 6.058 ( -11.588 7.530 7.580) 15.762 6.213 ( -9.500 -8.720 6.866) 14.609 6.834 ( 2.679 1.866 1.282) 3.508 6.862 ( 2.561 -1.160 1.423) 3.151 7.393 ( -9.905 6.612 -3.555) 12.428 7.553 ( -7.668 -10.328 -0.890) 12.894 7.916 ( 2.459 1.995 -2.443) 3.999 7.960 ( 2.100 -2.682 -1.865) 3.883 8.701 ( -1.907 14.111 3.580) 14.682 8.840 ( 0.890 3.025 0.575) 3.206 9.073 ( -1.227 -4.154 2.275) 4.893 9.152 ( 2.659 -8.274 1.806) 8.876 ======================= Grid point 217 (126/309) ======================= q-point: (-0.24 0.40 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 511 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.151 ( -14.274 7.442 -0.501) 16.105 1.291 ( -7.897 -5.942 -0.757) 9.912 1.534 ( -10.908 6.733 -4.120) 13.464 1.694 ( -8.256 -8.651 -4.124) 12.649 2.025 ( 1.637 3.804 0.597) 4.184 2.081 ( 0.514 -1.992 -1.729) 2.687 2.420 ( -14.560 13.294 -3.157) 19.967 2.630 ( -10.391 -9.026 -0.095) 13.764 2.816 ( -16.541 5.802 -0.682) 17.543 2.940 ( -14.541 -5.949 -0.403) 15.716 4.549 ( -5.955 -2.922 0.830) 6.685 4.557 ( -4.755 -3.922 0.156) 6.166 5.981 ( -9.897 8.491 4.744) 13.876 6.155 ( -8.221 -9.862 4.176) 13.501 6.873 ( 1.256 1.724 -0.151) 2.138 6.899 ( 0.544 -1.172 -0.557) 1.407 7.183 ( -11.363 9.168 -2.477) 14.809 7.404 ( -10.720 -14.557 -0.620) 18.088 7.914 ( 0.606 2.087 -1.331) 2.548 7.956 ( 0.024 -2.390 -1.168) 2.660 8.724 ( -2.363 12.104 4.015) 12.970 8.866 ( 2.209 2.360 0.043) 3.233 9.062 ( -1.920 -0.309 -0.122) 1.949 9.207 ( 3.145 -9.757 -0.010) 10.251 ======================= Grid point 218 (127/309) ======================= q-point: (-0.18 0.40 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 511 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.985 ( -10.656 12.673 4.603) 17.186 1.177 ( -7.728 -1.013 0.255) 7.798 1.335 ( -11.377 0.697 1.054) 11.447 1.506 ( -11.787 -10.577 -1.092) 15.875 1.989 ( -8.002 5.669 -1.818) 9.974 2.032 ( -2.614 -0.291 -1.793) 3.183 2.224 ( -5.440 17.305 -0.747) 18.155 2.506 ( -6.053 -9.901 0.506) 11.615 2.529 ( -18.030 5.433 -2.376) 18.980 2.701 ( -15.142 -11.629 -0.246) 19.094 4.465 ( -6.046 -1.703 0.542) 6.304 4.488 ( -4.617 -4.090 0.266) 6.174 5.900 ( -7.087 9.246 2.268) 11.869 6.087 ( -5.973 -10.654 1.624) 12.322 6.775 ( -15.779 4.930 0.188) 16.533 6.853 ( -5.872 -2.337 -0.296) 6.327 7.084 ( 1.372 4.452 -0.611) 4.698 7.243 ( -8.505 -13.810 0.033) 16.219 7.895 ( -1.369 1.613 -0.697) 2.228 7.926 ( -2.146 -1.650 -1.030) 2.896 8.723 ( -2.935 9.714 1.154) 10.213 8.900 ( 0.495 -5.019 0.547) 5.073 9.034 ( 1.004 9.016 -1.194) 9.149 9.251 ( 3.629 -10.428 -0.894) 11.078 ======================= Grid point 219 (128/309) ======================= q-point: (-0.12 0.40 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 511 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.918 ( -6.837 16.064 0.752) 17.474 1.057 ( -11.175 10.988 4.524) 16.312 1.234 ( -7.430 -10.010 1.674) 12.578 1.327 ( -14.482 -10.703 4.047) 18.457 1.847 ( -7.388 12.529 1.823) 14.659 1.944 ( -3.849 -1.251 -2.154) 4.584 2.164 ( -9.141 15.097 0.619) 17.659 2.283 ( -6.580 5.283 -2.379) 8.768 2.432 ( -4.863 -5.792 1.955) 7.811 2.577 ( -4.764 -19.283 4.764) 20.426 4.400 ( -4.235 -0.367 1.967) 4.684 4.441 ( -3.107 -4.643 1.972) 5.925 5.853 ( -2.719 9.323 3.055) 10.181 6.035 ( -2.810 -10.119 1.471) 10.604 6.534 ( -20.332 5.606 6.623) 22.106 6.679 ( -19.765 -9.396 4.815) 22.408 7.127 ( 5.224 1.757 -2.012) 5.868 7.183 ( 0.585 -5.332 -1.323) 5.525 7.851 ( -3.143 0.669 -0.921) 3.343 7.865 ( -3.572 -0.756 -1.445) 3.927 8.669 ( -2.432 10.589 -2.796) 11.219 8.873 ( -2.970 -10.950 -0.483) 11.356 9.085 ( 5.200 12.246 0.326) 13.308 9.293 ( 3.665 -9.581 -1.058) 10.313 ======================= Grid point 220 (129/309) ======================= q-point: (-0.06 0.40 0.17) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 511 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.789 ( -7.365 19.079 -1.990) 20.548 0.943 ( -13.474 12.749 5.914) 19.470 1.125 ( -6.277 -15.093 -0.937) 16.373 1.177 ( -12.830 -10.633 2.993) 16.930 1.831 ( -0.293 6.664 1.620) 6.865 1.882 ( -2.088 -1.320 -0.394) 2.501 2.044 ( -8.123 20.964 6.740) 23.471 2.220 ( 0.352 5.179 -1.886) 5.523 2.471 ( 1.244 -5.274 4.920) 7.319 2.606 ( -2.011 -18.523 5.754) 19.500 4.409 ( -1.191 0.417 5.246) 5.395 4.464 ( -0.316 -5.299 4.991) 7.286 5.959 ( 6.180 6.002 10.447) 13.541 6.088 ( 3.478 -7.144 7.082) 10.644 6.378 ( -17.458 2.220 11.604) 21.080 6.465 ( -21.967 -7.494 11.171) 25.758 7.158 ( 3.977 1.359 -4.052) 5.838 7.181 ( 2.578 -1.162 -3.623) 4.596 7.781 ( -2.938 0.552 -1.874) 3.528 7.794 ( -2.605 -0.723 -1.745) 3.217 8.595 ( -1.126 13.396 -3.365) 13.858 8.827 ( -1.729 -11.627 -0.703) 11.776 9.156 ( 3.624 8.975 -0.516) 9.692 9.323 ( 2.667 -8.261 -1.668) 8.840 ======================= Grid point 255 (130/309) ======================= q-point: ( 0.00 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.982 ( 2.109 0.000 14.420) 14.573 1.228 ( 0.693 0.000 13.896) 13.913 1.304 ( -4.313 0.000 4.039) 5.909 1.466 ( -1.853 0.000 20.585) 20.668 1.595 ( 1.445 0.000 2.132) 2.576 1.739 ( 1.274 0.000 -2.391) 2.709 1.922 ( 8.382 0.000 1.591) 8.531 1.945 ( -3.261 0.000 -0.718) 3.339 2.883 ( 0.571 0.000 5.350) 5.380 3.001 ( -0.736 0.000 -1.039) 1.273 4.722 ( -0.125 0.000 7.657) 7.658 4.821 ( 0.007 0.000 6.615) 6.615 6.569 ( -1.227 0.000 15.316) 15.365 6.599 ( -0.485 0.000 6.770) 6.788 6.685 ( -0.539 0.000 15.613) 15.622 6.897 ( 0.585 0.000 -0.884) 1.060 6.962 ( -0.708 0.000 0.067) 0.711 6.968 ( -0.397 0.000 -4.152) 4.171 7.652 ( -0.654 0.000 -3.699) 3.756 7.727 ( 0.701 0.000 -2.948) 3.031 8.107 ( 0.743 0.000 6.062) 6.108 8.903 ( -0.276 0.000 -5.268) 5.275 9.138 ( 0.320 0.000 1.198) 1.240 9.378 ( 0.421 0.000 -3.835) 3.858 ======================= Grid point 256 (131/309) ======================= q-point: ( 0.06 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.165 ( -2.475 0.000 13.750) 13.971 1.385 ( 0.892 0.000 6.305) 6.368 1.390 ( 6.604 0.000 3.311) 7.388 1.616 ( 4.642 0.000 3.798) 5.998 1.763 ( 6.922 0.000 -3.419) 7.720 1.885 ( -2.905 0.000 0.989) 3.068 1.892 ( 12.768 0.000 17.410) 21.590 2.124 ( 12.567 0.000 2.019) 12.728 2.920 ( -2.610 0.000 2.338) 3.504 2.970 ( -1.385 0.000 -1.368) 1.947 4.804 ( -2.094 0.000 6.809) 7.124 4.895 ( -1.347 0.000 5.238) 5.408 6.566 ( -18.446 0.000 13.829) 23.054 6.598 ( -8.980 0.000 7.237) 11.534 6.869 ( -2.214 0.000 -2.403) 3.267 6.900 ( -2.092 0.000 -2.474) 3.240 6.969 ( 9.608 0.000 12.996) 16.163 7.167 ( 16.275 0.000 2.263) 16.432 7.606 ( 3.076 0.000 -5.670) 6.451 7.710 ( 3.206 0.000 -3.939) 5.078 8.201 ( 0.601 0.000 6.315) 6.344 8.810 ( -1.701 0.000 -5.950) 6.188 9.163 ( 0.261 0.000 1.377) 1.402 9.318 ( -1.420 0.000 -4.008) 4.252 ======================= Grid point 257 (132/309) ======================= q-point: ( 0.12 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.314 ( -1.001 0.000 12.429) 12.469 1.423 ( 0.656 0.000 -1.199) 1.367 1.516 ( 6.197 0.000 0.909) 6.264 1.791 ( 9.622 0.000 4.639) 10.682 1.834 ( 7.985 0.000 -4.983) 9.412 1.888 ( 1.840 0.000 1.646) 2.469 2.293 ( 13.592 0.000 10.410) 17.121 2.324 ( 10.001 0.000 1.661) 10.138 2.883 ( -3.934 0.000 0.371) 3.952 2.922 ( -2.051 0.000 -1.748) 2.694 4.846 ( -3.637 0.000 5.546) 6.632 4.916 ( -3.199 0.000 2.687) 4.178 6.476 ( -17.369 0.000 12.862) 21.613 6.561 ( -8.361 0.000 5.895) 10.230 6.759 ( -5.998 0.000 -4.422) 7.452 6.830 ( -3.451 0.000 -2.686) 4.373 7.280 ( 9.789 0.000 10.743) 14.534 7.411 ( 11.338 0.000 3.136) 11.764 7.588 ( 6.155 0.000 -7.007) 9.326 7.714 ( 5.227 0.000 -4.670) 7.009 8.296 ( 0.293 0.000 6.507) 6.513 8.698 ( -2.101 0.000 -6.003) 6.360 9.173 ( -1.097 0.000 0.798) 1.356 9.229 ( -2.907 0.000 -4.012) 4.954 ======================= Grid point 258 (133/309) ======================= q-point: ( 0.18 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.422 ( 3.939 0.000 -2.313) 4.568 1.475 ( 1.141 0.000 10.732) 10.793 1.609 ( 5.448 0.000 -0.083) 5.448 1.814 ( 2.498 0.000 -8.103) 8.480 1.983 ( 8.399 0.000 2.990) 8.916 1.990 ( 7.653 0.000 0.514) 7.670 2.449 ( 3.791 0.000 1.347) 4.023 2.531 ( 6.476 0.000 0.925) 6.542 2.848 ( -0.424 0.000 0.499) 0.655 2.886 ( 0.409 0.000 -0.403) 0.574 4.847 ( -4.726 0.000 3.719) 6.014 4.875 ( -4.540 0.000 0.056) 4.541 6.401 ( -15.374 0.000 11.965) 19.481 6.512 ( -8.455 0.000 5.435) 10.052 6.567 ( -8.760 0.000 -7.732) 11.685 6.712 ( -5.832 0.000 -4.674) 7.474 7.546 ( 7.854 0.000 8.640) 11.677 7.597 ( 7.542 0.000 3.851) 8.468 7.600 ( 8.084 0.000 -6.920) 10.641 7.737 ( 6.464 0.000 -4.744) 8.018 8.383 ( -0.602 0.000 6.223) 6.252 8.587 ( -2.135 0.000 -5.692) 6.079 9.134 ( -2.767 0.000 -3.052) 4.120 9.151 ( -2.518 0.000 0.062) 2.518 ======================= Grid point 259 (134/309) ======================= q-point: ( 0.24 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.499 ( 7.862 0.000 0.567) 7.882 1.627 ( 2.703 0.000 5.857) 6.451 1.677 ( 3.116 0.000 1.784) 3.591 1.708 ( 1.307 0.000 -10.574) 10.655 2.104 ( 6.435 0.000 0.462) 6.452 2.116 ( 4.965 0.000 1.579) 5.210 2.491 ( -0.750 0.000 2.538) 2.647 2.534 ( -0.834 0.000 -3.236) 3.342 2.888 ( 3.658 0.000 1.130) 3.828 2.912 ( 2.918 0.000 -1.497) 3.280 4.791 ( -4.648 0.000 -1.757) 4.969 4.809 ( -5.194 0.000 1.812) 5.501 6.294 ( -9.613 0.000 -11.469) 14.965 6.346 ( -13.682 0.000 11.891) 18.127 6.465 ( -7.835 0.000 5.841) 9.773 6.535 ( -7.366 0.000 -6.179) 9.615 7.638 ( 8.487 0.000 -5.768) 10.262 7.737 ( 3.705 0.000 6.653) 7.615 7.758 ( 6.615 0.000 4.541) 8.024 7.774 ( 6.707 0.000 -4.350) 7.994 8.442 ( -2.011 0.000 5.292) 5.661 8.479 ( -2.391 0.000 -5.269) 5.786 9.078 ( -0.838 0.000 -0.995) 1.301 9.110 ( -2.691 0.000 0.056) 2.692 ======================= Grid point 260 (135/309) ======================= q-point: ( 0.29 0.00 -0.75) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.602 ( 2.413 0.000 -7.830) 8.193 1.647 ( 8.961 0.000 1.462) 9.079 1.671 ( 3.003 0.000 -3.171) 4.367 1.783 ( -0.008 0.000 7.730) 7.730 2.158 ( -0.452 0.000 -1.082) 1.173 2.180 ( 2.320 0.000 0.256) 2.334 2.502 ( 0.150 0.000 1.215) 1.224 2.516 ( -1.125 0.000 3.679) 3.847 2.913 ( 2.259 0.000 -3.002) 3.757 2.971 ( 3.975 0.000 2.242) 4.564 4.706 ( -2.939 0.000 -1.703) 3.397 4.753 ( -4.412 0.000 0.974) 4.518 6.001 ( -6.462 0.000 -12.172) 13.781 6.316 ( -12.551 0.000 12.247) 17.536 6.348 ( -6.357 0.000 -5.113) 8.158 6.445 ( -6.436 0.000 6.944) 9.468 7.687 ( 7.400 0.000 -4.710) 8.772 7.816 ( 6.149 0.000 -3.659) 7.155 7.858 ( 0.620 0.000 5.838) 5.870 7.899 ( 5.370 0.000 3.528) 6.426 8.370 ( -3.050 0.000 -4.724) 5.623 8.470 ( -2.802 0.000 4.219) 5.065 9.079 ( 0.851 0.000 0.804) 1.170 9.084 ( -1.440 0.000 1.083) 1.802 ======================= Grid point 261 (136/309) ======================= q-point: ( 0.35 0.00 -0.75) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.579 ( 4.289 0.000 -3.073) 5.276 1.666 ( 2.355 0.000 -2.850) 3.697 1.779 ( 7.585 0.000 -0.745) 7.621 1.854 ( -2.590 0.000 5.232) 5.838 2.088 ( -3.091 0.000 -3.675) 4.802 2.160 ( -3.731 0.000 -1.832) 4.156 2.559 ( -1.068 0.000 4.589) 4.712 2.571 ( 0.696 0.000 6.762) 6.798 2.941 ( 4.550 0.000 0.935) 4.645 3.060 ( 2.711 0.000 3.445) 4.384 4.674 ( -0.184 0.000 0.706) 0.730 4.717 ( -2.520 0.000 1.679) 3.028 5.822 ( 1.506 0.000 -6.996) 7.156 6.235 ( -2.449 0.000 -1.076) 2.675 6.303 ( -11.882 0.000 12.401) 17.174 6.462 ( -5.303 0.000 8.270) 9.824 7.723 ( 5.690 0.000 -4.440) 7.217 7.856 ( 5.035 0.000 -2.835) 5.779 7.906 ( -2.423 0.000 3.352) 4.137 8.018 ( 4.215 0.000 2.245) 4.775 8.271 ( -2.631 0.000 -2.343) 3.523 8.479 ( -2.791 0.000 3.323) 4.340 9.098 ( -0.117 0.000 2.368) 2.371 9.112 ( 1.020 0.000 1.490) 1.806 ======================= Grid point 262 (137/309) ======================= q-point: ( 0.41 0.00 -0.75) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.630 ( 4.325 0.000 0.592) 4.365 1.671 ( 1.110 0.000 -0.373) 1.171 1.844 ( 5.128 0.000 -4.387) 6.748 1.849 ( -4.005 0.000 1.806) 4.394 2.007 ( -0.233 0.000 -3.594) 3.602 2.037 ( -6.425 0.000 -3.230) 7.191 2.605 ( -1.089 0.000 4.897) 5.017 2.687 ( -0.546 0.000 9.770) 9.785 3.073 ( 5.913 0.000 5.861) 8.326 3.144 ( 1.284 0.000 4.267) 4.456 4.713 ( 1.012 0.000 3.494) 3.637 4.728 ( -0.548 0.000 3.299) 3.345 5.875 ( 10.069 0.000 1.615) 10.198 6.258 ( 2.662 0.000 4.242) 5.008 6.301 ( -11.417 0.000 12.719) 17.091 6.505 ( -5.126 0.000 9.136) 10.476 7.737 ( 4.618 0.000 -4.549) 6.482 7.884 ( 3.512 0.000 -2.452) 4.284 7.885 ( -4.434 0.000 1.305) 4.622 8.034 ( -0.950 0.000 -3.164) 3.304 8.282 ( 2.562 0.000 4.058) 4.800 8.477 ( -2.818 0.000 2.552) 3.802 9.138 ( 0.317 0.000 3.152) 3.168 9.144 ( 0.336 0.000 1.598) 1.634 ======================= Grid point 263 (138/309) ======================= q-point: ( 0.47 0.00 -0.75) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.676 ( -2.882 0.000 2.629) 3.901 1.713 ( 4.050 0.000 1.687) 4.388 1.780 ( -2.819 0.000 -5.773) 6.424 1.814 ( 0.449 0.000 -2.485) 2.525 1.951 ( -0.032 0.000 -2.355) 2.356 1.982 ( 1.240 0.000 -1.563) 1.996 2.680 ( 1.246 0.000 6.479) 6.598 2.811 ( -1.896 0.000 10.537) 10.706 3.209 ( -0.638 0.000 4.448) 4.494 3.237 ( 3.398 0.000 6.522) 7.354 4.783 ( 0.372 0.000 4.765) 4.780 4.784 ( 0.355 0.000 4.685) 4.699 6.123 ( 13.205 0.000 7.160) 15.021 6.307 ( -11.562 0.000 13.112) 17.481 6.414 ( 5.952 0.000 8.065) 10.023 6.554 ( -5.646 0.000 9.621) 11.155 7.742 ( 4.518 0.000 -4.655) 6.487 7.813 ( -5.249 0.000 -1.118) 5.367 7.895 ( 2.427 0.000 -2.361) 3.386 7.964 ( -2.283 0.000 -2.138) 3.128 8.400 ( 4.085 0.000 4.518) 6.091 8.463 ( -3.325 0.000 1.939) 3.850 9.167 ( -0.165 0.000 1.833) 1.840 9.188 ( 0.244 0.000 3.454) 3.463 ======================= Grid point 264 (139/309) ======================= q-point: (-0.47 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.656 ( -4.502 0.000 2.583) 5.190 1.659 ( -2.926 0.000 -2.501) 3.849 1.780 ( 0.051 0.000 -3.906) 3.907 1.819 ( 5.412 0.000 1.442) 5.601 1.919 ( -0.144 0.000 -2.937) 2.941 1.995 ( 2.315 0.000 -0.625) 2.398 2.815 ( 2.646 0.000 8.335) 8.745 2.902 ( -3.992 0.000 8.638) 9.516 3.240 ( -3.199 0.000 4.083) 5.187 3.325 ( -1.527 0.000 3.898) 4.186 4.844 ( -0.932 0.000 4.460) 4.556 4.852 ( -0.443 0.000 4.903) 4.923 6.305 ( -12.804 0.000 12.920) 18.189 6.412 ( 10.718 0.000 7.646) 13.166 6.595 ( -6.589 0.000 9.636) 11.673 6.620 ( 5.560 0.000 8.251) 9.950 7.704 ( -5.366 0.000 -3.038) 6.167 7.749 ( 4.990 0.000 -4.547) 6.751 7.901 ( 2.502 0.000 -1.775) 3.067 7.922 ( -1.493 0.000 0.233) 1.511 8.429 ( -4.322 0.000 1.380) 4.537 8.511 ( 3.524 0.000 3.118) 4.706 9.195 ( 0.193 0.000 2.405) 2.413 9.238 ( 0.108 0.000 3.304) 3.306 ======================= Grid point 265 (140/309) ======================= q-point: (-0.41 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.610 ( -5.539 0.000 1.015) 5.631 1.623 ( -1.697 0.000 1.456) 2.236 1.703 ( -3.416 0.000 -3.090) 4.606 1.844 ( -2.756 0.000 -2.148) 3.495 1.928 ( 7.095 0.000 -1.892) 7.343 2.020 ( 2.310 0.000 -1.309) 2.655 2.905 ( -8.211 0.000 4.080) 9.169 2.959 ( 0.573 0.000 8.299) 8.318 3.220 ( -6.391 0.000 3.256) 7.173 3.299 ( -6.142 0.000 1.340) 6.287 4.873 ( -2.368 0.000 3.288) 4.052 4.893 ( -2.553 0.000 4.000) 4.746 6.268 ( -14.720 0.000 11.442) 18.643 6.615 ( -7.677 0.000 8.716) 11.615 6.626 ( 5.978 0.000 5.044) 7.822 6.779 ( 3.002 0.000 5.376) 6.157 7.570 ( -6.233 0.000 -4.033) 7.424 7.767 ( 5.146 0.000 -3.857) 6.431 7.927 ( 3.135 0.000 -0.615) 3.195 7.931 ( 0.507 0.000 2.346) 2.400 8.370 ( -5.538 0.000 0.723) 5.585 8.585 ( 2.341 0.000 1.261) 2.659 9.242 ( 1.287 0.000 2.812) 3.093 9.278 ( -0.226 0.000 2.515) 2.525 ======================= Grid point 266 (141/309) ======================= q-point: (-0.35 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.490 ( -11.685 0.000 -0.066) 11.685 1.584 ( -7.942 0.000 0.403) 7.953 1.629 ( -1.806 0.000 -1.424) 2.300 1.799 ( 0.658 0.000 0.497) 0.824 1.992 ( 6.809 0.000 -4.412) 8.114 2.018 ( 0.418 0.000 -2.118) 2.159 2.745 ( -15.759 0.000 -1.457) 15.826 3.032 ( -4.800 0.000 5.820) 7.544 3.137 ( -9.437 0.000 2.164) 9.682 3.205 ( -7.748 0.000 0.804) 7.790 4.860 ( -3.953 0.000 1.692) 4.300 4.882 ( -5.036 0.000 2.660) 5.695 6.176 ( -15.825 0.000 8.575) 17.999 6.601 ( -8.232 0.000 6.658) 10.588 6.733 ( 2.457 0.000 1.988) 3.161 6.860 ( 1.459 0.000 2.121) 2.574 7.403 ( -8.780 0.000 -4.297) 9.775 7.794 ( 4.241 0.000 -2.631) 4.991 7.970 ( 2.742 0.000 0.206) 2.749 8.003 ( 2.920 0.000 4.365) 5.252 8.284 ( -6.563 0.000 0.058) 6.563 8.613 ( 1.028 0.000 -0.872) 1.348 9.296 ( -0.946 0.000 1.302) 1.610 9.305 ( 2.275 0.000 2.294) 3.231 ======================= Grid point 267 (142/309) ======================= q-point: (-0.29 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.275 ( -17.081 0.000 0.702) 17.096 1.400 ( -14.070 0.000 -1.747) 14.178 1.605 ( -0.122 0.000 -0.215) 0.247 1.866 ( 3.142 0.000 3.680) 4.839 1.973 ( -2.966 0.000 -1.732) 3.435 2.005 ( 5.150 0.000 -6.732) 8.476 2.418 ( -23.108 0.000 -2.637) 23.258 2.935 ( -13.896 0.000 0.887) 13.924 3.026 ( -9.638 0.000 1.871) 9.818 3.099 ( -7.564 0.000 0.652) 7.592 4.803 ( -5.227 0.000 0.286) 5.235 4.816 ( -7.200 0.000 1.264) 7.310 6.035 ( -15.036 0.000 4.746) 15.767 6.553 ( -7.521 0.000 3.505) 8.298 6.771 ( 1.382 0.000 0.134) 1.388 6.899 ( 2.196 0.000 0.202) 2.205 7.191 ( -12.888 0.000 -2.867) 13.203 7.818 ( 2.475 0.000 -1.286) 2.789 8.003 ( 0.976 0.000 0.152) 0.988 8.134 ( 5.545 0.000 5.238) 7.628 8.179 ( -7.115 0.000 -0.402) 7.127 8.591 ( -0.499 0.000 -2.803) 2.847 9.285 ( -1.865 0.000 0.374) 1.902 9.365 ( 2.691 0.000 0.853) 2.823 ======================= Grid point 268 (143/309) ======================= q-point: (-0.24 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.018 ( -19.928 0.000 2.906) 20.139 1.149 ( -17.077 0.000 0.102) 17.077 1.612 ( 0.424 0.000 0.459) 0.625 1.867 ( -10.984 0.000 -1.324) 11.064 1.958 ( 3.689 0.000 -5.624) 6.726 1.979 ( 2.500 0.000 2.207) 3.335 2.045 ( -24.288 0.000 4.199) 24.649 2.688 ( -17.732 0.000 -1.685) 17.812 2.870 ( -12.310 0.000 -0.177) 12.312 3.013 ( -5.543 0.000 1.825) 5.836 4.707 ( -8.405 0.000 0.126) 8.406 4.724 ( -5.183 0.000 0.113) 5.185 5.868 ( -12.180 0.000 1.064) 12.226 6.474 ( -5.619 0.000 -0.596) 5.650 6.792 ( 1.854 0.000 -0.374) 1.891 6.940 ( 4.039 0.000 -0.840) 4.125 6.957 ( -16.798 0.000 2.084) 16.927 7.835 ( 0.875 0.000 0.255) 0.911 7.996 ( -1.560 0.000 -0.709) 1.714 8.066 ( -7.129 0.000 -0.500) 7.147 8.270 ( 7.039 0.000 -3.537) 7.878 8.549 ( -1.476 0.000 2.396) 2.814 9.254 ( -2.688 0.000 0.085) 2.689 9.406 ( 2.800 0.000 -0.857) 2.928 ======================= Grid point 269 (144/309) ======================= q-point: (-0.18 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.790 ( -18.308 0.000 6.456) 19.413 0.932 ( -16.491 0.000 6.530) 17.736 1.563 ( -23.116 0.000 3.907) 23.443 1.632 ( -2.336 0.000 0.644) 2.423 1.883 ( 1.716 0.000 -8.330) 8.504 1.884 ( -15.858 0.000 10.868) 19.225 2.067 ( -0.208 0.000 3.985) 3.990 2.384 ( -17.850 0.000 -2.646) 18.045 2.695 ( -9.656 0.000 0.649) 9.677 2.995 ( -1.979 0.000 3.431) 3.961 4.589 ( -7.256 0.000 0.706) 7.291 4.668 ( -3.595 0.000 1.629) 3.947 5.732 ( -6.339 0.000 1.219) 6.455 6.377 ( -3.848 0.000 -2.551) 4.617 6.772 ( -17.438 0.000 8.751) 19.511 6.820 ( 2.520 0.000 -0.299) 2.537 6.991 ( 5.178 0.000 -2.136) 5.601 7.854 ( -0.180 0.000 1.526) 1.536 7.938 ( -4.107 0.000 -1.375) 4.331 7.959 ( -5.924 0.000 -0.157) 5.926 8.129 ( -4.461 0.000 -18.070) 18.612 8.688 ( 6.069 0.000 9.117) 10.953 9.210 ( -3.227 0.000 0.008) 3.227 9.426 ( 2.808 0.000 -2.307) 3.634 ======================= Grid point 270 (145/309) ======================= q-point: (-0.12 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.669 ( -11.636 0.000 9.604) 15.088 0.877 ( -10.130 0.000 15.064) 18.153 1.314 ( -23.639 0.000 14.022) 27.485 1.625 ( -0.111 0.000 -0.872) 0.879 1.760 ( -20.555 0.000 8.015) 22.063 1.804 ( 2.015 0.000 -6.517) 6.822 2.003 ( -10.321 0.000 -2.201) 10.553 2.153 ( -10.043 0.000 0.760) 10.071 2.656 ( -0.693 0.000 5.252) 5.297 3.023 ( 0.016 0.000 1.600) 1.600 4.541 ( -2.943 0.000 4.272) 5.188 4.669 ( -1.463 0.000 4.064) 4.320 5.793 ( 6.932 0.000 9.837) 12.034 6.324 ( -1.529 0.000 1.982) 2.503 6.674 ( -14.724 0.000 11.572) 18.728 6.856 ( 2.631 0.000 -0.252) 2.643 7.025 ( 4.508 0.000 -3.856) 5.932 7.701 ( -19.300 0.000 -16.282) 25.251 7.825 ( -4.653 0.000 -1.142) 4.791 7.843 ( -4.379 0.000 -1.905) 4.776 7.940 ( -0.384 0.000 4.198) 4.215 8.879 ( 7.210 0.000 2.252) 7.553 9.162 ( -2.971 0.000 -0.025) 2.971 9.427 ( 2.552 0.000 -3.271) 4.149 ======================= Grid point 271 (146/309) ======================= q-point: (-0.06 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.744 ( 0.320 0.000 13.936) 13.940 1.018 ( -2.755 0.000 17.758) 17.971 1.262 ( -13.660 0.000 18.848) 23.277 1.498 ( -22.848 0.000 5.440) 23.486 1.602 ( -0.357 0.000 -1.731) 1.768 1.779 ( 1.848 0.000 -3.188) 3.685 1.842 ( -2.511 0.000 -2.106) 3.277 2.037 ( -7.432 0.000 0.400) 7.442 2.769 ( 2.520 0.000 7.091) 7.526 3.023 ( -0.375 0.000 -0.806) 0.889 4.610 ( 0.463 0.000 7.379) 7.394 4.730 ( -0.011 0.000 6.107) 6.107 6.183 ( 18.460 0.000 14.662) 23.574 6.409 ( 3.702 0.000 8.437) 9.214 6.637 ( -11.849 0.000 11.694) 16.648 6.886 ( 1.968 0.000 -0.446) 2.017 7.016 ( 2.281 0.000 -4.777) 5.293 7.214 ( -23.693 0.000 -4.447) 24.107 7.728 ( -4.199 0.000 -2.160) 4.722 7.771 ( -1.758 0.000 -2.309) 2.903 8.015 ( 0.682 0.000 5.695) 5.736 8.946 ( 3.080 0.000 -3.258) 4.483 9.131 ( -1.235 0.000 0.494) 1.330 9.412 ( 1.799 0.000 -3.701) 4.115 ======================= Grid point 272 (147/309) ======================= q-point: ( 0.00 0.20 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 510 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.011 ( -4.162 1.996 13.551) 14.316 1.016 ( 3.915 -9.007 20.116) 22.385 1.270 ( -4.586 -3.532 4.551) 7.363 1.415 ( 1.059 -13.619 5.253) 14.635 1.759 ( 2.786 6.133 -0.207) 6.740 1.781 ( -1.182 15.920 3.291) 16.299 1.924 ( 3.921 -1.678 -1.136) 4.413 2.119 ( 1.438 15.590 7.130) 17.203 2.754 ( -0.162 -9.742 2.758) 10.126 3.020 ( -0.097 -1.404 4.406) 4.625 4.682 ( -0.219 -3.582 7.600) 8.405 4.762 ( 0.106 -5.637 5.900) 8.161 6.548 ( -1.687 -4.007 8.438) 9.492 6.580 ( 0.245 1.099 15.329) 15.370 6.674 ( -1.171 -1.168 15.553) 15.641 6.740 ( -0.642 -10.099 7.179) 12.407 6.985 ( 0.131 2.254 -4.459) 4.998 7.033 ( 0.008 1.986 -4.341) 4.774 7.657 ( -0.469 0.575 -3.636) 3.711 7.718 ( 0.608 -0.912 -3.029) 3.221 8.261 ( 0.742 13.795 2.666) 14.070 8.901 ( -0.484 -1.720 -4.921) 5.235 9.100 ( 0.628 -2.084 1.344) 2.558 9.350 ( 0.456 -3.201 -3.917) 5.079 ======================= Grid point 273 (148/309) ======================= q-point: ( 0.06 0.20 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 510 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.114 ( -4.991 -3.624 14.441) 15.703 1.292 ( 1.378 -4.632 6.692) 8.255 1.406 ( 11.329 -0.966 7.893) 13.841 1.603 ( 8.691 -9.133 9.705) 15.909 1.782 ( 4.333 4.038 -2.869) 6.581 1.834 ( 2.830 8.248 0.430) 8.731 1.984 ( 7.601 1.222 0.179) 7.701 2.295 ( 7.198 12.825 6.683) 16.154 2.768 ( -2.271 -7.528 2.549) 8.266 3.063 ( -1.220 2.642 2.703) 3.972 4.761 ( -2.038 -3.994 6.422) 7.833 4.828 ( -1.422 -6.251 4.905) 8.072 6.542 ( -14.603 -2.201 12.263) 19.195 6.573 ( -12.307 -1.970 9.370) 15.593 6.879 ( -1.203 0.734 -0.784) 1.613 6.905 ( -1.159 0.278 -0.276) 1.223 6.975 ( 8.719 0.761 10.038) 13.317 7.121 ( 14.256 -4.034 3.731) 15.278 7.617 ( 3.296 1.053 -5.489) 6.488 7.702 ( 3.634 -0.923 -4.132) 5.580 8.317 ( 0.719 10.949 3.880) 11.639 8.814 ( -1.371 -0.262 -5.599) 5.770 9.126 ( -0.063 -2.957 1.531) 3.331 9.288 ( -1.472 -3.224 -4.134) 5.445 ======================= Grid point 274 (149/309) ======================= q-point: ( 0.12 0.20 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 510 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.250 ( -0.735 -3.409 11.317) 11.842 1.389 ( 2.454 -3.954 4.295) 6.332 1.599 ( 6.133 5.896 -1.817) 8.699 1.807 ( 7.743 1.149 3.850) 8.723 1.860 ( 2.540 -0.208 -0.301) 2.567 1.886 ( 9.702 2.678 -0.463) 10.075 2.169 ( 11.998 -4.222 3.614) 13.222 2.467 ( 7.764 2.727 0.974) 8.286 2.779 ( -2.190 0.383 4.849) 5.335 3.053 ( -2.597 5.699 0.192) 6.266 4.797 ( -3.509 -4.547 4.995) 7.612 4.846 ( -3.208 -6.490 2.697) 7.726 6.472 ( -16.298 -0.311 12.363) 20.459 6.528 ( -9.297 -2.734 6.566) 11.705 6.775 ( -5.948 1.280 -4.107) 7.340 6.830 ( -3.920 -0.190 -3.297) 5.126 7.282 ( 9.981 0.222 10.606) 14.566 7.380 ( 10.952 -2.797 5.048) 12.380 7.605 ( 6.287 1.622 -6.722) 9.345 7.710 ( 5.843 -0.686 -5.090) 7.780 8.385 ( 0.500 8.730 4.700) 9.927 8.714 ( -1.580 1.366 -5.526) 5.908 9.132 ( -1.578 -3.875 0.976) 4.296 9.196 ( -3.058 -3.391 -4.116) 6.148 ======================= Grid point 275 (150/309) ======================= q-point: ( 0.18 0.20 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 510 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.384 ( 3.172 -1.510 5.171) 6.251 1.492 ( 2.616 -1.320 5.922) 6.608 1.622 ( 4.775 2.614 -3.669) 6.564 1.811 ( 1.250 -1.214 -8.182) 8.365 1.995 ( 7.732 2.029 3.495) 8.724 2.030 ( 8.433 3.568 0.408) 9.166 2.371 ( 7.226 -4.609 3.566) 9.283 2.546 ( 5.588 -3.333 -3.297) 7.294 2.838 ( 0.122 5.513 5.059) 7.484 3.004 ( -2.163 6.597 -1.427) 7.088 4.793 ( -4.606 -5.150 3.150) 7.594 4.808 ( -4.458 -6.244 0.302) 7.677 6.398 ( -14.702 -0.225 10.638) 18.149 6.463 ( -9.673 -3.302 3.986) 10.971 6.601 ( -8.217 2.100 -5.084) 9.888 6.699 ( -6.366 -1.253 -4.587) 7.946 7.547 ( 8.239 0.157 7.979) 11.471 7.583 ( 7.414 -1.064 4.870) 8.934 7.623 ( 8.080 2.109 -5.981) 10.272 7.736 ( 7.083 -0.509 -5.356) 8.895 8.455 ( -0.267 7.207 4.934) 8.738 8.620 ( -1.464 3.298 -5.000) 6.166 9.093 ( -3.215 -4.172 -2.767) 5.950 9.107 ( -2.932 -4.345 -0.195) 5.246 ======================= Grid point 276 (151/309) ======================= q-point: ( 0.24 0.20 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 510 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.500 ( 6.827 0.369 1.962) 7.113 1.624 ( 2.482 -3.250 4.101) 5.792 1.640 ( 3.571 0.374 -2.489) 4.369 1.714 ( 1.422 -0.894 -5.610) 5.856 2.124 ( 5.661 2.777 0.976) 6.381 2.144 ( 5.550 2.722 0.594) 6.210 2.487 ( 2.425 -0.463 3.732) 4.475 2.548 ( 1.848 -0.182 -4.490) 4.859 2.899 ( 1.202 2.896 2.692) 4.133 2.961 ( -0.188 3.752 -2.553) 4.542 4.730 ( -4.606 -5.738 -1.400) 7.490 4.749 ( -5.143 -5.730 1.311) 7.810 6.280 ( -9.815 -0.987 -7.374) 12.316 6.333 ( -12.927 -1.575 7.571) 15.064 6.464 ( -8.044 0.176 3.618) 8.822 6.527 ( -8.269 -0.976 -3.533) 9.045 7.657 ( 8.575 1.870 -5.721) 10.476 7.745 ( 4.400 0.562 6.192) 7.617 7.761 ( 6.767 0.253 4.232) 7.985 7.774 ( 7.002 -0.201 -3.658) 7.902 8.504 ( -1.541 6.236 3.791) 7.459 8.533 ( -1.936 5.650 -3.838) 7.100 9.027 ( -1.336 -5.138 -1.287) 5.463 9.062 ( -3.123 -5.002 0.306) 5.905 ======================= Grid point 277 (152/309) ======================= q-point: ( 0.29 0.20 -0.75) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 510 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.584 ( 3.703 -0.717 -6.280) 7.326 1.641 ( 7.362 -0.513 1.764) 7.587 1.697 ( 2.790 1.216 -1.746) 3.509 1.763 ( 0.523 -1.918 6.667) 6.957 2.180 ( 1.140 2.876 -1.290) 3.352 2.202 ( 1.695 2.007 -0.316) 2.646 2.508 ( 0.691 1.540 -1.264) 2.109 2.568 ( 0.290 2.910 4.843) 5.658 2.919 ( 0.539 0.935 -2.847) 3.045 2.965 ( 2.534 -0.269 2.514) 3.580 4.648 ( -3.174 -5.400 -1.394) 6.417 4.687 ( -4.367 -6.229 0.594) 7.631 6.014 ( -6.555 1.442 -10.763) 12.684 6.231 ( -9.255 -5.624 1.223) 10.898 6.393 ( -9.105 1.686 4.938) 10.494 6.433 ( -7.190 -1.019 7.026) 10.104 7.705 ( 7.530 1.794 -5.015) 9.224 7.808 ( 6.443 -0.776 -4.708) 8.017 7.875 ( 1.634 1.431 5.786) 6.180 7.914 ( 5.136 1.118 4.071) 6.648 8.440 ( -2.616 7.400 -3.818) 8.729 8.530 ( -2.544 6.212 3.766) 7.697 9.017 ( 0.156 -6.261 0.522) 6.285 9.035 ( -1.491 -5.400 1.332) 5.758 ======================= Grid point 278 (153/309) ======================= q-point: ( 0.35 0.20 -0.75) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 510 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.595 ( 4.647 1.802 -1.920) 5.341 1.684 ( 1.978 1.117 -2.020) 3.040 1.779 ( 6.025 -0.174 0.220) 6.031 1.824 ( -2.563 -2.631 4.023) 5.447 2.124 ( -1.997 3.770 -4.219) 6.000 2.178 ( -2.641 1.715 -2.197) 3.840 2.545 ( 0.683 0.883 3.984) 4.137 2.643 ( -0.660 4.193 6.929) 8.126 2.928 ( 3.693 -0.799 0.550) 3.819 3.046 ( 2.222 -1.416 4.016) 4.803 4.613 ( -0.682 -5.674 0.785) 5.769 4.648 ( -2.443 -6.457 1.529) 7.071 5.847 ( 0.898 2.600 -5.966) 6.569 6.137 ( -3.910 -6.849 1.042) 7.955 6.358 ( -9.481 2.740 9.571) 13.748 6.448 ( -5.624 -1.381 8.687) 10.440 7.739 ( 5.850 1.582 -4.748) 7.698 7.832 ( 4.844 -1.424 -4.079) 6.491 7.941 ( -1.230 2.394 3.485) 4.403 8.023 ( 3.242 0.090 1.607) 3.619 8.365 ( -1.785 9.877 -1.021) 10.088 8.539 ( -2.493 6.295 3.214) 7.495 9.036 ( -0.155 -6.581 2.351) 6.990 9.053 ( 0.568 -6.085 1.600) 6.318 ======================= Grid point 279 (154/309) ======================= q-point: ( 0.41 0.20 -0.75) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 510 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.637 ( 2.311 1.173 -0.254) 2.604 1.700 ( 1.523 1.837 0.589) 2.458 1.803 ( -3.288 -3.506 0.111) 4.808 1.828 ( 2.275 -1.585 -2.744) 3.901 2.045 ( -0.915 3.864 -3.765) 5.472 2.090 ( -2.427 4.309 -3.121) 5.848 2.609 ( -0.433 1.342 5.156) 5.346 2.748 ( -0.698 4.701 10.042) 11.110 3.032 ( 4.497 -3.095 4.010) 6.773 3.145 ( 2.202 -0.496 6.044) 6.452 4.644 ( 0.468 -6.447 3.299) 7.257 4.661 ( -0.449 -6.384 3.410) 7.251 5.896 ( 8.596 2.227 2.248) 9.160 6.164 ( 0.768 -6.294 6.186) 8.859 6.364 ( -8.184 3.334 10.481) 13.709 6.495 ( -4.841 -1.131 9.500) 10.722 7.751 ( 4.538 1.348 -4.747) 6.704 7.838 ( 2.472 -1.905 -3.316) 4.554 7.941 ( -2.429 2.614 0.843) 3.667 8.027 ( -1.048 -0.702 -2.861) 3.127 8.389 ( 2.106 10.744 3.785) 11.584 8.543 ( -2.484 6.795 2.768) 7.746 9.073 ( -0.210 -6.684 3.084) 7.364 9.086 ( 0.650 -6.254 1.971) 6.589 ======================= Grid point 280 (155/309) ======================= q-point: ( 0.47 0.20 -0.75) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 510 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.666 ( -0.439 -0.322 2.204) 2.270 1.714 ( -1.291 -0.569 -0.381) 1.461 1.753 ( -0.434 -1.698 -2.201) 2.814 1.787 ( -0.052 -2.291 -2.724) 3.560 1.999 ( 0.608 4.459 -2.893) 5.350 2.053 ( 1.216 5.733 -1.736) 6.112 2.689 ( 0.994 1.766 6.281) 6.600 2.883 ( -1.374 5.785 11.374) 12.834 3.129 ( 1.145 -4.761 3.589) 6.072 3.273 ( 1.636 0.815 7.351) 7.574 4.704 ( 0.286 -7.022 4.475) 8.331 4.719 ( 0.192 -6.507 4.794) 8.085 6.120 ( 9.555 0.349 8.273) 12.644 6.297 ( -0.976 -2.868 11.292) 11.692 6.411 ( -2.837 1.849 9.530) 10.114 6.560 ( -3.669 -0.184 9.466) 10.154 7.749 ( 3.752 0.854 -4.461) 5.892 7.808 ( -1.348 -0.606 -2.695) 3.074 7.904 ( -0.295 0.892 -2.520) 2.690 7.957 ( -2.305 -0.766 -2.494) 3.481 8.491 ( 2.957 9.450 4.108) 10.721 8.541 ( -2.421 7.817 2.760) 8.637 9.104 ( -0.269 -6.449 2.289) 6.849 9.132 ( 0.303 -6.109 3.449) 7.022 ======================= Grid point 281 (156/309) ======================= q-point: (-0.47 0.20 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 510 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.631 ( -4.301 -0.530 -0.091) 4.335 1.690 ( -1.019 1.574 0.755) 2.021 1.753 ( 0.352 -2.457 -3.137) 4.001 1.795 ( 4.407 -2.049 1.345) 5.043 1.965 ( -0.366 4.452 -2.760) 5.251 2.054 ( 1.223 4.650 -1.322) 4.987 2.801 ( 0.970 0.624 7.093) 7.186 3.003 ( -2.727 7.562 10.242) 13.019 3.163 ( -2.226 -5.224 2.526) 6.215 3.361 ( -2.097 1.569 5.429) 6.027 4.764 ( -0.628 -7.188 4.364) 8.433 4.784 ( -0.587 -6.692 4.767) 8.237 6.297 ( -7.584 0.104 12.472) 14.597 6.445 ( 3.274 0.604 9.578) 10.140 6.532 ( -0.096 -1.611 8.974) 9.118 6.657 ( 1.190 0.705 7.860) 7.980 7.715 ( -4.553 1.132 -2.827) 5.477 7.752 ( 3.813 0.254 -4.306) 5.757 7.873 ( 0.943 -1.713 -3.069) 3.640 7.912 ( 0.193 -1.664 -1.176) 2.047 8.516 ( -3.216 9.085 2.002) 9.843 8.602 ( 2.592 8.629 3.299) 9.595 9.136 ( 0.216 -6.079 2.695) 6.654 9.183 ( 0.069 -5.782 3.530) 6.775 ======================= Grid point 282 (157/309) ======================= q-point: (-0.41 0.20 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 510 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.573 ( -4.679 -0.627 0.797) 4.787 1.677 ( -4.509 -0.234 -1.861) 4.884 1.709 ( 1.271 3.107 0.289) 3.369 1.860 ( -0.635 0.577 -0.705) 1.110 1.934 ( 3.999 1.687 -2.215) 4.873 2.045 ( 0.333 1.975 -1.729) 2.646 2.872 ( -4.228 -0.476 5.006) 6.570 3.073 ( -4.131 8.888 6.842) 11.953 3.132 ( -5.778 -6.500 2.365) 9.013 3.355 ( -6.193 2.908 3.021) 7.479 4.797 ( -2.087 -6.995 3.251) 7.991 4.822 ( -2.339 -6.764 3.752) 8.081 6.292 ( -13.734 2.506 11.411) 18.031 6.548 ( -6.906 -4.946 9.379) 12.654 6.666 ( 4.401 2.583 5.075) 7.197 6.782 ( 2.500 -0.207 4.963) 5.561 7.588 ( -6.135 1.849 -3.848) 7.474 7.765 ( 3.941 -0.716 -2.525) 4.735 7.851 ( 0.076 -3.908 -0.974) 4.028 7.926 ( 3.510 -2.636 -1.418) 4.613 8.489 ( -3.853 11.364 2.017) 12.167 8.667 ( 1.716 7.803 1.399) 8.112 9.187 ( 1.197 -5.741 3.052) 6.611 9.226 ( -0.230 -5.405 2.735) 6.062 ======================= Grid point 283 (158/309) ======================= q-point: (-0.35 0.20 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 510 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.487 ( -8.940 0.119 -0.006) 8.941 1.556 ( -7.328 -1.553 -1.186) 7.584 1.715 ( -4.304 6.550 -1.064) 7.910 1.811 ( 0.701 1.277 0.072) 1.459 1.980 ( 3.880 -0.867 -3.638) 5.389 2.028 ( 1.435 0.253 -1.507) 2.096 2.770 ( -13.730 2.605 -0.472) 13.983 3.035 ( -7.027 -4.387 1.420) 8.404 3.091 ( -8.546 3.170 5.029) 10.410 3.274 ( -8.558 3.688 1.773) 9.486 4.788 ( -3.691 -6.675 1.710) 7.817 4.812 ( -4.595 -6.585 2.384) 8.376 6.210 ( -15.211 3.471 8.445) 17.741 6.536 ( -9.135 -5.773 6.930) 12.838 6.764 ( 2.339 2.417 2.048) 3.938 6.856 ( 1.454 -0.490 1.940) 2.474 7.426 ( -8.505 2.600 -3.940) 9.728 7.794 ( 2.478 -2.426 -0.723) 3.543 7.849 ( 0.220 -6.579 0.147) 6.584 7.963 ( 3.513 -3.253 -1.333) 4.970 8.467 ( -2.912 14.662 2.733) 15.196 8.690 ( 0.662 7.329 -0.698) 7.392 9.238 ( -0.762 -5.867 2.016) 6.251 9.258 ( 1.772 -5.018 1.800) 5.618 ======================= Grid point 284 (159/309) ======================= q-point: (-0.29 0.20 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 510 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.297 ( -15.668 2.135 0.364) 15.817 1.422 ( -10.280 1.148 -1.002) 10.392 1.607 ( -5.121 0.995 -0.856) 5.286 1.847 ( 0.776 -2.586 -0.297) 2.716 1.960 ( 0.128 0.565 -0.469) 0.745 2.035 ( 3.229 1.443 -4.076) 5.396 2.484 ( -20.884 6.760 -2.027) 22.044 2.928 ( -9.785 -6.593 1.194) 11.859 2.965 ( -13.533 2.774 0.890) 13.843 3.155 ( -10.029 2.571 1.071) 10.409 4.736 ( -4.937 -6.233 0.337) 7.958 4.752 ( -6.648 -6.084 1.139) 9.084 6.076 ( -14.411 4.161 4.562) 15.678 6.472 ( -8.693 -7.195 3.434) 11.795 6.805 ( 1.551 2.555 0.229) 2.997 6.892 ( 1.896 -0.702 0.069) 2.023 7.227 ( -12.146 3.933 -2.431) 12.996 7.802 ( -2.277 -10.333 0.851) 10.615 7.857 ( 0.936 -4.094 -0.251) 4.207 7.985 ( 1.619 -2.748 -1.187) 3.404 8.492 ( 0.421 17.337 4.086) 17.817 8.666 ( -0.443 7.458 -3.079) 8.080 9.227 ( -2.423 -5.873 0.551) 6.377 9.312 ( 2.660 -5.547 0.643) 6.185 ======================= Grid point 285 (160/309) ======================= q-point: (-0.24 0.20 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 510 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.065 ( -17.703 4.920 3.442) 18.694 1.223 ( -14.329 6.709 0.131) 15.823 1.556 ( -2.863 -5.357 1.216) 6.194 1.794 ( -5.846 -6.668 -0.660) 8.893 1.992 ( 2.091 1.374 -2.319) 3.412 2.003 ( -0.329 2.927 -2.041) 3.583 2.144 ( -22.672 10.776 3.521) 25.348 2.713 ( -17.987 2.794 -1.441) 18.259 2.796 ( -10.269 -6.897 0.137) 12.371 3.013 ( -9.949 -1.216 1.286) 10.105 4.651 ( -7.686 -5.199 0.164) 9.281 4.662 ( -5.077 -5.758 0.185) 7.679 5.916 ( -11.488 4.891 0.916) 12.520 6.377 ( -6.700 -8.685 -0.362) 10.975 6.827 ( 1.867 2.635 -0.536) 3.273 6.907 ( -2.110 -1.464 0.015) 2.568 7.028 ( -10.402 5.520 1.153) 11.832 7.737 ( -7.157 -18.452 0.077) 19.792 7.868 ( 0.515 0.194 0.104) 0.560 7.977 ( -1.026 -1.809 -0.807) 2.231 8.562 ( 3.470 16.935 -6.761) 18.562 8.620 ( -0.540 8.270 5.784) 10.107 9.186 ( -3.470 -6.713 0.002) 7.557 9.351 ( 2.847 -5.737 -0.818) 6.456 ======================= Grid point 286 (161/309) ======================= q-point: (-0.18 0.20 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 510 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.878 ( -16.300 8.600 5.443) 19.216 1.047 ( -13.465 10.417 6.455) 18.207 1.522 ( -5.881 -7.509 1.548) 9.663 1.658 ( -12.510 0.290 1.401) 12.591 1.858 ( -14.220 4.898 5.739) 16.098 1.924 ( -2.844 1.928 -3.765) 5.097 2.091 ( -2.492 3.140 4.938) 6.360 2.410 ( -17.907 2.846 -2.213) 18.266 2.643 ( -8.876 -5.192 0.202) 10.285 2.935 ( -5.105 -6.558 3.964) 9.207 4.544 ( -6.763 -3.977 0.924) 7.900 4.606 ( -3.513 -5.748 1.458) 6.892 5.787 ( -5.919 5.560 0.944) 8.175 6.277 ( -4.115 -9.035 -1.580) 10.053 6.780 ( -15.503 1.484 6.583) 16.908 6.853 ( 0.398 1.912 0.725) 2.084 7.008 ( 3.826 1.965 -1.602) 4.590 7.594 ( -11.032 -21.340 -1.249) 24.056 7.869 ( -1.169 0.700 0.395) 1.419 7.928 ( -3.815 -1.003 -1.137) 4.105 8.429 ( -1.946 16.146 -10.248) 19.223 8.775 ( 6.330 8.849 6.005) 12.427 9.129 ( -3.978 -7.817 -0.046) 8.771 9.377 ( 3.035 -5.284 -1.886) 6.379 ======================= Grid point 287 (162/309) ======================= q-point: (-0.12 0.20 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 510 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.722 ( -14.551 7.705 7.054) 17.913 0.991 ( -12.388 9.486 11.160) 19.184 1.413 ( -11.785 -0.552 5.899) 13.190 1.545 ( -7.229 -3.519 2.346) 8.376 1.744 ( -16.339 3.918 8.115) 18.659 1.856 ( 1.572 4.048 -3.827) 5.788 2.028 ( -11.069 2.687 -0.312) 11.395 2.181 ( -9.900 3.234 0.602) 10.433 2.600 ( -0.503 -5.571 4.073) 6.919 2.943 ( -2.005 -8.519 3.782) 9.534 4.503 ( -2.869 -3.207 4.405) 6.158 4.608 ( -0.911 -5.768 3.919) 7.033 5.832 ( 5.241 4.168 8.681) 10.964 6.243 ( -0.476 -7.497 2.798) 8.017 6.667 ( -15.692 0.363 11.203) 19.284 6.861 ( -2.046 -0.942 1.606) 2.766 7.038 ( 4.432 1.473 -3.664) 5.936 7.374 ( -14.684 -17.265 -2.225) 22.774 7.830 ( -4.479 -0.094 -0.949) 4.580 7.841 ( -4.012 -0.282 -1.732) 4.379 8.278 ( -1.943 19.888 -5.780) 20.801 8.924 ( 6.242 4.367 0.616) 7.643 9.077 ( -2.995 -7.581 0.681) 8.180 9.389 ( 2.878 -4.337 -2.824) 5.922 ======================= Grid point 288 (163/309) ======================= q-point: (-0.06 0.20 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 510 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.720 ( -3.040 0.164 14.842) 15.151 0.969 ( -13.169 2.516 14.713) 19.905 1.354 ( -7.295 -4.949 2.716) 9.224 1.421 ( -12.597 -10.210 3.976) 16.696 1.691 ( -3.704 17.384 7.858) 19.434 1.828 ( -3.054 5.370 -2.134) 6.536 1.884 ( -1.808 2.157 0.239) 2.825 2.092 ( -4.978 6.879 2.125) 8.753 2.687 ( 2.109 -7.671 4.694) 9.237 2.969 ( -0.879 -6.332 3.588) 7.331 4.572 ( 0.263 -3.241 7.487) 8.163 4.675 ( 0.606 -5.368 5.526) 7.728 6.174 ( 16.365 -0.482 14.460) 21.843 6.358 ( 5.214 -4.751 8.860) 11.325 6.614 ( -13.350 -1.134 12.629) 18.412 6.816 ( -11.139 -7.088 5.789) 14.417 7.032 ( 2.486 1.931 -4.897) 5.822 7.146 ( -9.067 -3.529 -3.061) 10.200 7.732 ( -4.133 0.307 -2.283) 4.731 7.768 ( -2.342 -0.502 -2.280) 3.307 8.231 ( 0.132 17.459 0.133) 17.460 8.955 ( 1.447 -1.280 -3.614) 4.099 9.074 ( 0.311 -2.998 1.282) 3.275 9.383 ( 1.998 -3.519 -3.566) 5.394 ======================= Grid point 289 (164/309) ======================= q-point: ( 0.00 0.40 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 510 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.967 ( -2.778 4.833 17.298) 18.174 1.088 ( -0.729 4.832 9.703) 10.864 1.151 ( -2.405 -12.889 9.200) 16.017 1.187 ( -0.862 -5.445 6.436) 8.474 1.819 ( 2.865 3.325 -1.767) 4.731 1.879 ( 3.488 -2.935 -1.413) 4.772 2.106 ( 0.044 15.396 -0.755) 15.414 2.314 ( 1.192 -2.456 1.627) 3.178 2.678 ( -0.118 7.819 10.044) 12.729 2.906 ( 0.275 -10.877 9.766) 14.621 4.626 ( -0.177 -1.356 6.651) 6.790 4.655 ( 0.074 -4.433 5.559) 7.110 6.509 ( -1.265 0.779 10.802) 10.904 6.581 ( -1.878 -6.530 10.565) 12.562 6.609 ( -0.541 1.843 15.367) 15.487 6.644 ( -0.282 -1.869 15.437) 15.552 7.024 ( 0.172 1.661 -4.972) 5.245 7.044 ( 0.226 -0.429 -5.103) 5.126 7.673 ( -0.052 1.107 -3.462) 3.635 7.696 ( 0.352 -1.314 -3.230) 3.505 8.535 ( 0.426 14.459 -0.127) 14.465 8.778 ( -0.153 -10.870 -1.751) 11.011 9.138 ( 0.641 5.594 -1.667) 5.872 9.258 ( 0.542 -6.311 -3.412) 7.195 ======================= Grid point 290 (165/309) ======================= q-point: ( 0.06 0.40 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 510 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.099 ( -4.465 2.629 13.548) 14.505 1.193 ( -2.311 -6.171 8.522) 10.772 1.398 ( 13.514 0.801 11.352) 17.667 1.452 ( 12.719 -5.428 12.324) 18.524 1.855 ( 5.907 3.737 -3.829) 7.970 1.912 ( 4.500 -1.750 -3.689) 6.076 2.113 ( 3.198 12.638 -0.845) 13.063 2.337 ( 2.177 -9.051 -1.384) 9.411 2.820 ( -0.003 12.185 10.078) 15.813 3.024 ( -0.299 -7.158 7.117) 10.098 4.693 ( -1.863 -2.080 5.345) 6.031 4.714 ( -1.632 -4.426 4.653) 6.626 6.515 ( -12.548 -0.153 11.440) 16.981 6.535 ( -13.449 -1.911 10.999) 17.478 6.892 ( 0.312 0.673 1.742) 1.894 6.903 ( 0.533 -0.452 2.737) 2.825 7.000 ( 7.975 1.841 5.736) 9.995 7.048 ( 10.497 -3.373 4.787) 12.021 7.643 ( 3.675 1.704 -5.014) 6.446 7.676 ( 3.868 -1.714 -4.502) 6.178 8.549 ( 0.749 12.572 0.678) 12.612 8.748 ( 0.027 -7.695 -2.537) 8.102 9.115 ( -1.233 2.795 -1.004) 3.216 9.203 ( -1.573 -5.428 -3.562) 6.680 ======================= Grid point 291 (166/309) ======================= q-point: ( 0.12 0.40 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 510 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.234 ( 0.430 1.768 10.503) 10.660 1.301 ( 1.920 -4.762 7.334) 8.953 1.693 ( 8.924 4.433 1.862) 10.137 1.774 ( 8.685 -4.054 4.647) 10.652 1.883 ( 5.724 2.745 -0.672) 6.384 1.924 ( 6.205 -0.723 -2.113) 6.595 2.192 ( 8.124 6.860 -0.229) 10.635 2.363 ( 5.119 -9.732 -2.078) 11.191 2.937 ( -0.619 11.309 7.294) 13.472 3.083 ( -1.756 -3.166 3.714) 5.187 4.716 ( -3.280 -2.794 3.687) 5.671 4.730 ( -3.254 -4.358 2.908) 6.168 6.469 ( -13.867 0.129 10.745) 17.543 6.484 ( -11.535 -1.649 8.509) 14.429 6.799 ( -5.625 1.238 -4.023) 7.025 6.819 ( -4.885 -0.910 -3.971) 6.360 7.293 ( 10.355 1.136 9.845) 14.333 7.327 ( 10.644 -2.498 7.973) 13.531 7.643 ( 6.450 2.311 -6.126) 9.191 7.685 ( 6.372 -1.969 -5.582) 8.698 8.575 ( 0.947 10.170 1.330) 10.300 8.711 ( 0.239 -3.276 -2.920) 4.395 9.073 ( -3.119 -0.842 -0.548) 3.277 9.116 ( -3.508 -4.421 -3.440) 6.610 ======================= Grid point 292 (167/309) ======================= q-point: ( 0.18 0.40 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 510 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.387 ( 3.504 1.672 7.029) 8.030 1.438 ( 3.857 -3.419 5.998) 7.909 1.690 ( 2.228 3.971 -6.982) 8.335 1.762 ( 0.627 -3.582 -8.384) 9.138 2.050 ( 8.002 3.332 4.590) 9.808 2.087 ( 8.240 0.692 2.685) 8.694 2.334 ( 8.958 1.945 1.439) 9.279 2.433 ( 7.498 -7.067 -2.093) 10.514 2.992 ( -2.057 8.133 3.715) 9.175 3.075 ( -3.058 0.013 0.575) 3.111 4.697 ( -4.237 -3.658 1.428) 5.777 4.699 ( -4.462 -3.849 1.331) 6.041 6.397 ( -13.157 0.221 8.144) 15.475 6.414 ( -11.382 -1.790 5.871) 12.931 6.635 ( -7.904 1.752 -4.638) 9.330 6.669 ( -7.313 -1.825 -4.527) 8.793 7.552 ( 8.420 0.472 7.503) 11.288 7.565 ( 7.860 -0.854 6.819) 10.440 7.668 ( 8.012 2.580 -5.850) 10.250 7.712 ( 7.741 -1.952 -5.820) 9.879 8.612 ( 0.954 8.017 1.853) 8.283 8.680 ( 0.723 1.465 -2.599) 3.071 9.004 ( -4.774 -3.792 -1.430) 6.262 9.015 ( -4.408 -4.399 -1.740) 6.466 ======================= Grid point 293 (168/309) ======================= q-point: ( 0.24 0.40 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 510 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.519 ( 5.428 1.666 2.541) 6.221 1.562 ( 4.042 -2.907 1.724) 5.269 1.653 ( 2.407 0.892 -2.423) 3.530 1.680 ( 1.726 -2.040 -3.418) 4.338 2.191 ( 5.068 3.229 1.782) 6.268 2.203 ( 5.580 2.395 -0.495) 6.093 2.474 ( 6.113 -0.209 2.049) 6.450 2.507 ( 5.852 -3.246 -2.105) 7.015 2.984 ( -2.959 4.526 1.261) 5.552 3.018 ( -3.417 1.242 -1.475) 3.923 4.630 ( -4.619 -3.314 -0.657) 5.723 4.641 ( -4.899 -4.277 0.256) 6.509 6.273 ( -10.377 0.451 -2.555) 10.697 6.296 ( -11.449 -1.917 2.202) 11.815 6.475 ( -8.906 1.021 1.429) 9.078 6.501 ( -9.112 -1.583 -0.524) 9.264 7.699 ( 8.585 2.451 -5.182) 10.323 7.740 ( 7.711 -1.655 -2.172) 8.180 7.763 ( 5.997 0.611 3.972) 7.219 7.772 ( 6.084 -0.178 4.458) 7.544 8.644 ( 0.602 7.397 0.140) 7.422 8.664 ( 0.286 6.479 -0.267) 6.491 8.912 ( -3.854 -5.548 -1.421) 6.903 8.939 ( -4.734 -7.075 0.324) 8.519 ======================= Grid point 294 (169/309) ======================= q-point: ( 0.29 0.40 -0.75) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 510 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.592 ( 4.993 1.521 -3.260) 6.154 1.625 ( 6.119 -1.437 0.046) 6.286 1.705 ( 2.123 0.232 2.001) 2.927 1.724 ( 1.470 -1.835 4.609) 5.174 2.243 ( 2.311 2.374 -2.369) 4.073 2.245 ( 1.557 2.104 -1.531) 3.032 2.541 ( 2.728 1.917 -0.500) 3.371 2.581 ( 2.705 -1.592 3.303) 4.556 2.951 ( -2.093 2.008 -1.205) 3.140 2.969 ( -1.045 0.229 1.784) 2.080 4.555 ( -3.649 -3.027 -0.768) 4.803 4.571 ( -4.114 -4.623 -0.133) 6.190 6.057 ( -7.046 3.140 -7.499) 10.758 6.131 ( -8.003 -4.807 -3.532) 9.981 6.408 ( -9.012 0.279 6.981) 11.403 6.416 ( -8.422 -0.705 7.209) 11.109 7.746 ( 7.597 2.325 -5.488) 9.656 7.785 ( 7.230 -1.708 -5.588) 9.296 7.903 ( 3.065 1.449 5.185) 6.195 7.922 ( 4.267 -0.401 4.616) 6.299 8.624 ( -0.707 11.211 -1.689) 11.360 8.682 ( -0.874 8.785 2.389) 9.145 8.861 ( -1.762 -9.336 0.103) 9.501 8.894 ( -2.824 -9.082 1.764) 9.673 ======================= Grid point 295 (170/309) ======================= q-point: ( 0.35 0.40 -0.75) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 510 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.641 ( 4.126 2.834 -0.571) 5.038 1.684 ( 2.627 -1.313 -0.640) 3.005 1.772 ( 2.231 -0.306 1.904) 2.948 1.781 ( -0.495 -1.503 2.029) 2.573 2.197 ( -1.168 2.855 -4.510) 5.463 2.211 ( -0.704 1.178 -3.641) 3.892 2.592 ( 1.119 3.927 3.885) 5.636 2.665 ( 0.802 -2.467 5.743) 6.302 2.948 ( 1.267 3.149 1.896) 3.888 3.009 ( 1.072 -2.680 4.075) 4.994 4.515 ( -1.604 -3.237 0.995) 3.747 4.529 ( -2.173 -4.651 1.263) 5.287 5.914 ( -0.579 4.516 -3.608) 5.809 6.014 ( -2.379 -6.079 -0.996) 6.603 6.393 ( -8.321 1.349 9.610) 12.784 6.419 ( -6.746 -1.514 9.362) 11.638 7.774 ( 5.969 1.953 -5.263) 8.194 7.807 ( 5.636 -1.494 -5.303) 7.881 7.982 ( 0.123 1.948 2.608) 3.257 8.012 ( 1.579 -1.217 1.604) 2.559 8.603 ( -0.659 14.226 0.891) 14.269 8.699 ( -1.230 10.084 2.481) 10.457 8.859 ( -0.663 -11.883 2.199) 12.103 8.898 ( -0.629 -9.998 2.078) 10.231 ======================= Grid point 296 (171/309) ======================= q-point: ( 0.41 0.40 -0.75) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 510 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.671 ( 0.632 2.181 -0.259) 2.285 1.708 ( 0.933 -1.337 0.422) 1.685 1.763 ( -2.383 0.098 -0.869) 2.538 1.791 ( -0.385 -2.167 -1.585) 2.713 2.125 ( -0.038 3.789 -3.849) 5.401 2.153 ( 0.217 1.301 -3.358) 3.607 2.671 ( 0.204 5.179 6.012) 7.938 2.771 ( 0.307 -3.675 8.443) 9.214 3.030 ( 2.697 3.780 4.961) 6.795 3.111 ( 2.333 -3.417 6.877) 8.025 4.532 ( -0.268 -3.706 3.197) 4.901 4.542 ( -0.474 -4.602 3.376) 5.727 5.957 ( 5.802 4.187 3.670) 8.041 6.050 ( 3.178 -5.682 5.135) 8.292 6.417 ( -6.965 2.582 10.481) 12.847 6.463 ( -5.397 -2.228 10.132) 11.694 7.781 ( 4.437 1.631 -5.085) 6.942 7.809 ( 3.928 -1.394 -4.851) 6.396 7.981 ( -2.115 1.747 -0.285) 2.758 8.009 ( -1.461 -1.261 -1.837) 2.664 8.639 ( 1.062 14.652 3.698) 15.149 8.713 ( -1.325 10.765 2.431) 11.115 8.897 ( -0.167 -11.968 3.926) 12.597 8.922 ( -0.048 -10.640 2.064) 10.838 ======================= Grid point 297 (172/309) ======================= q-point: ( 0.47 0.40 -0.75) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 510 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.675 ( -0.187 1.236 0.778) 1.473 1.701 ( -0.767 -0.859 -2.578) 2.823 1.726 ( -0.644 -0.702 0.928) 1.330 1.744 ( -1.471 -1.984 -1.774) 3.041 2.091 ( 0.894 4.455 -2.786) 5.330 2.129 ( 1.167 1.155 -2.303) 2.828 2.764 ( 0.762 6.231 6.550) 9.072 2.893 ( 0.100 -5.889 8.456) 10.305 3.140 ( 0.870 6.234 6.591) 9.113 3.247 ( 1.216 -3.809 8.245) 9.163 4.585 ( 0.058 -3.896 4.350) 5.840 4.596 ( -0.004 -4.885 4.581) 6.697 6.149 ( 5.979 2.768 9.501) 11.562 6.219 ( 3.877 -4.432 10.160) 11.743 6.471 ( -4.363 3.702 10.063) 11.577 6.533 ( -3.250 -2.626 9.709) 10.570 7.770 ( 3.063 1.260 -4.513) 5.597 7.792 ( 1.957 -1.025 -4.107) 4.664 7.922 ( -2.187 0.938 -3.064) 3.880 7.940 ( -2.411 -0.957 -3.111) 4.051 8.717 ( 1.457 13.350 3.458) 13.867 8.726 ( -1.145 11.071 2.859) 11.491 8.942 ( -0.654 -10.294 3.253) 10.816 8.965 ( 0.519 -11.293 4.054) 12.010 ======================= Grid point 298 (173/309) ======================= q-point: (-0.47 0.40 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 510 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.645 ( -2.553 2.042 -0.615) 3.327 1.696 ( -0.316 -2.860 -1.243) 3.135 1.722 ( 1.015 1.304 0.815) 1.843 1.755 ( 2.974 -2.067 1.485) 3.915 2.059 ( -0.618 4.799 -2.469) 5.432 2.109 ( -0.186 0.190 -2.122) 2.139 2.860 ( -0.019 5.561 6.057) 8.222 2.988 ( -1.248 -7.170 6.174) 9.544 3.222 ( -2.421 8.805 6.838) 11.408 3.347 ( -2.272 -3.673 6.976) 8.205 4.643 ( -0.451 -3.936 4.204) 5.776 4.657 ( -0.494 -5.130 4.436) 6.800 6.323 ( -4.428 2.627 12.331) 13.362 6.389 ( -2.688 -4.178 11.859) 12.857 6.575 ( 2.236 3.820 7.744) 8.920 6.638 ( 1.496 -2.504 7.620) 8.159 7.740 ( -2.438 1.230 -2.640) 3.798 7.754 ( 1.013 -0.223 -3.372) 3.528 7.855 ( 0.841 -0.044 -4.617) 4.693 7.874 ( 0.609 -1.912 -3.681) 4.193 8.729 ( -1.665 12.118 1.970) 12.390 8.789 ( 1.197 9.796 2.547) 10.192 8.984 ( 0.014 -8.905 3.993) 9.760 9.032 ( 0.375 -9.732 4.441) 10.704 ======================= Grid point 299 (174/309) ======================= q-point: (-0.41 0.40 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 510 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.590 ( -4.142 2.157 -0.588) 4.707 1.639 ( -3.758 -2.765 -2.152) 5.138 1.780 ( 3.491 3.586 1.673) 5.277 1.838 ( 3.975 -2.488 1.243) 4.851 2.002 ( -2.116 4.439 -2.458) 5.498 2.060 ( -2.251 -1.125 -2.241) 3.369 2.906 ( -3.793 4.021 4.054) 6.855 3.008 ( -4.651 -6.446 2.846) 8.443 3.249 ( -5.855 8.946 6.076) 12.298 3.364 ( -6.168 -2.651 4.772) 8.237 4.678 ( -1.692 -3.836 3.103) 5.216 4.694 ( -1.837 -5.215 3.301) 6.440 6.357 ( -11.633 4.333 11.180) 16.706 6.449 ( -9.298 -5.326 10.575) 15.055 6.717 ( 3.881 2.738 4.805) 6.756 6.762 ( 2.843 -1.879 4.690) 5.797 7.638 ( -5.360 3.507 -2.974) 7.062 7.713 ( -2.699 -4.219 -1.203) 5.151 7.829 ( 3.856 1.103 -4.050) 5.700 7.868 ( 4.397 -2.903 -3.224) 6.177 8.730 ( -1.662 12.706 2.066) 12.980 8.823 ( 0.336 6.269 0.977) 6.353 9.049 ( 0.763 -6.881 4.191) 8.093 9.092 ( 0.237 -8.041 3.475) 8.763 ======================= Grid point 300 (175/309) ======================= q-point: (-0.35 0.40 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 510 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.500 ( -6.836 1.219 -0.912) 7.003 1.527 ( -7.330 -1.568 -1.666) 7.679 1.821 ( -4.740 3.675 -2.115) 6.360 1.839 ( 0.401 1.152 -1.048) 1.608 1.974 ( 1.382 0.860 -1.371) 2.129 2.011 ( 0.585 -2.062 -0.317) 2.166 2.838 ( -10.043 4.458 0.628) 11.006 2.932 ( -8.336 -5.504 0.744) 10.017 3.205 ( -9.913 6.996 4.064) 12.795 3.297 ( -9.661 -1.892 2.827) 10.242 4.674 ( -3.251 -3.696 1.690) 5.204 4.689 ( -3.641 -4.984 1.927) 6.466 6.298 ( -13.623 5.691 8.082) 16.832 6.415 ( -11.437 -6.685 7.566) 15.255 6.807 ( 2.170 2.055 1.935) 3.560 6.839 ( 1.723 -1.344 1.829) 2.850 7.504 ( -7.375 5.816 -2.811) 9.804 7.642 ( -5.001 -8.806 -0.740) 10.154 7.850 ( 4.306 2.164 -2.336) 5.356 7.900 ( 4.151 -3.167 -1.864) 5.544 8.741 ( -1.026 12.998 2.606) 13.296 8.833 ( 0.195 5.288 -0.025) 5.291 9.104 ( -0.561 -6.322 2.817) 6.944 9.134 ( 1.004 -7.186 1.655) 7.442 ======================= Grid point 301 (176/309) ======================= q-point: (-0.29 0.40 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 510 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.348 ( -11.918 3.122 0.154) 12.321 1.405 ( -7.643 -2.646 0.176) 8.090 1.668 ( -9.556 5.166 -2.351) 11.115 1.770 ( -5.126 -5.205 -2.946) 7.877 1.998 ( 2.391 2.740 0.200) 3.642 2.038 ( 2.818 -1.210 -1.683) 3.498 2.639 ( -15.134 8.817 -0.934) 17.540 2.792 ( -10.826 -7.626 0.202) 13.244 3.055 ( -14.881 6.138 1.047) 16.131 3.153 ( -13.241 -3.163 1.073) 13.656 4.629 ( -4.539 -3.487 0.519) 5.747 4.640 ( -5.294 -4.371 0.866) 6.919 6.181 ( -12.894 6.828 4.118) 15.160 6.323 ( -10.913 -8.172 3.666) 14.118 6.847 ( 1.666 1.828 0.140) 2.477 6.874 ( 1.627 -1.180 0.016) 2.010 7.341 ( -10.409 8.409 -1.492) 13.464 7.542 ( -7.771 -12.930 -0.201) 15.087 7.881 ( 2.688 2.400 -0.970) 3.732 7.931 ( 2.292 -2.873 -0.915) 3.787 8.771 ( -0.761 11.473 3.411) 11.993 8.830 ( 1.270 7.345 -1.699) 7.645 9.102 ( -2.571 -5.036 0.701) 5.698 9.169 ( 1.940 -8.858 0.146) 9.070 ======================= Grid point 302 (177/309) ======================= q-point: (-0.24 0.40 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 510 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.186 ( -12.434 7.466 3.805) 14.994 1.303 ( -8.101 -2.242 1.927) 8.624 1.502 ( -10.401 3.674 0.774) 11.058 1.645 ( -7.795 -8.846 -0.508) 11.801 2.020 ( 0.888 1.436 -1.940) 2.572 2.034 ( 0.283 0.258 -2.201) 2.234 2.402 ( -15.564 14.544 1.630) 21.364 2.635 ( -10.468 -10.258 0.727) 14.674 2.801 ( -18.539 6.674 -0.898) 19.724 2.939 ( -15.888 -6.705 0.349) 17.249 4.559 ( -5.587 -3.202 0.147) 6.441 4.563 ( -5.414 -3.503 0.410) 6.461 6.038 ( -10.008 7.827 0.521) 12.716 6.201 ( -8.435 -9.433 0.043) 12.654 6.866 ( 1.316 1.493 -0.569) 2.070 6.887 ( -0.216 -0.882 -0.330) 0.966 7.168 ( -11.429 9.891 1.234) 15.165 7.406 ( -10.844 -15.585 0.931) 19.009 7.898 ( 0.500 2.042 -0.205) 2.113 7.938 ( -0.203 -2.188 -0.539) 2.263 8.766 ( -2.545 9.656 -1.112) 10.047 8.858 ( 3.764 7.386 0.243) 8.293 9.058 ( -3.168 -2.468 -0.315) 4.028 9.198 ( 2.642 -10.290 -0.716) 10.648 ======================= Grid point 303 (178/309) ======================= q-point: (-0.18 0.40 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 510 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.071 ( -11.279 11.088 3.537) 16.207 1.220 ( -8.256 1.640 4.277) 9.442 1.387 ( -9.862 -0.342 3.376) 10.430 1.540 ( -10.300 -9.915 4.794) 15.079 1.962 ( -3.407 2.017 -2.453) 4.658 1.975 ( -4.304 1.740 -1.624) 4.918 2.267 ( -8.378 15.091 4.115) 17.744 2.475 ( -13.794 -1.992 -1.865) 14.061 2.542 ( -11.875 1.398 2.084) 12.137 2.745 ( -12.242 -13.214 4.558) 18.581 4.481 ( -5.160 -1.692 1.131) 5.547 4.503 ( -3.825 -4.009 1.221) 5.674 5.922 ( -5.064 8.465 0.333) 9.870 6.094 ( -4.527 -9.802 -0.431) 10.806 6.825 ( -10.908 2.877 3.835) 11.915 6.864 ( -3.137 -0.842 1.221) 3.470 7.077 ( -2.119 5.971 0.467) 6.354 7.259 ( -10.508 -13.936 1.645) 17.531 7.886 ( -1.922 1.025 -0.298) 2.198 7.906 ( -2.840 -1.184 -0.860) 3.195 8.688 ( -2.616 12.460 -4.053) 13.361 8.894 ( 0.159 -6.503 -1.198) 6.615 9.036 ( 1.205 7.495 0.915) 7.646 9.232 ( 3.448 -9.944 -1.054) 10.577 ======================= Grid point 304 (179/309) ======================= q-point: (-0.12 0.40 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 510 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.936 ( -11.460 13.640 2.483) 17.987 1.154 ( -8.904 -0.764 4.015) 9.797 1.261 ( -13.041 -1.116 3.084) 13.447 1.430 ( -15.057 -9.846 5.355) 18.771 1.882 ( -4.719 4.352 0.993) 6.496 1.917 ( -2.236 0.668 -0.570) 2.402 2.187 ( -7.237 13.194 0.784) 15.069 2.276 ( -9.283 5.437 2.105) 10.962 2.496 ( -2.093 -1.467 4.845) 5.478 2.707 ( -5.744 -16.174 7.923) 18.904 4.460 ( -1.968 -0.590 4.096) 4.583 4.499 ( -0.953 -4.695 3.806) 6.119 5.942 ( 2.913 7.198 6.419) 10.075 6.089 ( 1.180 -8.343 4.500) 9.552 6.706 ( -16.387 3.790 9.820) 19.477 6.797 ( -12.418 -5.226 6.212) 14.836 7.078 ( 2.964 2.756 -2.668) 4.848 7.157 ( -3.748 -6.699 -0.923) 7.732 7.830 ( -4.268 0.104 -1.275) 4.455 7.834 ( -4.001 -0.362 -1.572) 4.314 8.598 ( -1.826 14.917 -3.613) 15.456 8.850 ( -1.922 -11.913 -1.767) 12.195 9.094 ( 4.029 8.852 0.099) 9.726 9.266 ( 3.479 -8.527 -1.814) 9.386 ======================= Grid point 305 (180/309) ======================= q-point: (-0.06 0.40 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 510 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.844 ( -7.427 12.355 7.623) 16.307 1.078 ( -10.430 3.697 7.361) 13.291 1.130 ( -8.418 -10.558 3.301) 13.901 1.258 ( -15.206 -8.761 5.339) 18.343 1.835 ( -2.265 2.694 -0.714) 3.591 1.874 ( -1.308 -1.507 -0.613) 2.087 2.123 ( -2.245 15.969 0.278) 16.129 2.260 ( -1.135 5.571 4.888) 7.498 2.565 ( -0.081 0.212 6.707) 6.711 2.774 ( -1.726 -14.198 9.962) 17.430 4.528 ( 0.447 -0.577 6.624) 6.664 4.568 ( 0.910 -4.761 5.547) 7.367 6.191 ( 11.426 2.620 12.887) 17.421 6.265 ( 8.089 -4.829 10.670) 14.234 6.620 ( -15.621 1.874 12.679) 20.205 6.688 ( -17.130 -5.551 11.032) 21.117 7.071 ( 2.472 1.925 -4.617) 5.580 7.103 ( 0.281 -1.650 -4.030) 4.364 7.740 ( -3.574 0.618 -2.299) 4.295 7.755 ( -2.923 -0.838 -2.276) 3.798 8.545 ( -0.431 15.500 -1.598) 15.588 8.806 ( -0.938 -12.215 -1.465) 12.338 9.136 ( 2.685 7.188 -1.439) 7.807 9.279 ( 2.385 -7.220 -2.818) 8.109 ======================= Grid point 340 (181/309) ======================= q-point: ( 0.00 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 309 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.233 ( 3.160 0.000 11.321) 11.754 1.398 ( -3.202 0.000 5.782) 6.610 1.424 ( -0.851 0.000 6.698) 6.752 1.572 ( 2.513 0.000 0.382) 2.542 1.687 ( 0.494 0.000 -3.063) 3.103 1.896 ( -0.155 0.000 18.367) 18.368 1.898 ( 2.853 0.000 -3.308) 4.368 2.031 ( 0.708 0.000 8.180) 8.211 2.953 ( -0.167 0.000 1.816) 1.824 2.974 ( -0.147 0.000 -1.886) 1.892 4.856 ( 0.274 0.000 6.129) 6.135 4.935 ( -0.066 0.000 4.962) 4.962 6.715 ( -1.018 0.000 5.010) 5.112 6.864 ( 1.122 0.000 14.654) 14.697 6.874 ( 0.324 0.000 -1.322) 1.361 6.912 ( -0.962 0.000 -1.690) 1.945 6.956 ( 0.145 0.000 -0.664) 0.679 6.978 ( 0.278 0.000 14.358) 14.360 7.573 ( -2.579 0.000 -4.578) 5.254 7.659 ( 0.311 0.000 -4.172) 4.184 8.230 ( 0.460 0.000 6.682) 6.698 8.788 ( -0.288 0.000 -6.570) 6.577 9.163 ( 0.934 0.000 1.324) 1.621 9.310 ( -0.220 0.000 -3.168) 3.176 ======================= Grid point 341 (182/309) ======================= q-point: ( 0.06 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 309 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.398 ( 0.004 0.000 9.784) 9.784 1.437 ( -3.284 0.000 -0.016) 3.284 1.470 ( 0.932 0.000 5.224) 5.306 1.674 ( 8.808 0.000 2.357) 9.118 1.696 ( 6.305 0.000 -3.457) 7.191 1.866 ( 1.339 0.000 -3.423) 3.675 2.184 ( 8.729 0.000 11.867) 14.732 2.213 ( 7.115 0.000 6.467) 9.615 2.934 ( -2.856 0.000 -0.707) 2.942 2.938 ( -1.257 0.000 -1.713) 2.124 4.919 ( -1.947 0.000 4.916) 5.287 4.972 ( -2.146 0.000 2.543) 3.328 6.709 ( -6.741 0.000 4.572) 8.145 6.777 ( -14.624 0.000 7.202) 16.301 6.827 ( -4.683 0.000 -1.624) 4.957 6.863 ( -2.753 0.000 -1.636) 3.202 7.205 ( 8.971 0.000 11.003) 14.197 7.259 ( 11.794 0.000 7.312) 13.877 7.489 ( 1.753 0.000 -6.490) 6.723 7.619 ( 3.298 0.000 -5.469) 6.387 8.329 ( 0.357 0.000 6.902) 6.911 8.684 ( -1.041 0.000 -6.892) 6.971 9.190 ( -0.134 0.000 1.407) 1.413 9.248 ( -2.257 0.000 -3.163) 3.886 ======================= Grid point 342 (183/309) ======================= q-point: ( 0.12 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 309 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.377 ( -0.351 0.000 -2.676) 2.699 1.518 ( 1.332 0.000 6.218) 6.359 1.554 ( 1.746 0.000 4.870) 5.173 1.716 ( 4.084 0.000 -7.546) 8.580 1.860 ( 10.208 0.000 2.538) 10.519 1.879 ( 6.540 0.000 -2.075) 6.861 2.387 ( 6.266 0.000 3.982) 7.424 2.422 ( 8.651 0.000 2.380) 8.973 2.873 ( -2.744 0.000 -1.127) 2.967 2.898 ( -1.751 0.000 -0.323) 1.781 4.931 ( -3.767 0.000 3.131) 4.898 4.940 ( -4.097 0.000 -0.152) 4.100 6.656 ( -9.019 0.000 4.938) 10.282 6.677 ( -10.297 0.000 -4.304) 11.160 6.678 ( -11.522 0.000 7.012) 13.488 6.772 ( -5.285 0.000 -3.268) 6.214 7.456 ( 5.862 0.000 -6.386) 8.669 7.472 ( 8.309 0.000 8.958) 12.218 7.502 ( 8.981 0.000 5.800) 10.690 7.611 ( 6.115 0.000 -5.922) 8.512 8.425 ( -0.212 0.000 6.823) 6.826 8.575 ( -1.108 0.000 -6.671) 6.762 9.164 ( -3.245 0.000 -2.646) 4.187 9.190 ( -2.083 0.000 0.958) 2.293 ======================= Grid point 343 (184/309) ======================= q-point: ( 0.18 0.00 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 309 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.393 ( 5.737 0.000 -0.507) 5.759 1.589 ( 3.216 0.000 -0.431) 3.245 1.621 ( 1.716 0.000 -10.872) 11.007 1.673 ( 2.053 0.000 7.685) 7.954 1.983 ( 9.131 0.000 -0.970) 9.183 2.026 ( 8.169 0.000 1.401) 8.288 2.496 ( 3.658 0.000 -3.725) 5.221 2.502 ( 2.714 0.000 2.928) 3.992 2.849 ( 1.213 0.000 -0.097) 1.217 2.884 ( -0.183 0.000 -0.318) 0.367 4.853 ( -5.031 0.000 -2.243) 5.509 4.894 ( -4.914 0.000 1.063) 5.027 6.407 ( -13.254 0.000 -8.857) 15.941 6.590 ( -10.482 0.000 7.494) 12.885 6.616 ( -7.704 0.000 -5.079) 9.227 6.617 ( -8.568 0.000 5.574) 10.222 7.486 ( 7.849 0.000 -4.677) 9.136 7.639 ( 7.697 0.000 -5.261) 9.323 7.681 ( 7.064 0.000 4.780) 8.529 7.703 ( 6.343 0.000 7.073) 9.501 8.471 ( -1.051 0.000 -6.238) 6.326 8.501 ( -1.598 0.000 6.035) 6.243 9.095 ( -2.164 0.000 -0.992) 2.380 9.159 ( -3.370 0.000 0.870) 3.480 ======================= Grid point 344 (185/309) ======================= q-point: ( 0.24 0.00 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 309 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.471 ( 6.904 0.000 -8.532) 10.976 1.557 ( 5.150 0.000 0.488) 5.173 1.609 ( 2.860 0.000 -3.060) 4.189 1.803 ( 2.462 0.000 5.611) 6.128 2.105 ( 7.513 0.000 -0.104) 7.514 2.133 ( 3.926 0.000 0.392) 3.946 2.492 ( 1.888 0.000 -0.454) 1.942 2.558 ( -0.351 0.000 3.511) 3.529 2.865 ( 1.135 0.000 -3.304) 3.494 2.906 ( 5.179 0.000 0.961) 5.267 4.745 ( -4.067 0.000 -2.798) 4.936 4.824 ( -4.744 0.000 -0.147) 4.746 6.071 ( -11.925 0.000 -11.281) 16.415 6.425 ( -7.752 0.000 -4.923) 9.184 6.552 ( -10.401 0.000 9.318) 13.964 6.578 ( -6.436 0.000 5.597) 8.530 7.549 ( 7.794 0.000 -3.695) 8.626 7.694 ( 7.580 0.000 -3.493) 8.346 7.833 ( 6.046 0.000 3.435) 6.954 7.864 ( 3.307 0.000 5.776) 6.656 8.372 ( -1.286 0.000 -5.761) 5.903 8.539 ( -3.085 0.000 4.720) 5.639 9.079 ( -0.128 0.000 1.058) 1.065 9.126 ( -2.992 0.000 1.712) 3.447 ======================= Grid point 345 (186/309) ======================= q-point: ( 0.29 0.00 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 309 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.460 ( 7.797 0.000 -6.241) 9.987 1.603 ( 3.093 0.000 -3.725) 4.841 1.678 ( 6.115 0.000 1.186) 6.228 1.883 ( 1.856 0.000 1.306) 2.270 2.136 ( -3.951 0.000 0.135) 3.953 2.172 ( 1.420 0.000 -1.086) 1.788 2.573 ( 3.722 0.000 5.598) 6.723 2.605 ( -0.800 0.000 4.867) 4.932 2.863 ( 5.117 0.000 -1.824) 5.432 3.010 ( 5.739 0.000 1.743) 5.998 4.680 ( -0.772 0.000 -0.710) 1.049 4.764 ( -3.019 0.000 0.307) 3.035 5.801 ( -4.713 0.000 -7.913) 9.210 6.280 ( -4.706 0.000 -1.758) 5.024 6.526 ( -9.528 0.000 8.917) 13.049 6.584 ( -5.032 0.000 7.519) 9.048 7.605 ( 6.757 0.000 -4.273) 7.995 7.765 ( 5.857 0.000 -1.046) 5.949 7.937 ( 1.961 0.000 2.037) 2.828 7.973 ( 2.851 0.000 3.855) 4.794 8.281 ( -1.140 0.000 -4.248) 4.399 8.545 ( -3.493 0.000 3.513) 4.954 9.109 ( 0.737 0.000 2.154) 2.277 9.124 ( -1.505 0.000 2.956) 3.317 ======================= Grid point 346 (187/309) ======================= q-point: ( 0.35 0.00 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 309 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.534 ( 8.626 0.000 -1.667) 8.785 1.613 ( 4.106 0.000 -2.392) 4.752 1.749 ( 4.249 0.000 -2.164) 4.768 1.906 ( 1.428 0.000 -0.973) 1.728 2.037 ( -7.933 0.000 -0.607) 7.956 2.110 ( -5.003 0.000 -3.124) 5.898 2.657 ( -1.484 0.000 4.854) 5.075 2.724 ( 2.901 0.000 8.481) 8.964 2.989 ( 9.037 0.000 3.836) 9.818 3.116 ( 4.782 0.000 2.220) 5.272 4.707 ( 2.089 0.000 2.708) 3.420 4.752 ( -0.622 0.000 1.983) 2.079 5.758 ( 5.959 0.000 0.788) 6.011 6.256 ( 0.399 0.000 3.301) 3.325 6.515 ( -8.546 0.000 9.123) 12.500 6.624 ( -4.230 0.000 8.172) 9.202 7.634 ( 5.651 0.000 -4.871) 7.461 7.829 ( 3.185 0.000 0.255) 3.195 7.954 ( -3.023 0.000 1.635) 3.437 8.016 ( 0.868 0.000 -2.404) 2.556 8.263 ( 2.425 0.000 1.358) 2.779 8.536 ( -3.168 0.000 2.534) 4.057 9.149 ( 0.371 0.000 2.352) 2.381 9.157 ( -0.367 0.000 3.631) 3.649 ======================= Grid point 347 (188/309) ======================= q-point: ( 0.41 0.00 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 309 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.649 ( 6.765 0.000 1.058) 6.847 1.658 ( 4.290 0.000 -0.618) 4.334 1.744 ( 1.701 0.000 -5.309) 5.575 1.886 ( -7.207 0.000 1.626) 7.388 1.937 ( 1.756 0.000 -3.464) 3.883 1.983 ( -5.300 0.000 -2.207) 5.741 2.709 ( -0.075 0.000 5.649) 5.649 2.879 ( 0.924 0.000 9.592) 9.636 3.190 ( 7.634 0.000 5.654) 9.500 3.209 ( 3.244 0.000 2.493) 4.091 4.793 ( 2.006 0.000 4.563) 4.985 4.797 ( 1.118 0.000 3.702) 3.867 5.970 ( 12.549 0.000 7.916) 14.837 6.377 ( 4.936 0.000 7.819) 9.247 6.520 ( -7.978 0.000 9.602) 12.483 6.677 ( -3.889 0.000 8.272) 9.141 7.645 ( 4.903 0.000 -4.901) 6.933 7.863 ( 0.965 0.000 0.166) 0.979 7.886 ( -5.339 0.000 -1.830) 5.644 7.979 ( -1.097 0.000 -1.565) 1.911 8.358 ( 4.632 0.000 3.266) 5.667 8.520 ( -2.983 0.000 1.904) 3.539 9.182 ( -0.244 0.000 2.332) 2.344 9.205 ( 0.051 0.000 3.594) 3.594 ======================= Grid point 348 (189/309) ======================= q-point: ( 0.47 0.00 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 309 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.674 ( -1.077 0.000 -3.806) 3.955 1.706 ( 1.948 0.000 0.205) 1.959 1.753 ( 4.841 0.000 1.290) 5.010 1.788 ( -6.192 0.000 0.057) 6.192 1.915 ( -1.499 0.000 -1.304) 1.987 1.950 ( 3.341 0.000 -1.705) 3.751 2.824 ( 2.622 0.000 8.133) 8.545 2.999 ( -1.900 0.000 8.558) 8.767 3.275 ( 0.976 0.000 2.376) 2.568 3.337 ( 2.953 0.000 3.607) 4.662 4.872 ( 1.212 0.000 4.289) 4.457 4.875 ( 0.365 0.000 4.460) 4.475 6.288 ( 12.314 0.000 9.497) 15.551 6.532 ( -8.473 0.000 9.727) 12.899 6.584 ( 5.932 0.000 9.143) 10.899 6.729 ( -4.298 0.000 8.182) 9.242 7.652 ( 4.744 0.000 -4.416) 6.481 7.767 ( -5.404 0.000 -3.455) 6.414 7.870 ( 0.503 0.000 -0.183) 0.535 7.946 ( -1.733 0.000 0.008) 1.733 8.468 ( 4.497 0.000 2.419) 5.107 8.496 ( -3.546 0.000 1.559) 3.874 9.209 ( -0.301 0.000 2.475) 2.494 9.253 ( 0.173 0.000 3.046) 3.051 ======================= Grid point 349 (190/309) ======================= q-point: (-0.47 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 309 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.643 ( 0.019 0.000 0.826) 0.827 1.699 ( -5.780 0.000 1.587) 5.994 1.715 ( -0.482 0.000 -2.549) 2.594 1.830 ( 4.778 0.000 -0.500) 4.804 1.872 ( -2.245 0.000 -1.469) 2.683 1.979 ( 2.722 0.000 -1.105) 2.938 2.986 ( 2.479 0.000 8.936) 9.274 3.040 ( -5.921 0.000 5.447) 8.045 3.298 ( -2.042 0.000 1.884) 2.779 3.370 ( -2.290 0.000 0.746) 2.409 4.921 ( -1.390 0.000 3.390) 3.664 4.935 ( -0.304 0.000 3.494) 3.507 6.518 ( -10.587 0.000 8.562) 13.615 6.557 ( 7.882 0.000 7.053) 10.576 6.764 ( -5.631 0.000 7.405) 9.302 6.768 ( 3.348 0.000 6.808) 7.587 7.635 ( -5.557 0.000 -3.861) 6.767 7.671 ( 5.051 0.000 -3.294) 6.030 7.885 ( 1.787 0.000 0.168) 1.794 7.935 ( -0.137 0.000 0.856) 0.867 8.453 ( -4.823 0.000 1.159) 4.960 8.551 ( 3.314 0.000 1.114) 3.496 9.244 ( 0.396 0.000 2.597) 2.628 9.291 ( 0.140 0.000 2.010) 2.015 ======================= Grid point 350 (191/309) ======================= q-point: (-0.41 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 309 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.624 ( -5.970 0.000 0.077) 5.971 1.658 ( -3.536 0.000 -1.121) 3.709 1.676 ( -2.058 0.000 3.706) 4.239 1.802 ( -1.811 0.000 -2.369) 2.982 1.885 ( 4.424 0.000 -2.005) 4.858 1.994 ( 1.514 0.000 -1.467) 2.108 2.953 ( -12.021 0.000 0.949) 12.058 3.112 ( -1.090 0.000 7.120) 7.202 3.260 ( -5.716 0.000 0.864) 5.781 3.309 ( -5.558 0.000 -0.247) 5.564 4.924 ( -3.099 0.000 1.881) 3.625 4.952 ( -2.589 0.000 2.048) 3.300 6.438 ( -13.258 0.000 5.569) 14.380 6.708 ( 3.087 0.000 3.354) 4.558 6.755 ( -7.313 0.000 5.182) 8.963 6.862 ( 0.443 0.000 3.184) 3.215 7.495 ( -6.652 0.000 -3.405) 7.473 7.713 ( 4.978 0.000 -1.635) 5.239 7.928 ( 2.869 0.000 0.744) 2.964 7.972 ( 2.959 0.000 1.482) 3.310 8.383 ( -6.249 0.000 0.662) 6.284 8.594 ( 1.508 0.000 -0.174) 1.518 9.290 ( 1.317 0.000 2.088) 2.469 9.309 ( -0.184 0.000 0.718) 0.741 ======================= Grid point 351 (192/309) ======================= q-point: (-0.35 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 309 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.496 ( -11.701 0.000 0.448) 11.710 1.588 ( -11.544 0.000 0.034) 11.544 1.612 ( -1.241 0.000 -0.055) 1.242 1.829 ( 4.338 0.000 1.214) 4.505 1.909 ( 3.367 0.000 -2.674) 4.300 1.986 ( -0.026 0.000 -1.168) 1.169 2.718 ( -18.359 0.000 -1.108) 18.393 3.121 ( -9.217 0.000 3.060) 9.712 3.156 ( -7.161 0.000 -0.063) 7.162 3.212 ( -6.880 0.000 -0.069) 6.881 4.880 ( -4.672 0.000 0.324) 4.684 4.913 ( -4.973 0.000 0.537) 5.001 6.276 ( -14.476 0.000 1.242) 14.530 6.684 ( -7.986 0.000 1.262) 8.085 6.758 ( 0.759 0.000 0.651) 1.000 6.886 ( -0.079 0.000 0.744) 0.748 7.344 ( -9.243 0.000 -1.276) 9.330 7.768 ( 3.718 0.000 -0.040) 3.719 7.979 ( 2.263 0.000 0.576) 2.335 8.059 ( 6.101 0.000 0.847) 6.160 8.287 ( -7.311 0.000 0.334) 7.319 8.593 ( -0.502 0.000 -0.772) 0.920 9.305 ( -0.751 0.000 -0.235) 0.786 9.335 ( 1.884 0.000 0.729) 2.021 ======================= Grid point 352 (193/309) ======================= q-point: (-0.29 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 309 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.298 ( -15.801 0.000 1.253) 15.851 1.390 ( -14.694 0.000 0.718) 14.712 1.613 ( -0.061 0.000 1.252) 1.253 1.863 ( 3.615 0.000 -5.996) 7.001 1.961 ( -3.022 0.000 0.503) 3.064 1.965 ( 2.796 0.000 4.803) 5.557 2.416 ( -21.783 0.000 2.541) 21.931 2.930 ( -15.496 0.000 -1.401) 15.559 3.036 ( -10.018 0.000 -0.827) 10.052 3.113 ( -6.437 0.000 0.746) 6.480 4.803 ( -5.228 0.000 -0.352) 5.240 4.821 ( -6.954 0.000 -0.833) 7.003 6.054 ( -13.141 0.000 -2.981) 13.475 6.558 ( -6.892 0.000 -2.979) 7.508 6.769 ( 0.913 0.000 -0.400) 0.997 6.896 ( 1.411 0.000 -0.412) 1.470 7.191 ( -12.453 0.000 2.953) 12.799 7.819 ( 1.906 0.000 1.373) 2.349 8.001 ( 0.255 0.000 -0.405) 0.478 8.144 ( 6.584 0.000 -4.385) 7.911 8.178 ( -7.817 0.000 0.391) 7.827 8.580 ( -0.810 0.000 1.849) 2.019 9.283 ( -1.397 0.000 -0.605) 1.522 9.363 ( 2.139 0.000 -0.983) 2.354 ======================= Grid point 353 (194/309) ======================= q-point: (-0.24 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 309 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.079 ( -16.613 0.000 2.859) 16.857 1.199 ( -14.833 0.000 4.797) 15.589 1.631 ( -0.398 0.000 1.299) 1.359 1.812 ( 1.642 0.000 -6.597) 6.799 1.873 ( -12.348 0.000 2.278) 12.557 2.080 ( 2.088 0.000 5.730) 6.098 2.200 ( -18.023 0.000 10.775) 20.998 2.643 ( -18.407 0.000 -2.741) 18.610 2.850 ( -11.092 0.000 -1.934) 11.259 3.053 ( -3.709 0.000 1.674) 4.069 4.696 ( -7.185 0.000 -1.094) 7.268 4.732 ( -4.012 0.000 0.653) 4.065 5.835 ( -8.354 0.000 -3.842) 9.195 6.420 ( -4.393 0.000 -3.973) 5.923 6.783 ( 1.989 0.000 -0.577) 2.071 6.919 ( 3.129 0.000 -1.320) 3.396 7.060 ( -14.508 0.000 7.433) 16.301 7.864 ( 0.441 0.000 2.486) 2.525 7.973 ( -2.134 0.000 -1.260) 2.478 8.069 ( -7.809 0.000 0.691) 7.839 8.081 ( -0.524 0.000 -11.768) 11.780 8.653 ( 3.992 0.000 4.924) 6.339 9.248 ( -2.049 0.000 -0.846) 2.216 9.373 ( 2.373 0.000 -2.452) 3.412 ======================= Grid point 354 (195/309) ======================= q-point: (-0.18 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 309 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.903 ( -13.564 0.000 5.197) 14.526 1.109 ( -10.857 0.000 10.797) 15.312 1.627 ( -0.932 0.000 -0.545) 1.080 1.700 ( -18.664 0.000 8.822) 20.644 1.747 ( 0.846 0.000 -5.092) 5.161 2.104 ( -18.157 0.000 10.471) 20.960 2.126 ( -5.766 0.000 1.378) 5.929 2.351 ( -15.687 0.000 -0.133) 15.688 2.711 ( -4.418 0.000 1.095) 4.551 3.037 ( -1.046 0.000 0.441) 1.136 4.609 ( -3.862 0.000 1.541) 4.159 4.712 ( -1.672 0.000 2.900) 3.348 5.766 ( 2.136 0.000 3.037) 3.712 6.346 ( -0.936 0.000 -0.274) 0.975 6.811 ( 2.827 0.000 -0.669) 2.905 6.946 ( 3.645 0.000 -2.532) 4.438 6.963 ( -14.710 0.000 10.185) 17.892 7.831 ( -9.978 0.000 -12.323) 15.856 7.870 ( -2.837 0.000 -0.722) 2.927 7.921 ( -4.830 0.000 -0.072) 4.831 7.988 ( -3.742 0.000 3.454) 5.093 8.788 ( 6.513 0.000 1.703) 6.732 9.200 ( -2.414 0.000 -1.122) 2.662 9.370 ( 2.573 0.000 -3.344) 4.219 ======================= Grid point 355 (196/309) ======================= q-point: (-0.12 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 309 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.852 ( -5.511 0.000 9.644) 11.108 1.167 ( -4.894 0.000 14.000) 14.830 1.577 ( -15.052 0.000 10.674) 18.452 1.597 ( -2.168 0.000 -1.793) 2.813 1.717 ( 2.173 0.000 -1.864) 2.863 1.901 ( -24.025 0.000 8.120) 25.360 1.953 ( -11.326 0.000 -2.608) 11.623 2.183 ( -11.010 0.000 1.877) 11.169 2.761 ( 3.126 0.000 5.344) 6.191 3.021 ( -0.157 0.000 -1.475) 1.483 4.637 ( 0.784 0.000 5.378) 5.435 4.759 ( 0.378 0.000 5.102) 5.116 6.006 ( 15.132 0.000 11.808) 19.194 6.397 ( 3.310 0.000 5.175) 6.143 6.845 ( 2.958 0.000 -0.912) 3.096 6.899 ( -13.546 0.000 11.296) 17.638 6.954 ( 2.859 0.000 -3.374) 4.423 7.486 ( -16.927 0.000 -7.132) 18.368 7.794 ( -3.970 0.000 -2.024) 4.456 7.812 ( -6.770 0.000 -1.361) 6.906 8.043 ( 0.041 0.000 6.099) 6.099 8.869 ( 4.852 0.000 -2.602) 5.505 9.154 ( -1.655 0.000 -0.758) 1.821 9.360 ( 2.422 0.000 -3.559) 4.305 ======================= Grid point 356 (197/309) ======================= q-point: (-0.06 0.00 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 309 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.005 ( 3.540 0.000 12.932) 13.408 1.307 ( -1.174 0.000 11.710) 11.769 1.458 ( -11.478 0.000 2.150) 11.678 1.562 ( -1.128 0.000 0.327) 1.175 1.742 ( -0.857 0.000 -1.211) 1.483 1.756 ( -15.705 0.000 17.685) 23.652 1.825 ( 0.987 0.000 0.693) 1.206 2.056 ( -8.903 0.000 1.906) 9.105 2.886 ( 2.895 0.000 4.747) 5.560 2.998 ( 0.173 0.000 -1.876) 1.884 4.748 ( 1.999 0.000 6.711) 7.002 4.850 ( 1.014 0.000 5.989) 6.075 6.453 ( 19.001 0.000 12.862) 22.945 6.572 ( 7.092 0.000 7.994) 10.687 6.870 ( 2.227 0.000 -1.169) 2.515 6.872 ( -10.869 0.000 12.156) 16.306 6.941 ( 1.292 0.000 -2.963) 3.232 7.168 ( -17.854 0.000 -0.710) 17.868 7.684 ( -5.628 0.000 -2.547) 6.178 7.721 ( -2.189 0.000 -2.857) 3.599 8.133 ( 0.419 0.000 6.497) 6.511 8.862 ( 1.748 0.000 -5.321) 5.600 9.139 ( 0.166 0.000 0.391) 0.425 9.343 ( 1.535 0.000 -3.332) 3.669 ======================= Grid point 357 (198/309) ======================= q-point: ( 0.00 0.20 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 511 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.243 ( 2.372 1.028 10.682) 10.991 1.331 ( -0.806 -4.827 11.378) 12.386 1.372 ( -2.746 -2.422 6.078) 7.096 1.568 ( 1.755 -8.813 9.343) 12.963 1.714 ( 0.990 2.622 -2.988) 4.097 1.849 ( -0.429 8.933 4.539) 10.029 1.881 ( 2.687 -1.768 -3.284) 4.596 2.272 ( 1.313 12.673 6.588) 14.343 2.808 ( -0.753 -5.383 3.395) 6.409 3.085 ( 0.191 3.434 1.864) 3.912 4.809 ( 0.295 -4.371 5.510) 7.039 4.867 ( -0.022 -6.380 4.724) 7.939 6.688 ( -0.626 -1.777 5.859) 6.155 6.834 ( -1.111 -4.582 3.024) 5.601 6.874 ( 1.683 1.040 14.576) 14.710 6.915 ( 0.353 1.528 -3.055) 3.434 6.966 ( -1.818 -1.165 13.785) 13.953 6.968 ( 1.076 0.217 -1.469) 1.834 7.579 ( -2.217 0.687 -4.522) 5.083 7.649 ( 0.101 -1.019 -4.200) 4.323 8.331 ( 0.559 9.742 4.445) 10.723 8.794 ( -0.424 -0.141 -6.072) 6.088 9.127 ( 1.062 -2.831 1.455) 3.356 9.279 ( -0.177 -3.255 -3.319) 4.652 ======================= Grid point 358 (199/309) ======================= q-point: ( 0.06 0.20 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 511 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.343 ( -3.563 -2.356 8.721) 9.711 1.423 ( -2.134 -2.855 7.730) 8.512 1.515 ( 5.219 3.510 2.666) 6.831 1.702 ( 6.546 2.428 -1.021) 7.056 1.756 ( 7.574 3.564 0.523) 8.387 1.832 ( 0.766 -2.421 -1.714) 3.063 2.033 ( 9.395 -3.978 7.122) 12.443 2.373 ( 5.110 3.111 0.442) 5.999 2.844 ( -2.232 1.617 5.379) 6.044 3.083 ( -1.449 6.107 -0.752) 6.322 4.865 ( -1.783 -5.135 4.244) 6.896 4.902 ( -2.120 -6.501 2.530) 7.291 6.689 ( -7.169 -1.323 4.926) 8.798 6.752 ( -12.672 -2.126 6.434) 14.370 6.848 ( -5.095 1.412 -1.682) 5.548 6.870 ( -3.974 0.457 -0.910) 4.102 7.203 ( 9.149 -0.205 11.099) 14.385 7.244 ( 11.207 -1.438 8.276) 14.006 7.502 ( 2.115 1.396 -6.300) 6.791 7.608 ( 3.443 -1.193 -5.601) 6.682 8.405 ( 0.561 7.490 5.162) 9.114 8.699 ( -0.847 1.117 -6.211) 6.367 9.155 ( -0.360 -3.297 1.453) 3.621 9.215 ( -2.284 -3.248 -3.251) 5.132 ======================= Grid point 359 (200/309) ======================= q-point: ( 0.12 0.20 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 511 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.383 ( -0.886 0.773 2.056) 2.368 1.511 ( 1.242 -3.520 5.252) 6.444 1.552 ( 1.567 3.309 1.043) 3.807 1.741 ( 1.875 0.652 -7.398) 7.659 1.883 ( 9.929 2.117 2.399) 10.432 1.896 ( 8.406 2.833 -1.172) 8.948 2.275 ( 8.785 -6.240 6.511) 12.590 2.432 ( 6.619 -4.127 -4.180) 8.850 2.889 ( -2.294 6.758 5.702) 9.135 3.028 ( -2.291 7.633 -2.678) 8.407 4.870 ( -3.670 -6.087 1.539) 7.272 4.875 ( -3.872 -5.920 1.054) 7.152 6.618 ( -9.639 -1.949 1.635) 9.969 6.652 ( -11.434 -2.122 5.186) 12.733 6.716 ( -9.031 2.086 -1.012) 9.323 6.778 ( -6.623 0.176 -1.115) 6.719 7.457 ( 7.329 0.074 1.309) 7.445 7.486 ( 8.016 0.850 3.066) 8.624 7.498 ( 8.190 0.139 4.403) 9.299 7.601 ( 6.356 -1.129 -6.074) 8.864 8.485 ( 0.161 5.856 5.479) 8.021 8.605 ( -0.689 2.874 -5.753) 6.468 9.128 ( -3.503 -3.492 -2.708) 5.639 9.152 ( -2.372 -3.827 0.983) 4.609 ======================= Grid point 360 (201/309) ======================= q-point: ( 0.18 0.20 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 511 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.413 ( 4.904 1.926 -0.680) 5.312 1.545 ( 3.194 -2.646 -5.532) 6.914 1.647 ( 0.940 0.087 3.052) 3.195 1.666 ( 1.685 -0.475 0.480) 1.815 2.009 ( 9.155 3.144 -1.721) 9.832 2.045 ( 8.210 2.108 1.033) 8.539 2.451 ( 5.428 -4.367 2.879) 7.537 2.465 ( 5.846 -3.191 -3.628) 7.584 2.914 ( -1.279 6.492 1.661) 6.822 2.961 ( -1.754 6.478 -2.072) 7.024 4.792 ( -4.847 -5.704 -1.857) 7.712 4.829 ( -4.796 -6.164 0.572) 7.831 6.403 ( -12.745 -0.176 -7.431) 14.755 6.530 ( -10.110 -4.341 -0.448) 11.011 6.611 ( -8.499 1.074 4.506) 9.679 6.662 ( -9.385 1.143 2.911) 9.892 7.502 ( 8.028 1.641 -4.933) 9.564 7.626 ( 7.972 -1.403 -5.570) 9.826 7.685 ( 7.170 0.438 5.231) 8.886 7.707 ( 6.748 0.246 6.826) 9.601 8.517 ( -0.581 4.734 -4.559) 6.598 8.557 ( -1.014 5.393 4.501) 7.097 9.050 ( -2.699 -4.340 -1.299) 5.274 9.118 ( -3.670 -4.278 1.041) 5.731 ======================= Grid point 361 (202/309) ======================= q-point: ( 0.24 0.20 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 511 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.460 ( 6.467 -0.178 -8.210) 10.453 1.548 ( 6.186 -0.850 1.068) 6.335 1.654 ( 1.941 3.128 -0.913) 3.793 1.788 ( 1.791 -1.653 6.739) 7.166 2.112 ( 6.971 1.485 -1.503) 7.284 2.151 ( 4.913 1.506 -0.510) 5.164 2.474 ( 3.152 -1.090 -1.951) 3.864 2.568 ( 3.345 -0.303 3.643) 4.955 2.893 ( 0.752 3.246 -4.302) 5.441 2.945 ( 0.630 3.701 2.110) 4.307 4.692 ( -4.093 -5.016 -2.366) 6.893 4.755 ( -4.654 -6.585 -0.561) 8.083 6.088 ( -11.528 1.905 -10.240) 15.536 6.348 ( -8.771 -6.159 -4.127) 11.485 6.572 ( -7.749 0.539 7.357) 10.698 6.590 ( -9.043 1.105 6.302) 11.078 7.563 ( 7.962 1.429 -4.068) 9.055 7.675 ( 7.741 -1.659 -4.396) 9.055 7.848 ( 6.100 1.100 4.246) 7.513 7.872 ( 4.103 0.639 5.251) 6.694 8.441 ( -0.864 7.163 -4.614) 8.564 8.591 ( -2.621 5.274 4.221) 7.246 9.021 ( -0.585 -5.733 0.651) 5.799 9.083 ( -3.340 -4.626 1.941) 6.027 ======================= Grid point 362 (203/309) ======================= q-point: ( 0.29 0.20 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 511 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.479 ( 8.206 2.382 -4.280) 9.557 1.627 ( 3.741 0.861 -2.483) 4.572 1.703 ( 4.310 2.830 1.480) 5.364 1.875 ( 0.164 -1.377 3.413) 3.684 2.129 ( -1.213 0.571 -3.113) 3.389 2.179 ( 1.272 0.217 -1.841) 2.248 2.541 ( 3.432 -0.399 4.148) 5.398 2.668 ( 2.442 2.403 5.109) 6.151 2.867 ( 3.448 1.447 -2.176) 4.326 3.016 ( 3.873 0.510 2.629) 4.709 4.627 ( -1.232 -4.910 -0.504) 5.088 4.692 ( -2.824 -6.778 0.077) 7.343 5.836 ( -4.701 3.580 -6.988) 9.152 6.197 ( -5.092 -7.232 -1.691) 9.005 6.554 ( -8.782 1.669 8.166) 12.108 6.580 ( -5.657 -0.350 8.027) 9.826 7.617 ( 6.885 1.283 -4.438) 8.291 7.731 ( 6.024 -2.550 -2.663) 7.062 7.968 ( 1.562 1.687 2.783) 3.610 7.977 ( 3.729 0.442 2.880) 4.732 8.374 ( -0.710 9.716 -2.803) 10.137 8.599 ( -3.061 5.591 3.396) 7.222 9.042 ( 0.603 -6.635 2.029) 6.965 9.078 ( -1.932 -5.122 3.022) 6.253 ======================= Grid point 363 (204/309) ======================= q-point: ( 0.35 0.20 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 511 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.564 ( 6.983 2.944 -1.523) 7.730 1.648 ( 4.174 2.704 -1.511) 5.198 1.760 ( 2.579 1.012 -1.621) 3.210 1.890 ( -2.270 -2.192 1.647) 3.559 2.039 ( -3.098 1.709 -3.702) 5.121 2.121 ( -3.339 0.637 -3.587) 4.942 2.644 ( 0.560 0.312 5.323) 5.361 2.791 ( 2.212 4.326 8.100) 9.446 2.958 ( 7.669 -1.891 2.230) 8.207 3.122 ( 4.541 0.091 3.827) 5.939 4.646 ( 1.395 -5.682 2.612) 6.407 4.682 ( -0.377 -6.535 2.025) 6.852 5.798 ( 5.259 3.960 1.179) 6.688 6.173 ( 0.574 -7.238 3.540) 8.078 6.547 ( -7.688 2.240 8.733) 11.849 6.618 ( -4.572 -0.586 8.573) 9.733 7.646 ( 5.678 1.271 -4.930) 7.626 7.776 ( 3.578 -3.598 -1.527) 5.299 7.991 ( -2.423 1.758 1.668) 3.427 8.015 ( 0.638 -0.080 -2.209) 2.301 8.374 ( 2.227 11.364 1.632) 11.694 8.597 ( -2.752 6.267 2.764) 7.382 9.087 ( 0.840 -6.528 2.598) 7.076 9.102 ( -1.110 -5.846 3.566) 6.937 ======================= Grid point 364 (205/309) ======================= q-point: ( 0.41 0.20 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 511 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.629 ( 4.330 0.246 -0.320) 4.349 1.710 ( 4.269 1.950 -0.513) 4.722 1.735 ( -0.621 -0.447 -3.418) 3.503 1.850 ( -6.700 -2.848 2.158) 7.593 1.972 ( 1.008 3.461 -3.578) 5.080 2.031 ( -1.082 3.960 -2.873) 5.011 2.716 ( 0.330 1.487 5.572) 5.776 2.947 ( 1.409 5.388 10.106) 11.539 3.099 ( 5.318 -4.973 2.621) 7.739 3.261 ( 4.985 1.562 5.605) 7.661 4.717 ( 1.316 -6.807 3.988) 7.998 4.734 ( 1.305 -6.280 4.073) 7.598 5.998 ( 11.449 2.934 8.078) 14.316 6.303 ( 4.978 -6.149 8.418) 11.552 6.562 ( -6.794 2.990 9.130) 11.766 6.673 ( -3.829 -0.538 8.512) 9.349 7.656 ( 4.789 1.178 -4.912) 6.960 7.793 ( 1.135 -3.919 -1.194) 4.251 7.930 ( -3.740 1.649 -2.946) 5.038 7.978 ( -2.057 -0.343 -0.996) 2.311 8.461 ( 3.895 10.573 3.313) 11.745 8.593 ( -2.491 7.212 2.376) 7.991 9.124 ( -0.421 -5.987 2.557) 6.524 9.147 ( 0.166 -6.203 3.770) 7.260 ======================= Grid point 365 (206/309) ======================= q-point: ( 0.47 0.20 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 511 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.667 ( -1.180 -0.392 -2.533) 2.821 1.696 ( 3.384 -0.831 0.824) 3.581 1.753 ( 1.360 -0.146 0.727) 1.549 1.773 ( -5.576 -1.335 0.868) 5.799 1.949 ( 0.573 3.911 -2.163) 4.506 2.018 ( 2.463 5.173 -1.927) 6.045 2.822 ( 1.861 0.944 7.205) 7.501 3.090 ( -0.828 7.473 9.599) 12.193 3.179 ( 1.704 -6.294 1.603) 6.715 3.391 ( 2.130 2.388 4.556) 5.568 4.790 ( 0.688 -7.300 4.203) 8.451 4.809 ( 0.667 -6.676 4.274) 7.955 6.300 ( 10.560 1.508 10.029) 14.642 6.507 ( 2.636 -3.708 10.337) 11.294 6.595 ( -4.217 2.518 8.670) 9.965 6.732 ( -3.404 -0.264 7.941) 8.644 7.661 ( 4.520 0.984 -4.320) 6.330 7.763 ( -3.123 -0.881 -2.262) 3.955 7.845 ( -0.555 -1.258 -2.861) 3.175 7.930 ( -2.468 -1.934 -0.752) 3.224 8.552 ( 1.566 9.099 2.374) 9.533 8.593 ( -0.742 8.788 2.291) 9.112 9.153 ( -0.394 -5.800 2.794) 6.449 9.199 ( 0.271 -5.711 3.251) 6.577 ======================= Grid point 366 (207/309) ======================= q-point: (-0.47 0.20 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 511 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.642 ( -2.200 0.179 1.595) 2.723 1.703 ( -1.964 -0.771 -1.777) 2.758 1.718 ( -1.952 1.337 1.362) 2.730 1.816 ( 4.696 -1.409 0.627) 4.943 1.917 ( -1.448 4.525 -1.991) 5.151 2.024 ( 1.487 3.633 -1.818) 4.326 2.940 ( -0.317 -1.112 6.865) 6.962 3.162 ( -2.941 6.702 3.368) 8.056 3.209 ( -2.189 -4.083 4.852) 6.708 3.434 ( -2.280 3.439 2.011) 4.591 4.840 ( -1.025 -7.407 3.359) 8.198 4.863 ( -0.510 -6.985 3.267) 7.729 6.511 ( -4.530 0.517 9.330) 10.384 6.608 ( 1.452 3.390 6.841) 7.772 6.702 ( -1.426 -3.353 8.210) 8.982 6.792 ( -0.677 -0.087 5.763) 5.803 7.651 ( -5.304 1.634 -3.675) 6.656 7.679 ( 4.857 0.893 -3.029) 5.793 7.836 ( 1.542 -3.858 -0.644) 4.204 7.894 ( -0.464 -4.184 -0.837) 4.292 8.554 ( -3.274 9.804 1.860) 10.502 8.645 ( 2.367 8.735 1.193) 9.128 9.191 ( 0.352 -5.453 2.879) 6.176 9.241 ( 0.134 -5.269 2.232) 5.724 ======================= Grid point 367 (208/309) ======================= q-point: (-0.41 0.20 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 511 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.598 ( -6.016 -1.076 1.235) 6.235 1.643 ( -4.704 -1.232 -0.845) 4.936 1.739 ( 1.018 4.356 2.283) 5.022 1.840 ( -4.388 3.284 -1.332) 5.640 1.887 ( 5.029 0.728 -2.330) 5.590 2.013 ( 0.421 1.499 -1.644) 2.264 2.945 ( -8.842 -0.102 2.238) 9.121 3.122 ( -3.903 -2.905 0.339) 4.877 3.231 ( -5.952 3.761 5.875) 9.170 3.388 ( -5.582 4.442 0.380) 7.144 4.848 ( -2.811 -7.116 1.874) 7.877 4.877 ( -2.419 -7.154 1.852) 7.776 6.465 ( -12.793 2.682 5.787) 14.295 6.694 ( -5.298 -2.810 5.111) 7.879 6.752 ( 0.101 1.192 3.758) 3.944 6.856 ( 0.465 -0.763 2.771) 2.912 7.516 ( -6.401 2.293 -3.250) 7.536 7.724 ( 4.957 1.070 -1.335) 5.244 7.854 ( 0.305 -7.382 0.859) 7.438 7.904 ( 3.154 -4.493 -0.855) 5.555 8.526 ( -3.372 12.432 1.704) 12.994 8.677 ( 0.981 7.905 -0.180) 7.968 9.239 ( 1.176 -5.288 2.234) 5.860 9.261 ( -0.276 -5.001 0.868) 5.083 ======================= Grid point 368 (209/309) ======================= q-point: (-0.35 0.20 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 511 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.496 ( -10.347 0.111 0.822) 10.380 1.548 ( -6.861 -1.907 0.230) 7.125 1.696 ( -7.351 5.877 -0.332) 9.417 1.825 ( 2.075 -0.278 0.289) 2.113 1.916 ( 3.438 0.951 -2.048) 4.113 2.000 ( 0.506 0.977 -1.073) 1.537 2.754 ( -16.235 3.626 -0.936) 16.661 3.054 ( -6.590 -6.370 0.575) 9.183 3.162 ( -11.119 3.895 2.011) 11.952 3.293 ( -7.542 4.408 0.308) 8.741 4.808 ( -4.355 -6.700 0.316) 7.997 4.841 ( -4.567 -6.864 0.503) 8.260 6.309 ( -14.116 3.364 1.243) 14.564 6.621 ( -8.999 -5.437 1.199) 10.582 6.791 ( 0.670 2.332 0.710) 2.528 6.880 ( 0.019 -0.688 0.674) 0.964 7.373 ( -8.731 3.154 -1.158) 9.355 7.782 ( 3.561 1.015 0.133) 3.705 7.865 ( -0.340 -12.612 0.353) 12.621 7.947 ( 2.814 -3.103 0.083) 4.189 8.509 ( -1.282 15.748 1.048) 15.835 8.670 ( -0.832 7.415 -0.866) 7.512 9.255 ( -1.102 -5.177 -0.159) 5.295 9.283 ( 1.749 -5.423 0.688) 5.740 ======================= Grid point 369 (210/309) ======================= q-point: (-0.29 0.20 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 511 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.323 ( -14.417 2.505 1.911) 14.757 1.423 ( -11.422 2.375 1.204) 11.728 1.614 ( -4.249 0.529 1.547) 4.553 1.826 ( 0.091 -3.676 -2.004) 4.188 1.945 ( 1.365 0.704 -0.968) 1.816 2.005 ( 0.784 1.635 1.534) 2.376 2.482 ( -19.644 6.817 1.953) 20.885 2.941 ( -9.002 -6.886 0.065) 11.334 2.961 ( -15.840 3.201 -1.349) 16.216 3.167 ( -9.483 2.384 0.048) 9.778 4.735 ( -4.956 -6.227 -0.428) 7.970 4.757 ( -6.335 -6.005 -0.603) 8.750 6.093 ( -12.654 3.994 -2.955) 13.594 6.478 ( -7.948 -7.157 -2.904) 11.083 6.802 ( 1.003 2.504 -0.539) 2.751 6.888 ( 1.126 -0.762 -0.353) 1.405 7.229 ( -11.671 4.068 2.666) 12.644 7.808 ( -2.071 -9.459 -0.136) 9.684 7.859 ( 0.638 -5.111 0.243) 5.157 7.980 ( 0.526 -2.569 0.810) 2.744 8.499 ( 0.776 17.421 -3.812) 17.851 8.654 ( -0.782 7.455 2.321) 7.847 9.225 ( -1.982 -5.884 -0.779) 6.258 9.310 ( 2.077 -5.627 -0.863) 6.060 ======================= Grid point 370 (211/309) ======================= q-point: (-0.24 0.20 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 511 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.141 ( -14.945 5.981 3.661) 16.509 1.276 ( -12.509 6.865 5.036) 15.132 1.585 ( -3.422 -4.258 1.502) 5.666 1.797 ( -1.966 -2.939 0.205) 3.542 1.893 ( -4.886 2.512 -2.496) 6.035 2.054 ( -1.165 -1.803 3.706) 4.282 2.276 ( -16.287 7.806 8.933) 20.150 2.673 ( -18.430 3.155 -2.491) 18.863 2.787 ( -10.278 -5.835 -1.339) 11.894 3.046 ( -7.116 -1.763 1.703) 7.526 4.644 ( -6.474 -4.835 -0.714) 8.111 4.667 ( -3.987 -5.906 0.376) 7.135 5.883 ( -7.865 4.857 -3.719) 9.964 6.330 ( -4.934 -8.182 -3.635) 10.223 6.813 ( 1.834 2.383 -0.811) 3.114 6.905 ( 1.899 -1.229 -0.704) 2.369 7.105 ( -13.012 4.552 6.285) 15.150 7.721 ( -7.014 -16.433 -1.683) 17.946 7.882 ( -0.041 0.776 1.333) 1.543 7.975 ( -2.615 -1.900 0.484) 3.268 8.407 ( -1.954 17.269 -7.290) 18.846 8.728 ( 3.923 7.445 3.736) 9.207 9.176 ( -2.734 -7.042 -1.080) 7.631 9.324 ( 2.516 -5.290 -2.047) 6.205 ======================= Grid point 371 (212/309) ======================= q-point: (-0.18 0.20 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 511 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.973 ( -14.428 7.199 4.415) 16.718 1.214 ( -9.775 8.874 9.744) 16.409 1.537 ( -4.678 -7.673 0.236) 8.990 1.735 ( -13.040 1.418 5.829) 14.354 1.809 ( 1.585 5.182 -2.950) 6.170 2.019 ( -12.131 -3.873 4.677) 13.566 2.205 ( -11.538 5.125 6.342) 14.129 2.385 ( -16.121 3.879 0.127) 16.582 2.650 ( -4.695 -5.673 0.552) 7.385 3.002 ( -3.275 -4.400 2.370) 5.975 4.569 ( -3.542 -3.591 1.824) 5.363 4.645 ( -1.445 -6.241 2.545) 6.893 5.815 ( 1.683 4.994 2.657) 5.903 6.260 ( -0.623 -7.878 0.313) 7.909 6.832 ( 1.474 1.727 -0.234) 2.282 6.916 ( -1.244 -1.545 1.199) 2.318 7.019 ( -9.051 4.396 5.556) 11.494 7.560 ( -11.093 -15.699 -2.053) 19.332 7.875 ( -2.660 0.203 0.056) 2.669 7.915 ( -5.544 -0.963 -0.322) 5.636 8.282 ( -2.559 18.719 -4.406) 19.400 8.837 ( 5.799 4.936 0.623) 7.640 9.120 ( -2.691 -7.583 -0.907) 8.097 9.330 ( 2.837 -4.479 -2.928) 6.056 ======================= Grid point 372 (213/309) ======================= q-point: (-0.12 0.20 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 511 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.874 ( -8.438 4.034 8.461) 12.612 1.222 ( -9.472 4.427 11.830) 15.789 1.460 ( -6.493 -9.980 1.255) 11.973 1.636 ( -11.345 0.160 4.989) 12.395 1.804 ( 1.123 6.199 -1.909) 6.583 1.857 ( -12.867 0.938 3.148) 13.280 2.046 ( -15.071 6.397 2.775) 16.605 2.225 ( -10.048 5.538 4.043) 12.164 2.678 ( 2.234 -7.194 3.881) 8.474 3.001 ( -1.016 -3.376 2.270) 4.194 4.601 ( 0.740 -3.213 5.418) 6.342 4.693 ( 0.897 -6.204 4.725) 7.850 6.028 ( 13.184 2.417 11.136) 17.425 6.331 ( 4.319 -5.989 5.956) 9.487 6.843 ( -3.028 0.283 3.316) 4.499 6.904 ( -4.813 -0.295 4.384) 6.517 6.981 ( -1.465 2.929 -0.313) 3.290 7.341 ( -14.727 -10.729 -1.133) 18.256 7.804 ( -5.360 0.113 -1.821) 5.662 7.810 ( -5.709 -0.205 -1.473) 5.899 8.237 ( -0.567 16.359 0.916) 16.394 8.895 ( 3.811 1.856 -3.144) 5.277 9.084 ( -0.908 -5.849 0.015) 5.919 9.327 ( 2.639 -3.708 -3.421) 5.694 ======================= Grid point 373 (214/309) ======================= q-point: (-0.06 0.20 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 511 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.994 ( 3.800 -0.323 13.095) 13.639 1.253 ( -8.666 -1.812 12.735) 15.510 1.385 ( -6.487 -7.527 2.400) 10.223 1.523 ( -10.695 -7.536 6.838) 14.762 1.762 ( -3.827 3.089 -0.478) 4.941 1.800 ( 1.350 8.614 -0.624) 8.742 1.926 ( -6.530 4.557 2.904) 8.476 2.191 ( -4.751 12.960 7.521) 15.719 2.761 ( 1.478 -8.442 3.193) 9.145 3.038 ( 0.704 0.212 3.159) 3.244 4.709 ( 1.871 -3.612 6.383) 7.569 4.784 ( 1.294 -6.160 5.552) 8.393 6.439 ( 17.069 -1.130 12.473) 21.171 6.535 ( 8.600 -3.114 8.969) 12.811 6.842 ( -7.016 -0.763 8.407) 10.977 6.898 ( -4.286 -0.473 4.380) 6.147 6.953 ( 0.154 1.943 -2.597) 3.248 7.117 ( -13.789 -4.130 0.443) 14.401 7.686 ( -5.393 0.218 -2.614) 5.997 7.718 ( -2.873 -0.431 -2.890) 4.098 8.269 ( 0.357 12.619 3.409) 13.076 8.869 ( 0.924 -0.398 -5.205) 5.301 9.093 ( 1.032 -3.299 0.856) 3.561 9.313 ( 1.646 -3.329 -3.433) 5.058 ======================= Grid point 374 (215/309) ======================= q-point: ( 0.00 0.40 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 511 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.272 ( 0.383 2.126 9.079) 9.333 1.298 ( -0.848 1.613 15.443) 15.550 1.320 ( -1.248 -2.872 7.258) 7.904 1.390 ( 0.161 -7.946 14.620) 16.640 1.773 ( 1.937 3.448 -3.036) 4.986 1.835 ( 2.607 -3.035 -3.178) 5.109 2.084 ( -0.027 13.522 -1.515) 13.607 2.305 ( 0.616 -8.430 -2.203) 8.734 2.881 ( -0.214 11.330 10.050) 15.147 3.065 ( 0.225 -6.017 6.461) 8.832 4.733 ( 0.303 -2.430 4.340) 4.984 4.752 ( 0.120 -4.458 4.271) 6.175 6.682 ( -0.405 1.518 6.910) 7.086 6.743 ( -0.530 -4.600 6.063) 7.629 6.901 ( 0.770 1.776 14.426) 14.556 6.936 ( -0.544 -1.844 14.069) 14.200 6.943 ( 0.515 1.244 -2.976) 3.266 6.962 ( -0.728 -0.759 -2.937) 3.120 7.598 ( -1.371 1.281 -4.398) 4.782 7.624 ( -0.497 -1.486 -4.279) 4.557 8.544 ( 0.474 11.881 0.946) 11.928 8.733 ( -0.098 -7.238 -2.800) 7.762 9.114 ( 0.707 2.412 -0.721) 2.615 9.196 ( 0.076 -5.204 -2.916) 5.966 ======================= Grid point 375 (216/309) ======================= q-point: ( 0.06 0.40 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 511 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.330 ( -4.599 0.805 10.027) 11.061 1.366 ( -3.746 -2.823 8.860) 10.025 1.585 ( 8.643 4.306 7.083) 11.975 1.679 ( 8.643 -5.419 8.812) 13.481 1.776 ( 5.816 2.892 -3.027) 7.166 1.826 ( 4.208 -1.669 -4.611) 6.461 2.095 ( 4.491 9.198 -0.579) 10.252 2.286 ( 3.012 -9.580 -3.859) 10.758 2.994 ( -1.096 10.510 7.672) 13.058 3.126 ( -1.096 -2.333 3.272) 4.165 4.773 ( -1.647 -3.162 2.885) 4.586 4.785 ( -1.917 -4.443 2.499) 5.447 6.681 ( -8.625 0.627 5.736) 10.377 6.710 ( -10.571 -2.193 6.030) 12.366 6.867 ( -5.074 0.642 -1.625) 5.367 6.874 ( -4.748 -0.079 -1.108) 4.876 7.202 ( 9.573 0.269 10.928) 14.531 7.216 ( 10.232 -1.260 9.928) 14.313 7.536 ( 2.831 2.125 -5.993) 6.960 7.577 ( 3.362 -2.054 -5.783) 6.998 8.570 ( 0.764 8.946 1.527) 9.108 8.692 ( 0.084 -3.117 -3.151) 4.433 9.105 ( -1.354 -0.712 -0.065) 1.532 9.142 ( -2.186 -3.899 -2.627) 5.185 ======================= Grid point 376 (217/309) ======================= q-point: ( 0.12 0.40 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 511 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.406 ( -0.852 1.635 6.301) 6.565 1.448 ( 0.125 -2.946 6.428) 7.072 1.630 ( 0.786 4.641 -4.305) 6.379 1.710 ( 0.200 -3.506 -6.730) 7.591 1.930 ( 10.750 2.955 2.781) 11.490 1.960 ( 9.797 1.333 1.335) 9.977 2.213 ( 8.535 1.109 2.776) 9.044 2.310 ( 6.909 -7.393 -3.278) 10.637 3.051 ( -2.456 7.959 4.330) 9.387 3.121 ( -2.559 1.100 0.095) 2.787 4.760 ( -3.499 -3.756 0.648) 5.174 4.767 ( -3.466 -4.226 1.123) 5.580 6.598 ( -10.297 -0.042 2.226) 10.535 6.614 ( -10.806 -1.639 3.182) 11.383 6.748 ( -8.626 1.442 -0.295) 8.751 6.771 ( -7.900 -0.928 -0.006) 7.954 7.462 ( 8.461 0.555 5.498) 10.105 7.477 ( 9.065 -0.927 6.794) 11.366 7.529 ( 6.695 2.251 -3.575) 7.917 7.571 ( 6.607 -2.026 -5.551) 8.864 8.608 ( 0.974 5.925 1.979) 6.323 8.655 ( 0.593 1.200 -2.789) 3.094 9.060 ( -4.087 -2.580 -1.932) 5.205 9.071 ( -3.464 -3.631 0.048) 5.018 ======================= Grid point 377 (218/309) ======================= q-point: ( 0.18 0.40 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 511 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.455 ( 3.526 2.390 -1.584) 4.545 1.499 ( 3.091 -2.323 -3.973) 5.543 1.638 ( 0.684 -0.185 4.972) 5.022 1.649 ( 0.742 -1.180 -0.056) 1.395 2.081 ( 9.187 3.421 -2.709) 10.171 2.097 ( 8.146 2.218 -0.284) 8.447 2.375 ( 8.113 -2.309 0.541) 8.453 2.396 ( 7.934 -3.609 0.178) 8.718 3.039 ( -3.413 5.180 0.407) 6.217 3.062 ( -3.518 2.904 -1.355) 4.759 4.694 ( -4.528 -3.113 -1.142) 5.612 4.712 ( -4.543 -4.817 -0.378) 6.632 6.412 ( -11.816 1.418 -5.127) 12.959 6.457 ( -10.825 -3.293 -2.968) 11.698 6.635 ( -9.417 1.428 4.240) 10.425 6.660 ( -9.755 -1.012 3.984) 10.586 7.542 ( 8.330 2.464 -5.368) 10.211 7.589 ( 8.342 -2.415 -5.676) 10.374 7.696 ( 7.345 0.708 5.837) 9.408 7.707 ( 7.286 -0.324 6.231) 9.593 8.626 ( 0.909 5.731 -2.020) 6.144 8.659 ( 1.063 3.445 1.963) 4.105 8.970 ( -4.725 -2.358 -1.096) 5.393 9.015 ( -4.769 -5.802 0.868) 7.561 ======================= Grid point 378 (219/309) ======================= q-point: ( 0.24 0.40 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 511 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.479 ( 6.535 2.050 -5.148) 8.568 1.521 ( 6.781 -2.030 -1.453) 7.225 1.701 ( 0.909 2.113 4.154) 4.749 1.745 ( 0.796 -2.616 7.037) 7.549 2.155 ( 6.911 2.467 -4.019) 8.367 2.178 ( 5.682 0.561 -3.189) 6.540 2.472 ( 6.223 1.506 -0.379) 6.414 2.528 ( 6.328 -3.540 2.228) 7.585 2.974 ( -2.072 4.206 -2.617) 5.370 3.004 ( -2.846 1.412 0.605) 3.234 4.606 ( -4.152 -2.595 -1.655) 5.168 4.631 ( -4.394 -5.107 -1.198) 6.843 6.143 ( -10.685 3.939 -8.006) 13.921 6.234 ( -9.761 -5.699 -5.717) 12.666 6.581 ( -8.285 0.663 6.957) 10.839 6.594 ( -9.202 -0.520 6.928) 11.530 7.598 ( 8.223 2.152 -4.781) 9.753 7.639 ( 8.147 -2.159 -5.107) 9.855 7.867 ( 5.758 0.868 4.610) 7.427 7.877 ( 5.307 -0.202 4.656) 7.063 8.611 ( 0.842 9.727 -1.919) 9.950 8.701 ( 0.242 3.653 2.387) 4.371 8.901 ( -3.520 -4.464 0.444) 5.702 8.963 ( -4.566 -7.442 2.136) 8.988 ======================= Grid point 379 (220/309) ======================= q-point: ( 0.29 0.40 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 511 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.545 ( 7.670 4.122 -1.593) 8.852 1.611 ( 6.203 -2.472 -0.938) 6.743 1.764 ( 0.424 3.304 3.244) 4.650 1.826 ( -1.386 -3.346 4.884) 6.081 2.161 ( 2.289 1.826 -5.930) 6.614 2.179 ( 2.223 -0.234 -4.631) 5.142 2.571 ( 4.690 3.447 3.268) 6.675 2.648 ( 5.128 -3.789 3.343) 7.199 2.940 ( 0.665 5.199 0.080) 5.242 3.011 ( 1.002 -1.787 2.464) 3.205 4.544 ( -1.979 -2.601 -0.206) 3.275 4.566 ( -2.433 -5.037 -0.145) 5.596 5.926 ( -4.799 5.986 -5.014) 9.165 6.054 ( -5.037 -7.510 -3.013) 9.532 6.570 ( -7.562 0.300 7.995) 11.009 6.575 ( -7.192 -0.234 8.629) 11.236 7.648 ( 7.003 1.924 -4.653) 8.625 7.687 ( 6.685 -2.200 -4.258) 8.226 7.982 ( 2.294 0.396 2.722) 3.582 7.986 ( 3.263 0.094 1.796) 3.726 8.604 ( 0.715 13.347 -0.368) 13.371 8.729 ( -0.791 6.198 2.476) 6.721 8.883 ( -1.263 -8.512 2.063) 8.849 8.943 ( -3.132 -8.638 3.271) 9.753 ======================= Grid point 380 (221/309) ======================= q-point: ( 0.35 0.40 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 511 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.627 ( 4.568 3.388 -1.089) 5.791 1.671 ( 4.016 -0.785 -0.864) 4.182 1.786 ( -1.379 2.022 0.479) 2.494 1.835 ( -3.644 -3.054 2.583) 5.411 2.093 ( 0.710 2.921 -5.778) 6.513 2.126 ( 0.416 -0.457 -5.019) 5.057 2.688 ( 2.366 4.347 5.354) 7.291 2.783 ( 4.076 -4.681 6.045) 8.664 3.003 ( 4.074 5.869 3.715) 8.052 3.097 ( 3.806 -3.242 4.871) 6.980 4.548 ( 0.300 -3.229 2.378) 4.021 4.562 ( -0.057 -4.674 2.195) 5.164 5.896 ( 3.721 6.367 2.082) 7.663 6.029 ( 1.977 -7.688 3.036) 8.499 6.580 ( -6.577 1.360 8.864) 11.121 6.602 ( -5.503 -1.086 8.995) 10.600 7.677 ( 5.491 1.959 -4.706) 7.492 7.719 ( 4.732 -2.539 -3.580) 6.454 8.008 ( -1.158 0.378 0.115) 1.223 8.013 ( -0.105 -0.205 -1.365) 1.384 8.634 ( 1.837 14.853 2.108) 15.114 8.747 ( -1.249 8.435 2.411) 8.862 8.916 ( 0.358 -10.836 3.459) 11.381 8.953 ( -2.058 -9.314 3.671) 10.220 ======================= Grid point 381 (222/309) ======================= q-point: ( 0.41 0.40 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 511 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.653 ( 2.113 2.000 -1.197) 3.146 1.693 ( 1.030 -2.098 -2.418) 3.363 1.757 ( -2.421 1.789 1.104) 3.206 1.798 ( -4.988 -2.580 1.749) 5.882 2.048 ( 2.187 3.944 -3.890) 5.956 2.085 ( 2.268 0.703 -3.559) 4.278 2.785 ( 1.260 5.970 5.526) 8.231 2.917 ( 2.482 -7.134 6.119) 9.721 3.141 ( 4.083 7.230 6.496) 10.542 3.248 ( 4.600 -3.281 6.965) 8.969 4.602 ( 0.839 -3.707 3.768) 5.352 4.614 ( 0.908 -4.794 3.893) 6.242 6.075 ( 9.212 5.086 8.389) 13.457 6.183 ( 6.895 -6.321 8.588) 12.699 6.612 ( -5.596 2.424 9.059) 10.920 6.652 ( -4.412 -1.727 8.899) 10.082 7.686 ( 4.271 2.001 -4.505) 6.522 7.731 ( 3.047 -2.799 -3.100) 5.170 7.951 ( -3.110 0.821 -3.125) 4.484 7.966 ( -2.773 -0.793 -1.959) 3.486 8.705 ( 2.489 13.741 2.806) 14.244 8.759 ( -1.279 9.414 2.249) 9.763 8.973 ( -0.174 -9.598 3.305) 10.153 8.984 ( -0.553 -10.304 4.720) 11.347 ======================= Grid point 382 (223/309) ======================= q-point: ( 0.47 0.40 -0.67) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 511 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.668 ( -0.242 0.503 -0.711) 0.904 1.681 ( 2.288 -0.756 0.450) 2.451 1.747 ( -1.369 -0.312 1.161) 1.822 1.750 ( -3.905 -0.803 1.611) 4.300 2.037 ( 1.678 4.584 -2.627) 5.543 2.081 ( 2.138 0.607 -2.552) 3.384 2.884 ( 1.400 5.761 5.760) 8.266 3.019 ( 1.258 -8.053 4.574) 9.346 3.276 ( 0.860 8.798 7.141) 11.364 3.391 ( 1.655 -2.940 6.270) 7.121 4.666 ( 0.475 -3.962 3.918) 5.592 4.681 ( 0.499 -5.204 3.962) 6.559 6.347 ( 8.002 3.421 10.663) 13.764 6.423 ( 5.961 -4.579 10.755) 13.122 6.655 ( -4.692 3.328 8.263) 10.069 6.708 ( -3.564 -2.246 7.960) 9.006 7.688 ( 3.730 1.864 -3.765) 5.618 7.728 ( 1.692 -2.360 -2.391) 3.761 7.849 ( -3.260 1.371 -4.164) 5.463 7.886 ( -3.323 -2.392 -2.690) 4.899 8.758 ( -0.463 10.902 1.692) 11.042 8.783 ( 1.095 10.028 2.047) 10.293 9.012 ( -0.657 -7.936 4.044) 8.931 9.050 ( 0.506 -9.511 4.223) 10.419 ======================= Grid point 383 (224/309) ======================= q-point: (-0.47 0.40 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 511 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.655 ( -3.629 1.197 1.533) 4.117 1.681 ( -2.986 -1.407 -0.008) 3.301 1.749 ( 1.519 1.858 1.490) 2.825 1.785 ( 3.847 -1.862 1.458) 4.516 2.013 ( -0.756 4.853 -2.212) 5.386 2.065 ( -0.028 -0.143 -2.374) 2.379 2.966 ( -0.817 3.824 4.759) 6.159 3.068 ( -1.398 -6.647 2.301) 7.171 3.352 ( -2.940 8.678 6.274) 11.105 3.456 ( -2.507 -1.875 4.116) 5.171 4.714 ( -0.699 -4.109 3.055) 5.167 4.730 ( -0.536 -5.452 2.954) 6.224 6.543 ( -2.962 2.688 10.010) 10.780 6.603 ( -2.125 -3.338 9.801) 10.570 6.708 ( 0.040 3.314 5.566) 6.478 6.766 ( -0.425 -2.492 5.281) 5.855 7.690 ( -2.873 2.094 -2.598) 4.403 7.702 ( 2.593 1.167 -1.877) 3.407 7.777 ( 1.082 -1.676 -3.142) 3.722 7.808 ( -0.579 -4.222 -3.031) 5.229 8.763 ( -1.384 10.828 1.587) 11.031 8.819 ( 0.938 7.438 0.695) 7.529 9.065 ( 0.160 -6.188 3.959) 7.348 9.107 ( 0.330 -8.083 3.132) 8.675 ======================= Grid point 384 (225/309) ======================= q-point: (-0.41 0.40 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 511 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.595 ( -6.157 0.688 0.900) 6.260 1.617 ( -5.489 -1.455 -0.159) 5.681 1.809 ( 2.628 3.061 1.310) 4.241 1.852 ( 1.610 -1.397 0.297) 2.152 1.957 ( -1.739 4.982 -2.203) 5.718 2.020 ( -1.492 -1.356 -1.857) 2.741 2.966 ( -6.075 2.510 2.050) 6.886 3.036 ( -5.069 -4.698 0.379) 6.922 3.355 ( -6.812 6.935 4.530) 10.725 3.432 ( -6.255 -0.571 2.171) 6.646 4.725 ( -2.233 -4.017 1.684) 4.895 4.742 ( -2.066 -5.504 1.589) 6.090 6.531 ( -11.567 4.268 6.118) 13.764 6.617 ( -9.675 -4.717 6.140) 12.392 6.791 ( 1.913 2.391 2.830) 4.169 6.831 ( 1.086 -1.842 2.562) 3.337 7.583 ( -5.392 4.910 -2.566) 7.730 7.696 ( -2.739 -6.606 -0.775) 7.193 7.770 ( 4.471 1.691 -1.799) 5.107 7.825 ( 4.526 -3.770 -1.015) 5.977 8.766 ( -0.941 11.385 1.494) 11.521 8.831 ( 0.198 5.984 -0.097) 5.988 9.117 ( 0.518 -5.917 2.634) 6.498 9.140 ( -0.199 -6.813 1.461) 6.971 ======================= Grid point 385 (226/309) ======================= q-point: (-0.35 0.40 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 511 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.502 ( -8.359 0.588 1.050) 8.446 1.519 ( -7.293 -1.224 0.677) 7.426 1.788 ( -7.467 3.221 -0.852) 8.177 1.819 ( -2.725 -0.591 -0.849) 2.914 1.952 ( 3.140 2.850 -1.103) 4.382 1.999 ( 1.284 -1.457 -0.886) 2.134 2.839 ( -11.715 5.066 -0.358) 12.769 2.939 ( -8.363 -5.775 0.203) 10.165 3.261 ( -11.587 5.838 1.521) 13.064 3.333 ( -9.812 -0.867 0.818) 9.884 4.694 ( -3.674 -3.654 0.328) 5.192 4.712 ( -3.732 -5.256 0.412) 6.460 6.394 ( -13.068 5.472 1.223) 14.220 6.506 ( -11.323 -6.387 1.200) 13.055 6.831 ( 0.698 1.903 0.671) 2.136 6.861 ( 0.325 -1.291 0.633) 1.475 7.466 ( -7.192 6.927 -0.841) 10.021 7.632 ( -4.583 -10.692 -0.308) 11.638 7.828 ( 4.049 2.557 0.068) 4.789 7.884 ( 3.614 -3.354 0.206) 4.935 8.780 ( 0.628 11.526 1.048) 11.590 8.822 ( -0.635 6.801 -0.759) 6.872 9.136 ( -1.467 -5.991 0.217) 6.172 9.151 ( 0.833 -7.269 0.403) 7.328 ======================= Grid point 386 (227/309) ======================= q-point: (-0.29 0.40 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 511 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.381 ( -10.706 3.372 2.967) 11.610 1.433 ( -7.381 -1.607 2.459) 7.944 1.656 ( -9.555 3.975 1.094) 10.407 1.743 ( -5.644 -4.886 0.348) 7.473 1.978 ( 2.352 2.301 -2.165) 3.939 2.012 ( 1.605 -0.952 -0.687) 1.988 2.641 ( -14.402 9.130 1.135) 17.089 2.801 ( -10.512 -7.961 0.601) 13.199 3.056 ( -16.010 6.413 -0.952) 17.273 3.160 ( -13.394 -3.460 -0.414) 13.839 4.631 ( -4.432 -3.261 -0.398) 5.517 4.645 ( -4.998 -4.513 -0.361) 6.744 6.193 ( -11.474 6.557 -2.936) 13.537 6.331 ( -9.875 -7.974 -2.933) 13.027 6.843 ( 1.012 1.793 -0.515) 2.122 6.870 ( 0.906 -1.192 -0.388) 1.547 7.346 ( -9.881 8.530 1.988) 13.204 7.548 ( -7.257 -12.995 0.858) 14.909 7.881 ( 2.005 2.326 0.898) 3.199 7.929 ( 1.399 -2.756 0.691) 3.167 8.776 ( -0.520 11.063 -3.518) 11.621 8.823 ( 1.308 8.057 1.620) 8.322 9.098 ( -2.474 -5.218 -1.067) 5.872 9.165 ( 1.369 -8.998 -0.571) 9.119 ======================= Grid point 387 (228/309) ======================= q-point: (-0.24 0.40 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 511 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.269 ( -11.540 6.866 4.059) 14.029 1.364 ( -7.790 -1.083 3.985) 8.817 1.550 ( -9.186 4.027 4.014) 10.803 1.689 ( -6.162 -7.978 4.849) 11.186 1.955 ( -0.173 3.621 -3.219) 4.848 2.016 ( -0.696 -2.637 -0.313) 2.745 2.467 ( -13.423 10.991 4.180) 17.845 2.645 ( -11.358 -7.990 -0.250) 13.889 2.787 ( -17.219 8.147 -0.258) 19.050 2.956 ( -13.053 -8.021 1.468) 15.391 4.559 ( -4.610 -2.943 -0.169) 5.472 4.566 ( -4.272 -3.625 -0.041) 5.602 6.003 ( -6.860 7.664 -3.519) 10.871 6.161 ( -5.888 -9.136 -3.435) 11.399 6.853 ( 1.559 1.744 -0.826) 2.480 6.881 ( 1.355 -1.352 -0.592) 2.004 7.229 ( -11.721 8.854 4.610) 15.395 7.437 ( -10.233 -13.414 2.087) 17.000 7.906 ( -0.568 1.526 0.875) 1.848 7.938 ( -1.485 -1.926 0.509) 2.485 8.698 ( -2.100 13.723 -4.491) 14.591 8.865 ( 2.256 1.424 -0.455) 2.707 9.048 ( -1.774 -1.372 -0.792) 2.379 9.181 ( 2.468 -9.450 -1.173) 9.837 ======================= Grid point 388 (229/309) ======================= q-point: (-0.18 0.40 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 511 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.137 ( -12.574 9.385 3.435) 16.062 1.295 ( -8.240 -5.432 2.984) 10.311 1.480 ( -11.079 6.910 6.519) 14.594 1.655 ( -10.417 -8.783 6.142) 14.946 1.912 ( -0.203 4.834 -1.517) 5.071 1.978 ( -4.665 -2.086 0.682) 5.156 2.330 ( -11.416 7.411 1.773) 13.726 2.448 ( -11.949 -2.997 -1.043) 12.363 2.613 ( -9.438 8.539 5.398) 13.825 2.850 ( -7.776 -11.993 5.525) 15.323 4.511 ( -2.463 -1.646 1.977) 3.562 4.534 ( -1.509 -4.251 2.028) 4.946 5.938 ( 0.944 7.784 1.913) 8.071 6.096 ( 0.141 -8.987 1.176) 9.064 6.863 ( 0.308 1.528 0.121) 1.563 6.890 ( -0.153 -1.348 0.437) 1.425 7.127 ( -10.410 7.405 4.850) 13.665 7.304 ( -11.949 -11.614 2.803) 16.897 7.881 ( -3.383 0.498 -0.206) 3.426 7.895 ( -4.410 -0.960 -0.333) 4.525 8.607 ( -2.149 15.767 -3.641) 16.324 8.856 ( -0.437 -9.055 -2.452) 9.391 9.046 ( 2.214 5.708 -0.201) 6.126 9.204 ( 3.285 -8.562 -1.950) 9.375 ======================= Grid point 389 (230/309) ======================= q-point: (-0.12 0.40 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 511 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.014 ( -10.191 9.978 5.099) 15.146 1.210 ( -7.317 -9.509 2.429) 12.242 1.381 ( -15.208 5.770 8.813) 18.500 1.531 ( -15.741 -8.507 5.548) 18.733 1.888 ( -3.205 2.353 -0.279) 3.986 1.903 ( -3.818 1.162 -1.334) 4.208 2.191 ( -7.708 9.070 0.048) 11.903 2.327 ( -4.993 -1.532 2.233) 5.680 2.628 ( -2.587 7.735 8.532) 11.803 2.861 ( -3.008 -11.761 7.655) 14.352 4.550 ( 0.991 -1.262 4.924) 5.179 4.580 ( 1.320 -4.545 4.411) 6.469 6.098 ( 9.658 5.043 9.427) 14.408 6.209 ( 6.684 -6.541 7.574) 12.034 6.859 ( -4.759 1.312 4.065) 6.395 6.886 ( -3.201 -1.411 2.711) 4.426 7.053 ( -5.559 4.693 1.556) 7.440 7.166 ( -10.757 -7.674 2.078) 13.376 7.803 ( -5.641 -0.048 -1.539) 5.848 7.805 ( -5.172 -0.255 -1.542) 5.403 8.547 ( -1.016 15.865 -1.488) 15.968 8.810 ( -0.932 -11.483 -2.271) 11.742 9.082 ( 3.335 6.241 -1.217) 7.180 9.221 ( 3.157 -7.301 -2.739) 8.412 ======================= Grid point 390 (231/309) ======================= q-point: (-0.06 0.40 0.33) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 511 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.037 ( 0.152 5.538 10.966) 12.286 1.185 ( -1.492 -8.924 5.600) 10.641 1.300 ( -13.854 2.790 11.765) 18.388 1.393 ( -14.440 -6.204 8.780) 18.003 1.810 ( -2.857 2.546 -1.802) 4.230 1.852 ( -0.735 -1.482 -1.822) 2.461 2.116 ( -2.524 13.151 -0.513) 13.401 2.316 ( -0.759 -4.942 0.745) 5.055 2.741 ( -0.344 9.687 10.422) 14.233 2.956 ( 0.113 -9.228 8.397) 12.478 4.649 ( 1.764 -1.779 5.477) 6.023 4.672 ( 1.669 -4.391 5.062) 6.906 6.434 ( 13.375 1.032 11.651) 17.768 6.476 ( 11.326 -3.046 10.519) 15.754 6.842 ( -8.754 0.823 9.004) 12.586 6.869 ( -7.632 -1.871 7.091) 10.584 6.997 ( -1.774 2.476 -1.900) 3.590 7.048 ( -6.339 -3.106 -0.528) 7.079 7.693 ( -4.675 0.561 -2.712) 5.434 7.706 ( -3.780 -0.797 -2.808) 4.776 8.532 ( -0.014 14.274 0.131) 14.274 8.770 ( -0.368 -10.297 -2.242) 10.544 9.106 ( 2.339 4.855 -1.448) 5.580 9.221 ( 2.001 -6.238 -3.055) 7.229 ======================= Grid point 425 (232/309) ======================= q-point: ( 0.00 0.00 0.42) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.411 ( 3.754 0.000 7.061) 7.998 1.513 ( -4.415 0.000 2.968) 5.320 1.531 ( 0.793 0.000 7.516) 7.558 1.578 ( 1.144 0.000 0.370) 1.202 1.620 ( 0.292 0.000 -3.821) 3.832 1.812 ( 1.706 0.000 -5.531) 5.788 2.184 ( -0.108 0.000 10.720) 10.720 2.198 ( 0.571 0.000 7.773) 7.794 2.935 ( 0.520 0.000 -1.733) 1.809 2.956 ( -0.716 0.000 -1.268) 1.456 4.955 ( 0.537 0.000 4.077) 4.113 5.004 ( -0.304 0.000 1.944) 1.968 6.789 ( -0.674 0.000 2.765) 2.846 6.851 ( 0.309 0.000 -1.139) 1.180 6.898 ( -1.493 0.000 0.176) 1.503 6.937 ( 0.462 0.000 -1.183) 1.270 7.124 ( 4.030 0.000 12.018) 12.676 7.231 ( 0.348 0.000 11.571) 11.576 7.470 ( -4.148 0.000 -6.222) 7.478 7.562 ( -0.244 0.000 -5.939) 5.944 8.365 ( 0.232 0.000 7.250) 7.253 8.653 ( -0.225 0.000 -7.327) 7.330 9.189 ( 1.415 0.000 1.423) 2.007 9.257 ( -0.963 0.000 -2.308) 2.501 ======================= Grid point 426 (233/309) ======================= q-point: ( 0.06 0.00 0.42) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.412 ( -6.204 0.000 -2.009) 6.521 1.517 ( 0.519 0.000 3.487) 3.525 1.597 ( -0.672 0.000 6.064) 6.101 1.623 ( 3.536 0.000 -4.535) 5.750 1.715 ( 10.370 0.000 2.477) 10.662 1.773 ( 4.639 0.000 -5.443) 7.152 2.320 ( 5.068 0.000 3.132) 5.957 2.323 ( 5.656 0.000 1.965) 5.987 2.907 ( -2.548 0.000 -1.480) 2.947 2.921 ( -0.997 0.000 0.276) 1.034 4.989 ( -1.826 0.000 2.216) 2.872 4.990 ( -2.682 0.000 -0.637) 2.757 6.776 ( -4.939 0.000 2.513) 5.542 6.801 ( -6.303 0.000 -1.494) 6.477 6.836 ( -6.068 0.000 -1.236) 6.192 6.860 ( -7.798 0.000 2.122) 8.081 7.357 ( 2.162 0.000 -7.083) 7.406 7.392 ( 9.693 0.000 8.488) 12.884 7.422 ( 5.613 0.000 8.363) 10.072 7.497 ( 3.891 0.000 -7.225) 8.206 8.467 ( -0.005 0.000 7.321) 7.321 8.546 ( -0.483 0.000 -7.313) 7.329 9.197 ( -2.826 0.000 -2.110) 3.527 9.217 ( -0.493 0.000 1.417) 1.500 ======================= Grid point 427 (234/309) ======================= q-point: ( 0.12 0.00 -0.58) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.340 ( 0.314 0.000 -1.159) 1.201 1.545 ( 0.423 0.000 -9.340) 9.350 1.550 ( 1.456 0.000 -0.266) 1.480 1.686 ( 1.526 0.000 5.596) 5.801 1.831 ( 9.548 0.000 -2.559) 9.885 1.895 ( 9.855 0.000 1.179) 9.926 2.391 ( 6.486 0.000 -4.624) 7.965 2.427 ( 7.523 0.000 -1.179) 7.615 2.861 ( -2.252 0.000 0.653) 2.345 2.907 ( -2.228 0.000 0.682) 2.330 4.911 ( -4.490 0.000 -2.755) 5.268 4.962 ( -3.697 0.000 0.006) 3.697 6.580 ( -15.220 0.000 -6.009) 16.363 6.703 ( -7.351 0.000 -3.932) 8.337 6.730 ( -5.949 0.000 3.165) 6.739 6.783 ( -7.995 0.000 3.919) 8.904 7.350 ( 6.983 0.000 -4.630) 8.378 7.490 ( 7.712 0.000 -6.399) 10.021 7.606 ( 6.521 0.000 5.300) 8.403 7.630 ( 8.452 0.000 6.543) 10.689 8.442 ( -0.314 0.000 -6.997) 7.004 8.558 ( -1.048 0.000 6.802) 6.883 9.128 ( -2.938 0.000 -1.028) 3.112 9.212 ( -2.591 0.000 1.367) 2.929 ======================= Grid point 428 (235/309) ======================= q-point: ( 0.18 0.00 -0.58) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.335 ( 4.260 0.000 -8.617) 9.613 1.489 ( 4.090 0.000 0.533) 4.125 1.554 ( 2.111 0.000 -3.105) 3.755 1.782 ( 3.057 0.000 2.702) 4.080 1.963 ( 10.836 0.000 -1.048) 10.886 2.040 ( 8.516 0.000 0.382) 8.524 2.424 ( 6.132 0.000 -2.807) 6.744 2.515 ( 7.660 0.000 -2.282) 7.993 2.860 ( -2.666 0.000 -2.254) 3.491 2.868 ( 0.373 0.000 2.511) 2.539 4.794 ( -4.748 0.000 -3.712) 6.027 4.888 ( -4.339 0.000 -1.533) 4.601 6.224 ( -16.439 0.000 -9.972) 19.227 6.519 ( -8.430 0.000 -4.812) 9.707 6.693 ( -5.419 0.000 3.925) 6.691 6.730 ( -7.637 0.000 5.486) 9.403 7.410 ( 8.111 0.000 -3.898) 9.000 7.551 ( 8.997 0.000 -2.921) 9.459 7.760 ( 6.202 0.000 3.393) 7.070 7.820 ( 6.600 0.000 4.791) 8.156 8.346 ( -0.153 0.000 -6.677) 6.679 8.613 ( -2.888 0.000 5.474) 6.189 9.095 ( -1.195 0.000 0.935) 1.517 9.187 ( -3.453 0.000 2.025) 4.003 ======================= Grid point 429 (236/309) ======================= q-point: ( 0.24 0.00 -0.58) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.297 ( 7.958 0.000 -7.818) 11.156 1.536 ( 2.827 0.000 -4.423) 5.249 1.604 ( 5.420 0.000 2.605) 6.014 1.833 ( 3.622 0.000 -2.558) 4.435 2.098 ( 7.695 0.000 -0.926) 7.751 2.157 ( 3.413 0.000 2.518) 4.241 2.522 ( 6.806 0.000 3.028) 7.449 2.598 ( 5.550 0.000 0.115) 5.552 2.792 ( 1.102 0.000 -3.732) 3.892 2.938 ( 3.993 0.000 2.578) 4.754 4.694 ( -2.208 0.000 -2.283) 3.176 4.808 ( -3.193 0.000 -1.381) 3.478 5.874 ( -11.307 0.000 -8.522) 14.159 6.351 ( -6.330 0.000 -2.635) 6.857 6.670 ( -5.123 0.000 4.025) 6.515 6.711 ( -6.159 0.000 6.957) 9.292 7.470 ( 7.933 0.000 -4.982) 9.368 7.667 ( 7.443 0.000 1.167) 7.534 7.882 ( 5.287 0.000 1.665) 5.543 7.956 ( 3.887 0.000 3.456) 5.201 8.257 ( 0.183 0.000 -5.963) 5.966 8.623 ( -4.153 0.000 3.885) 5.687 9.114 ( 0.307 0.000 2.461) 2.480 9.175 ( -2.746 0.000 3.194) 4.212 ======================= Grid point 430 (237/309) ======================= q-point: ( 0.29 0.00 -0.58) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.367 ( 11.046 0.000 -3.353) 11.544 1.534 ( 4.412 0.000 -3.308) 5.515 1.689 ( 3.441 0.000 -0.059) 3.441 1.838 ( 4.108 0.000 -4.398) 6.018 2.131 ( 0.329 0.000 -3.158) 3.175 2.161 ( -6.440 0.000 1.071) 6.528 2.675 ( 2.786 0.000 1.380) 3.109 2.693 ( 6.972 0.000 6.223) 9.345 2.857 ( 9.985 0.000 1.443) 10.088 3.042 ( 5.599 0.000 1.905) 5.914 4.686 ( 2.090 0.000 1.400) 2.515 4.769 ( -0.781 0.000 0.278) 0.829 5.717 ( -0.315 0.000 -0.419) 0.524 6.282 ( -1.762 0.000 1.954) 2.631 6.653 ( -4.950 0.000 4.665) 6.802 6.729 ( -4.240 0.000 6.788) 8.003 7.511 ( 7.076 0.000 -5.388) 8.893 7.786 ( 4.112 0.000 3.138) 5.173 7.958 ( 3.024 0.000 0.243) 3.034 8.009 ( -0.674 0.000 -0.449) 0.810 8.220 ( 3.285 0.000 -1.767) 3.730 8.603 ( -4.066 0.000 2.466) 4.755 9.159 ( 0.412 0.000 2.905) 2.934 9.193 ( -1.490 0.000 3.905) 4.179 ======================= Grid point 431 (238/309) ======================= q-point: ( 0.35 0.00 -0.58) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.510 ( 11.113 0.000 -0.874) 11.147 1.581 ( 5.463 0.000 -0.867) 5.532 1.705 ( 0.978 0.000 -2.189) 2.397 1.847 ( 4.603 0.000 -3.731) 5.925 2.038 ( -9.106 0.000 -0.413) 9.115 2.048 ( -4.421 0.000 -3.072) 5.384 2.723 ( 2.062 0.000 1.666) 2.651 2.884 ( 5.191 0.000 7.877) 9.433 3.074 ( 11.564 0.000 4.436) 12.386 3.151 ( 5.519 0.000 1.596) 5.745 4.774 ( 3.750 0.000 3.963) 5.456 4.794 ( 1.552 0.000 2.303) 2.777 5.850 ( 9.510 0.000 8.172) 12.539 6.357 ( 3.402 0.000 6.811) 7.614 6.652 ( -4.278 0.000 5.238) 6.763 6.766 ( -2.750 0.000 6.186) 6.769 7.536 ( 6.000 0.000 -5.128) 7.893 7.864 ( 0.386 0.000 3.130) 3.154 7.936 ( -3.178 0.000 -4.130) 5.211 7.984 ( -0.226 0.000 0.461) 0.514 8.295 ( 5.691 0.000 1.345) 5.847 8.575 ( -3.183 0.000 1.527) 3.531 9.200 ( -0.166 0.000 2.780) 2.785 9.230 ( -0.649 0.000 3.733) 3.789 ======================= Grid point 432 (239/309) ======================= q-point: ( 0.41 0.00 -0.58) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.631 ( 5.235 0.000 -3.072) 6.070 1.657 ( 4.193 0.000 0.640) 4.242 1.692 ( 2.702 0.000 0.262) 2.715 1.873 ( 4.724 0.000 -3.025) 5.609 1.905 ( -7.735 0.000 0.014) 7.735 1.953 ( -3.934 0.000 -0.916) 4.039 2.815 ( 4.426 0.000 5.049) 6.714 3.046 ( 1.928 0.000 7.523) 7.766 3.244 ( 4.186 0.000 1.327) 4.392 3.276 ( 7.776 0.000 2.941) 8.313 4.866 ( 2.491 0.000 3.352) 4.176 4.879 ( 2.393 0.000 4.078) 4.728 6.160 ( 12.486 0.000 10.907) 16.579 6.546 ( 6.154 0.000 9.141) 11.020 6.666 ( -3.923 0.000 5.534) 6.783 6.814 ( -1.852 0.000 5.685) 5.979 7.554 ( 5.198 0.000 -4.362) 6.786 7.821 ( -4.532 0.000 -4.104) 6.114 7.886 ( -1.795 0.000 2.116) 2.774 7.973 ( -1.630 0.000 0.171) 1.639 8.401 ( 5.860 0.000 1.174) 5.976 8.551 ( -2.741 0.000 1.324) 3.045 9.231 ( -0.536 0.000 2.598) 2.652 9.270 ( -0.236 0.000 2.888) 2.898 ======================= Grid point 433 (240/309) ======================= q-point: ( 0.47 0.00 -0.58) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.630 ( 1.589 0.000 -0.709) 1.740 1.701 ( 0.834 0.000 -0.213) 0.861 1.766 ( 4.254 0.000 -0.060) 4.255 1.796 ( -6.126 0.000 0.154) 6.128 1.904 ( -2.606 0.000 0.274) 2.621 1.917 ( 4.526 0.000 -1.709) 4.837 2.979 ( 5.227 0.000 7.396) 9.057 3.134 ( -2.308 0.000 5.329) 5.807 3.307 ( 1.739 0.000 1.085) 2.049 3.371 ( 2.416 0.000 -0.056) 2.417 4.943 ( 1.640 0.000 2.828) 3.269 4.948 ( 0.318 0.000 2.995) 3.012 6.469 ( 9.934 0.000 8.681) 13.193 6.673 ( -5.171 0.000 4.798) 7.054 6.750 ( 4.755 0.000 7.588) 8.955 6.858 ( -2.248 0.000 4.872) 5.366 7.578 ( 5.054 0.000 -2.992) 5.873 7.694 ( -5.208 0.000 -3.739) 6.411 7.884 ( -1.170 0.000 1.504) 1.905 7.949 ( -1.298 0.000 -0.097) 1.302 8.494 ( 4.986 0.000 0.451) 5.006 8.524 ( -3.600 0.000 1.291) 3.825 9.258 ( -0.279 0.000 2.443) 2.458 9.299 ( -0.002 0.000 1.589) 1.589 ======================= Grid point 434 (241/309) ======================= q-point: (-0.47 0.00 0.42) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.668 ( -2.540 0.000 -1.869) 3.153 1.677 ( 3.160 0.000 2.105) 3.797 1.730 ( -4.618 0.000 1.261) 4.788 1.802 ( 1.449 0.000 -1.612) 2.167 1.868 ( -2.729 0.000 0.586) 2.792 1.953 ( 2.999 0.000 -1.549) 3.375 3.108 ( -7.755 0.000 1.462) 7.892 3.140 ( 2.851 0.000 6.259) 6.878 3.319 ( -1.846 0.000 0.670) 1.964 3.360 ( -1.804 0.000 -1.476) 2.331 4.970 ( -1.602 0.000 1.514) 2.205 4.983 ( -0.276 0.000 1.363) 1.390 6.623 ( -8.439 0.000 2.110) 8.699 6.672 ( 5.022 0.000 4.448) 6.709 6.865 ( -4.219 0.000 2.708) 5.013 6.873 ( 1.158 0.000 3.866) 4.036 7.568 ( -5.626 0.000 -2.716) 6.247 7.628 ( 5.348 0.000 -0.983) 5.437 7.904 ( 1.020 0.000 1.565) 1.868 7.942 ( 1.199 0.000 -0.389) 1.261 8.474 ( -5.226 0.000 1.017) 5.324 8.558 ( 3.297 0.000 -0.263) 3.308 9.289 ( 0.382 0.000 1.887) 1.925 9.312 ( 0.086 0.000 0.148) 0.171 ======================= Grid point 435 (242/309) ======================= q-point: (-0.41 0.00 0.42) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.604 ( -3.263 0.000 -1.333) 3.525 1.669 ( -5.906 0.000 1.437) 6.079 1.736 ( -7.126 0.000 -1.060) 7.205 1.761 ( 3.757 0.000 1.485) 4.040 1.869 ( 1.797 0.000 0.430) 1.848 1.966 ( 1.676 0.000 -1.307) 2.126 2.947 ( -13.160 0.000 -1.468) 13.241 3.210 ( -1.341 0.000 1.409) 1.945 3.267 ( -6.666 0.000 1.083) 6.754 3.294 ( -4.387 0.000 -1.206) 4.550 4.942 ( -3.375 0.000 -0.114) 3.376 4.970 ( -2.517 0.000 -0.239) 2.528 6.471 ( -11.790 0.000 -2.298) 12.011 6.750 ( 1.277 0.000 0.860) 1.539 6.795 ( -6.588 0.000 -1.334) 6.721 6.902 ( -0.955 0.000 0.864) 1.288 7.455 ( -6.564 0.000 -0.344) 6.573 7.707 ( 4.873 0.000 0.953) 4.965 7.950 ( 2.105 0.000 1.281) 2.464 7.976 ( 4.526 0.000 -1.119) 4.663 8.396 ( -6.719 0.000 0.722) 6.758 8.585 ( 1.264 0.000 -0.593) 1.396 9.307 ( 0.009 0.000 -0.913) 0.913 9.317 ( 0.964 0.000 0.608) 1.140 ======================= Grid point 436 (243/309) ======================= q-point: (-0.35 0.00 0.42) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.497 ( -10.172 0.000 -0.210) 10.174 1.587 ( -11.022 0.000 -0.211) 11.024 1.632 ( -1.568 0.000 1.770) 2.365 1.796 ( 1.661 0.000 -2.212) 2.766 1.941 ( 3.824 0.000 3.748) 5.355 1.977 ( 0.883 0.000 0.350) 0.949 2.710 ( -16.273 0.000 0.324) 16.276 3.111 ( -9.045 0.000 -3.268) 9.618 3.167 ( -8.945 0.000 0.306) 8.950 3.204 ( -5.517 0.000 -0.805) 5.575 4.872 ( -4.472 0.000 -1.197) 4.630 4.901 ( -4.785 0.000 -1.731) 5.089 6.220 ( -12.823 0.000 -6.731) 14.482 6.641 ( -7.248 0.000 -5.351) 9.009 6.757 ( 0.381 0.000 -0.793) 0.880 6.889 ( -0.485 0.000 -0.608) 0.777 7.362 ( -8.369 0.000 2.919) 8.863 7.791 ( 3.312 0.000 2.343) 4.057 7.989 ( 1.232 0.000 0.364) 1.284 8.028 ( 5.753 0.000 -3.685) 6.832 8.298 ( -7.609 0.000 0.649) 7.636 8.590 ( 0.330 0.000 0.321) 0.460 9.289 ( -0.239 0.000 -1.412) 1.432 9.332 ( 1.318 0.000 -1.066) 1.695 ======================= Grid point 437 (244/309) ======================= q-point: (-0.29 0.00 0.42) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.315 ( -13.730 0.000 0.469) 13.738 1.423 ( -12.167 0.000 2.490) 12.419 1.648 ( -0.566 0.000 1.934) 2.015 1.770 ( -0.015 0.000 -2.901) 2.901 1.991 ( -2.514 0.000 2.577) 3.600 2.065 ( 4.248 0.000 5.090) 6.630 2.511 ( -15.797 0.000 6.691) 17.156 2.882 ( -15.056 0.000 -3.483) 15.454 2.995 ( -10.598 0.000 -3.336) 11.111 3.118 ( -4.436 0.000 -0.571) 4.472 4.786 ( -6.194 0.000 -2.580) 6.710 4.791 ( -3.910 0.000 -0.749) 3.981 5.937 ( -9.993 0.000 -8.188) 12.919 6.462 ( -5.165 0.000 -6.045) 7.951 6.754 ( 1.277 0.000 -1.152) 1.720 6.880 ( 1.285 0.000 -1.423) 1.917 7.283 ( -10.321 0.000 5.842) 11.860 7.867 ( 1.504 0.000 3.326) 3.651 7.990 ( -0.834 0.000 -0.508) 0.976 8.014 ( 1.983 0.000 -7.657) 7.910 8.191 ( -7.868 0.000 0.767) 7.905 8.624 ( 2.597 0.000 1.784) 3.151 9.261 ( -0.727 0.000 -1.769) 1.913 9.328 ( 1.654 0.000 -2.553) 3.042 ======================= Grid point 438 (245/309) ======================= q-point: (-0.24 0.00 0.42) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.125 ( -13.296 0.000 2.188) 13.475 1.316 ( -9.985 0.000 6.725) 12.039 1.647 ( -1.766 0.000 0.265) 1.786 1.728 ( -1.107 0.000 -1.598) 1.944 1.954 ( -9.710 0.000 5.473) 11.146 2.179 ( 0.788 0.000 3.795) 3.876 2.411 ( -14.816 0.000 9.847) 17.790 2.595 ( -16.910 0.000 -1.873) 17.013 2.799 ( -7.937 0.000 -3.137) 8.535 3.057 ( -2.020 0.000 -1.550) 2.546 4.673 ( -4.513 0.000 -1.046) 4.632 4.750 ( -1.738 0.000 1.206) 2.116 5.760 ( -1.394 0.000 -2.744) 3.077 6.352 ( -1.072 0.000 -2.634) 2.843 6.766 ( 2.469 0.000 -1.242) 2.764 6.886 ( 2.699 0.000 -2.341) 3.573 7.213 ( -11.675 0.000 7.864) 14.077 7.876 ( -4.703 0.000 -9.063) 10.210 7.906 ( -1.946 0.000 0.899) 2.143 7.969 ( -1.544 0.000 1.382) 2.072 8.090 ( -7.157 0.000 1.721) 7.361 8.705 ( 5.349 0.000 0.552) 5.378 9.218 ( -1.300 0.000 -2.175) 2.534 9.315 ( 2.140 0.000 -3.447) 4.058 ======================= Grid point 439 (246/309) ======================= q-point: (-0.18 0.00 0.42) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.007 ( -8.925 0.000 6.015) 10.763 1.315 ( -5.591 0.000 9.702) 11.197 1.605 ( -2.297 0.000 -1.908) 2.986 1.706 ( -0.984 0.000 1.047) 1.437 1.860 ( -13.893 0.000 6.480) 15.330 2.111 ( -10.561 0.000 -2.335) 10.816 2.276 ( -19.563 0.000 7.791) 21.057 2.375 ( -13.016 0.000 1.719) 13.129 2.743 ( 1.889 0.000 2.330) 3.000 3.010 ( -0.134 0.000 -2.944) 2.947 4.652 ( 0.237 0.000 2.889) 2.899 4.776 ( 0.747 0.000 3.489) 3.568 5.864 ( 11.171 0.000 7.128) 13.251 6.368 ( 3.403 0.000 2.446) 4.191 6.791 ( 3.234 0.000 -1.436) 3.538 6.892 ( 3.088 0.000 -3.082) 4.363 7.150 ( -12.059 0.000 8.999) 15.047 7.647 ( -10.527 0.000 -7.032) 12.659 7.844 ( -4.339 0.000 -1.501) 4.591 7.916 ( -6.985 0.000 -0.727) 7.022 8.086 ( -1.235 0.000 6.203) 6.325 8.777 ( 5.404 0.000 -2.340) 5.888 9.168 ( -1.254 0.000 -2.080) 2.428 9.302 ( 2.589 0.000 -3.550) 4.394 ======================= Grid point 440 (247/309) ======================= q-point: (-0.12 0.00 0.42) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.050 ( -0.710 0.000 10.787) 10.810 1.390 ( -2.084 0.000 8.741) 8.986 1.527 ( -2.281 0.000 -4.548) 5.088 1.717 ( -13.934 0.000 4.194) 14.552 1.732 ( 0.613 0.000 2.461) 2.536 1.912 ( -10.109 0.000 -1.334) 10.197 2.109 ( -18.601 0.000 12.317) 22.309 2.221 ( -11.086 0.000 2.288) 11.319 2.853 ( 4.678 0.000 3.871) 6.072 2.974 ( 1.007 0.000 -3.252) 3.404 4.742 ( 3.258 0.000 5.390) 6.298 4.857 ( 2.124 0.000 4.730) 5.185 6.234 ( 18.889 0.000 11.416) 22.071 6.508 ( 6.930 0.000 5.992) 9.161 6.820 ( 3.332 0.000 -1.604) 3.698 6.895 ( 2.758 0.000 -2.774) 3.911 7.102 ( -11.194 0.000 9.544) 14.711 7.395 ( -13.630 0.000 -2.620) 13.879 7.751 ( -4.480 0.000 -2.500) 5.130 7.782 ( -7.889 0.000 -1.881) 8.110 8.170 ( -0.131 0.000 6.902) 6.903 8.794 ( 3.349 0.000 -4.924) 5.955 9.136 ( 0.122 0.000 -0.958) 0.966 9.295 ( 2.449 0.000 -3.015) 3.884 ======================= Grid point 441 (248/309) ======================= q-point: (-0.06 0.00 0.42) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 306 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.236 ( 3.891 0.000 10.391) 11.095 1.455 ( -0.156 0.000 -0.249) 0.293 1.472 ( -0.581 0.000 5.854) 5.883 1.607 ( -7.581 0.000 3.408) 8.312 1.711 ( -4.602 0.000 -2.000) 5.018 1.839 ( 0.717 0.000 -0.653) 0.970 2.080 ( -10.251 0.000 14.638) 17.870 2.135 ( -6.974 0.000 6.509) 9.540 2.945 ( 2.350 0.000 1.337) 2.704 2.951 ( 1.357 0.000 -2.800) 3.112 4.865 ( 2.724 0.000 5.315) 5.972 4.950 ( 1.654 0.000 4.108) 4.428 6.658 ( 15.385 0.000 7.736) 17.221 6.711 ( 10.338 0.000 6.346) 12.131 6.844 ( 2.575 0.000 -1.465) 2.963 6.900 ( 1.640 0.000 -1.323) 2.107 7.085 ( -8.180 0.000 8.987) 12.153 7.195 ( -13.099 0.000 4.508) 13.853 7.624 ( -6.901 0.000 -3.747) 7.853 7.657 ( -3.237 0.000 -3.961) 5.115 8.265 ( 0.117 0.000 7.042) 7.043 8.745 ( 0.991 0.000 -6.636) 6.709 9.148 ( 1.671 0.000 0.597) 1.775 9.287 ( 1.193 0.000 -2.462) 2.736 ======================= Grid point 442 (249/309) ======================= q-point: ( 0.00 0.20 0.42) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 510 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.415 ( 3.660 0.467 7.062) 7.968 1.492 ( -0.127 -0.279 6.749) 6.756 1.510 ( -3.446 -1.210 7.179) 8.054 1.643 ( -1.325 3.260 -2.741) 4.461 1.668 ( 3.185 4.065 -0.493) 5.188 1.797 ( 1.526 -1.539 -5.320) 5.745 2.017 ( -0.723 -5.468 11.554) 12.803 2.324 ( 0.934 1.019 -1.538) 2.068 2.898 ( -0.714 3.777 5.774) 6.937 3.084 ( 0.336 6.596 -2.010) 6.904 4.896 ( 0.577 -5.622 3.466) 6.629 4.933 ( -0.267 -6.610 1.939) 6.894 6.771 ( -0.193 -1.002 2.832) 3.010 6.853 ( 0.361 -1.645 -2.032) 2.639 6.887 ( -0.964 0.846 1.702) 2.131 6.947 ( -0.654 0.116 -0.778) 1.023 7.132 ( 3.574 0.856 11.899) 12.453 7.218 ( 0.538 -1.282 11.475) 11.559 7.478 ( -3.641 0.831 -6.078) 7.134 7.552 ( -0.537 -1.025 -5.912) 6.024 8.429 ( 0.356 6.355 5.624) 8.494 8.671 ( -0.336 1.483 -6.525) 6.700 9.155 ( 1.414 -3.106 1.461) 3.712 9.224 ( -0.896 -3.326 -2.378) 4.186 ======================= Grid point 443 (250/309) ======================= q-point: ( 0.06 0.20 0.42) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 510 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.442 ( -6.047 2.502 -0.078) 6.544 1.506 ( -0.601 -0.856 1.082) 1.504 1.589 ( -0.449 0.595 6.671) 6.712 1.674 ( 2.611 2.920 -3.578) 5.306 1.743 ( 9.513 2.678 0.529) 9.897 1.769 ( 6.283 0.494 -3.870) 7.395 2.207 ( 5.460 -6.685 8.695) 12.252 2.312 ( 5.161 -4.733 -6.312) 9.428 2.957 ( -2.249 7.269 5.526) 9.404 3.035 ( -0.982 7.846 -3.922) 8.827 4.920 ( -2.407 -6.480 0.202) 6.916 4.925 ( -1.869 -6.141 1.118) 6.515 6.751 ( -6.475 -1.352 1.726) 6.836 6.784 ( -5.445 -1.989 -1.813) 6.074 6.845 ( -7.473 1.425 1.039) 7.678 6.883 ( -6.042 0.932 1.270) 6.244 7.363 ( 2.952 0.561 -5.317) 6.107 7.390 ( 9.351 -0.225 8.046) 12.338 7.423 ( 5.412 0.204 6.688) 8.606 7.486 ( 3.887 -1.117 -6.829) 7.936 8.514 ( 0.256 4.591 5.982) 7.545 8.577 ( -0.314 3.003 -6.217) 6.911 9.163 ( -2.903 -3.241 -2.131) 4.844 9.182 ( -0.654 -3.466 1.392) 3.791 ======================= Grid point 444 (251/309) ======================= q-point: ( 0.12 0.20 -0.58) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 510 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.360 ( 0.250 1.911 -3.534) 4.026 1.491 ( -0.057 -2.390 -4.537) 5.128 1.622 ( 0.646 3.320 -2.298) 4.089 1.682 ( 0.851 -0.455 6.280) 6.353 1.848 ( 10.047 2.128 -3.172) 10.749 1.911 ( 9.953 1.917 0.190) 10.138 2.321 ( 8.418 -5.548 -6.770) 12.144 2.385 ( 6.305 -4.503 4.053) 8.744 2.934 ( -1.979 7.390 -4.023) 8.644 2.997 ( -2.694 7.314 2.498) 8.185 4.849 ( -4.279 -5.794 -2.334) 7.571 4.894 ( -3.612 -6.538 -0.319) 7.476 6.571 ( -14.212 -0.649 -5.160) 15.134 6.654 ( -8.455 -3.456 -2.984) 9.609 6.751 ( -7.035 1.618 2.811) 7.746 6.808 ( -7.336 1.245 2.714) 7.920 7.361 ( 7.165 1.196 -5.000) 8.819 7.473 ( 7.717 -1.638 -6.491) 10.216 7.609 ( 6.881 0.254 5.516) 8.823 7.629 ( 8.439 -0.111 6.351) 10.563 8.491 ( -0.070 4.879 -5.698) 7.502 8.597 ( -0.433 3.754 5.845) 6.960 9.089 ( -3.366 -3.626 -1.255) 5.104 9.175 ( -2.756 -3.828 1.447) 4.934 ======================= Grid point 445 (252/309) ======================= q-point: ( 0.18 0.20 -0.58) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 510 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.324 ( 4.685 0.090 -8.568) 9.766 1.467 ( 4.646 -2.145 -0.458) 5.137 1.629 ( 1.160 5.907 0.151) 6.022 1.784 ( 2.737 -0.036 4.052) 4.890 1.967 ( 10.568 0.702 -2.328) 10.845 2.043 ( 8.786 0.372 -1.043) 8.856 2.376 ( 8.327 -3.342 -3.461) 9.617 2.510 ( 6.012 -2.374 1.281) 6.590 2.853 ( 0.223 4.423 -5.370) 6.960 2.979 ( -3.047 6.212 1.729) 7.132 4.741 ( -4.589 -4.877 -3.176) 7.412 4.816 ( -4.348 -6.837 -1.813) 8.302 6.238 ( -15.636 1.519 -9.193) 18.202 6.459 ( -9.494 -5.156 -4.795) 11.820 6.705 ( -6.024 0.971 4.428) 7.539 6.747 ( -7.244 1.038 4.463) 8.571 7.420 ( 8.306 0.981 -4.163) 9.343 7.528 ( 8.862 -2.118 -3.792) 9.869 7.773 ( 6.673 1.088 3.820) 7.765 7.819 ( 6.846 -0.227 4.564) 8.231 8.417 ( 0.150 7.223 -5.225) 8.916 8.654 ( -2.163 3.867 4.979) 6.665 9.043 ( -1.812 -4.969 0.458) 5.308 9.149 ( -3.648 -4.054 2.183) 5.874 ======================= Grid point 446 (253/309) ======================= q-point: ( 0.24 0.20 -0.58) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 510 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.319 ( 8.806 2.989 -5.747) 10.932 1.547 ( 5.225 -1.038 -1.701) 5.592 1.662 ( 2.530 6.577 1.325) 7.170 1.853 ( 3.185 1.660 -0.955) 3.716 2.077 ( 7.006 -1.951 -2.111) 7.573 2.138 ( 3.859 -1.957 0.261) 4.335 2.482 ( 7.247 -1.956 2.325) 7.858 2.616 ( 6.610 -0.931 1.101) 6.765 2.802 ( 2.963 3.316 -4.822) 6.560 2.987 ( 1.037 3.504 2.381) 4.361 4.648 ( -2.438 -4.299 -1.941) 5.309 4.733 ( -3.131 -7.079 -1.571) 7.898 5.910 ( -10.751 3.665 -7.687) 13.715 6.275 ( -7.023 -6.916 -2.922) 10.281 6.686 ( -5.064 1.045 4.583) 6.910 6.718 ( -6.298 0.542 6.280) 8.910 7.481 ( 8.032 1.116 -4.910) 9.480 7.622 ( 7.386 -3.574 -0.769) 8.241 7.908 ( 5.626 1.634 2.000) 6.190 7.954 ( 4.211 -0.267 3.073) 5.220 8.355 ( 0.404 9.949 -4.086) 10.763 8.669 ( -3.537 4.614 3.741) 6.913 9.049 ( 0.055 -6.428 2.067) 6.753 9.135 ( -3.080 -4.379 3.313) 6.296 ======================= Grid point 447 (254/309) ======================= q-point: ( 0.29 0.20 -0.58) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 510 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.417 ( 10.530 4.955 -2.265) 11.856 1.575 ( 4.016 2.695 -2.733) 5.555 1.722 ( 2.645 3.794 0.365) 4.639 1.860 ( 3.354 2.165 -4.107) 5.728 2.090 ( -1.450 -3.604 -1.820) 4.290 2.139 ( -2.563 -2.517 -1.878) 4.053 2.631 ( 5.212 -1.095 3.986) 6.652 2.758 ( 7.747 1.234 4.279) 8.936 2.842 ( 7.835 1.554 -0.286) 7.993 3.067 ( 4.540 1.566 2.715) 5.517 4.635 ( 1.414 -4.752 1.379) 5.146 4.695 ( -0.497 -6.869 0.331) 6.895 5.764 ( -0.493 4.790 -0.088) 4.816 6.197 ( -1.763 -7.747 1.886) 8.166 6.677 ( -4.662 1.715 4.856) 6.947 6.729 ( -4.383 -0.088 6.672) 7.984 7.524 ( 7.024 1.392 -5.183) 8.839 7.713 ( 4.640 -5.247 0.594) 7.029 7.980 ( 2.622 0.841 -0.925) 2.905 8.019 ( 0.324 0.085 1.028) 1.081 8.340 ( 2.614 12.315 -0.538) 12.601 8.659 ( -3.466 5.578 2.663) 7.086 9.091 ( 0.739 -6.828 2.869) 7.443 9.147 ( -2.078 -4.991 3.911) 6.673 ======================= Grid point 448 (255/309) ======================= q-point: ( 0.35 0.20 -0.58) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 510 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.537 ( 7.926 2.841 -1.145) 8.497 1.618 ( 5.728 2.561 -1.858) 6.544 1.734 ( -0.313 2.965 -0.685) 3.059 1.866 ( 4.552 1.800 -3.329) 5.919 2.006 ( -7.153 -2.343 -0.312) 7.534 2.047 ( -2.675 -0.568 -3.805) 4.686 2.724 ( 2.517 0.888 2.528) 3.676 2.946 ( 5.986 4.837 7.640) 10.844 3.003 ( 9.214 -4.383 2.232) 10.445 3.195 ( 6.810 2.172 3.641) 8.022 4.708 ( 2.691 -6.163 3.463) 7.565 4.727 ( 2.023 -6.232 2.638) 7.063 5.891 ( 8.831 4.161 8.034) 12.643 6.278 ( 3.965 -7.066 7.100) 10.773 6.682 ( -3.887 2.352 5.304) 6.984 6.764 ( -2.780 -0.311 6.195) 6.798 7.550 ( 5.803 1.531 -4.906) 7.751 7.771 ( 1.760 -6.146 0.842) 6.449 7.951 ( -1.599 0.706 -3.942) 4.312 8.010 ( -2.010 0.182 0.152) 2.024 8.413 ( 4.649 12.020 2.165) 13.068 8.643 ( -2.664 6.684 1.909) 7.444 9.140 ( 0.326 -6.191 2.915) 6.851 9.176 ( -1.147 -5.684 3.852) 6.962 ======================= Grid point 449 (256/309) ======================= q-point: ( 0.41 0.20 -0.58) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 510 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.631 ( 5.591 0.013 0.081) 5.592 1.646 ( 2.086 0.074 -2.576) 3.316 1.736 ( 0.932 2.931 0.833) 3.186 1.881 ( -4.784 -1.790 0.810) 5.172 1.909 ( 1.770 3.055 -2.946) 4.598 1.984 ( -0.472 2.812 -1.747) 3.344 2.818 ( 3.822 1.140 4.879) 6.301 3.120 ( 3.897 5.640 4.998) 8.484 3.138 ( 4.512 -5.524 4.105) 8.230 3.349 ( 6.243 3.243 3.301) 7.771 4.790 ( 2.197 -7.001 3.426) 8.098 4.811 ( 2.160 -6.604 3.691) 7.868 6.189 ( 11.812 2.999 10.887) 16.341 6.481 ( 6.636 -5.496 9.624) 12.918 6.703 ( -3.389 2.819 5.406) 6.975 6.812 ( -1.805 -0.406 5.609) 5.907 7.567 ( 4.922 1.476 -4.155) 6.608 7.786 ( -1.124 -4.754 0.071) 4.885 7.856 ( -2.819 0.106 -3.672) 4.631 7.968 ( -2.882 -1.660 -0.707) 3.400 8.513 ( 4.437 10.993 2.039) 12.029 8.632 ( -2.099 7.693 1.576) 8.129 9.177 ( -0.508 -5.522 2.839) 6.230 9.215 ( -0.164 -5.734 3.086) 6.514 ======================= Grid point 450 (257/309) ======================= q-point: ( 0.47 0.20 -0.58) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 510 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.643 ( 1.561 1.309 -0.031) 2.037 1.707 ( 1.747 0.308 0.514) 1.847 1.762 ( 2.265 -0.123 0.207) 2.278 1.793 ( -6.090 -0.415 0.719) 6.146 1.921 ( 0.642 2.972 -0.571) 3.094 1.979 ( 2.460 4.328 -2.027) 5.375 2.957 ( 3.370 -0.688 6.541) 7.391 3.179 ( 1.233 -2.299 -0.494) 2.655 3.262 ( 0.263 3.906 7.089) 8.098 3.442 ( 2.208 4.050 0.730) 4.670 4.860 ( 0.991 -7.501 2.957) 8.124 4.877 ( 0.788 -7.028 2.616) 7.541 6.490 ( 9.099 2.158 9.020) 12.993 6.682 ( 0.504 -1.024 6.836) 6.931 6.732 ( -0.103 0.214 5.902) 5.907 6.855 ( -2.050 -0.697 4.432) 4.933 7.590 ( 4.814 1.349 -2.790) 5.725 7.707 ( -4.935 1.310 -3.349) 6.106 7.820 ( 0.190 -5.156 0.233) 5.165 7.913 ( -2.380 -3.783 -1.196) 4.627 8.590 ( 1.866 9.515 1.481) 9.809 8.624 ( -0.826 9.035 0.952) 9.123 9.208 ( -0.340 -5.173 2.713) 5.851 9.249 ( 0.123 -5.247 1.766) 5.537 ======================= Grid point 451 (258/309) ======================= q-point: (-0.47 0.20 0.42) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 510 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.676 ( -3.832 0.732 -0.990) 4.025 1.684 ( 0.228 0.595 2.174) 2.266 1.743 ( -1.693 1.292 1.147) 2.419 1.812 ( 3.874 0.300 -0.972) 4.005 1.900 ( -3.531 3.604 0.352) 5.058 1.985 ( 2.032 2.758 -2.101) 4.018 3.054 ( -2.875 -2.375 4.555) 5.886 3.154 ( -1.116 -2.643 -1.922) 3.453 3.331 ( -2.893 5.163 5.790) 8.280 3.439 ( -1.576 4.957 -1.480) 5.408 4.890 ( -1.363 -7.475 1.636) 7.772 4.906 ( -0.365 -7.351 1.106) 7.443 6.642 ( -6.758 2.023 3.409) 7.835 6.702 ( 3.117 2.801 3.275) 5.318 6.831 ( -2.573 -2.778 4.448) 5.842 6.869 ( -0.494 -1.151 2.144) 2.484 7.586 ( -5.409 1.947 -2.704) 6.353 7.641 ( 5.256 1.369 -0.802) 5.490 7.846 ( 1.472 -5.232 1.382) 5.608 7.874 ( -0.125 -5.985 -1.354) 6.137 8.586 ( -3.334 10.249 1.398) 10.868 8.652 ( 2.312 8.771 -0.302) 9.076 9.241 ( 0.278 -4.997 2.029) 5.401 9.265 ( 0.109 -4.869 0.256) 4.877 ======================= Grid point 452 (259/309) ======================= q-point: (-0.41 0.20 0.42) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 510 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.603 ( -4.474 0.161 -0.320) 4.489 1.649 ( -6.230 -1.313 0.800) 6.417 1.784 ( 2.656 2.085 0.624) 3.433 1.808 ( -5.447 6.216 -0.291) 8.270 1.866 ( 1.833 -0.309 0.272) 1.879 1.983 ( 1.052 1.355 -1.299) 2.151 2.952 ( -11.123 0.722 -1.408) 11.235 3.128 ( -2.914 -5.420 0.432) 6.169 3.312 ( -7.394 4.568 1.413) 8.806 3.378 ( -3.886 5.498 -0.618) 6.761 4.866 ( -3.151 -7.131 -0.093) 7.797 4.893 ( -2.287 -7.335 -0.237) 7.687 6.500 ( -11.600 2.956 -2.258) 12.182 6.737 ( -5.336 -2.576 -0.853) 5.987 6.793 ( -1.028 1.007 0.210) 1.454 6.892 ( -0.673 -0.993 0.969) 1.542 7.477 ( -6.163 2.431 -0.424) 6.639 7.721 ( 4.906 1.485 1.044) 5.231 7.857 ( 0.809 -9.519 -1.062) 9.612 7.909 ( 2.836 -3.870 1.591) 5.055 8.548 ( -3.282 12.776 0.443) 13.198 8.667 ( 0.738 7.847 -0.646) 7.908 9.260 ( -0.120 -4.835 -0.931) 4.926 9.268 ( 0.802 -5.153 0.598) 5.250 ======================= Grid point 453 (260/309) ======================= q-point: (-0.35 0.20 0.42) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 510 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.510 ( -9.520 1.215 0.543) 9.613 1.560 ( -6.304 -1.222 0.831) 6.475 1.712 ( -7.072 5.919 1.675) 9.373 1.798 ( 0.919 0.407 -1.864) 2.118 1.926 ( 2.493 -0.909 2.201) 3.447 1.992 ( 1.620 0.669 0.209) 1.766 2.742 ( -14.310 3.420 -0.213) 14.715 3.057 ( -6.574 -6.100 -0.377) 8.976 3.160 ( -11.566 3.797 -2.301) 12.388 3.289 ( -7.258 4.359 -0.850) 8.509 4.800 ( -4.202 -6.680 -1.197) 7.982 4.831 ( -4.307 -6.710 -1.515) 8.116 6.254 ( -12.485 3.416 -6.658) 14.556 6.575 ( -8.155 -5.769 -5.550) 11.428 6.790 ( 0.290 2.451 -0.839) 2.607 6.883 ( -0.495 -0.639 -0.489) 0.945 7.389 ( -7.841 2.950 2.635) 8.782 7.802 ( 2.699 -0.168 1.602) 3.143 7.851 ( 0.499 -10.120 -1.127) 10.195 7.970 ( 1.926 -3.249 1.781) 4.176 8.497 ( -2.566 15.133 -1.888) 15.465 8.667 ( 0.129 7.443 0.363) 7.453 9.237 ( -0.629 -5.330 -1.594) 5.599 9.280 ( 1.253 -5.422 -1.055) 5.664 ======================= Grid point 454 (261/309) ======================= q-point: (-0.29 0.20 0.42) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 510 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.357 ( -12.071 4.264 1.548) 12.895 1.465 ( -9.359 3.035 2.850) 10.244 1.659 ( -4.922 1.358 2.796) 5.821 1.783 ( 0.785 1.288 -1.667) 2.248 1.962 ( -2.293 -2.550 2.520) 4.256 2.052 ( 3.178 -1.597 2.863) 4.565 2.555 ( -14.363 4.811 5.128) 15.992 2.914 ( -15.377 1.848 -3.296) 15.834 2.924 ( -9.463 -3.993 -2.096) 10.483 3.156 ( -7.339 1.844 -1.194) 7.661 4.720 ( -4.231 -6.227 -1.301) 7.640 4.731 ( -5.077 -5.627 -1.810) 7.791 5.979 ( -9.517 4.276 -7.913) 13.094 6.382 ( -5.810 -7.338 -6.183) 11.218 6.785 ( 1.199 2.418 -1.272) 2.984 6.874 ( 1.086 -0.660 -1.326) 1.837 7.312 ( -9.826 3.199 5.333) 11.629 7.785 ( -3.163 -12.047 -2.068) 12.626 7.885 ( 1.136 0.739 2.473) 2.820 8.004 ( -0.409 -2.436 1.312) 2.797 8.412 ( -3.267 16.199 -4.138) 17.035 8.696 ( 2.340 7.058 1.251) 7.540 9.197 ( -1.343 -6.372 -2.051) 6.827 9.279 ( 1.833 -5.265 -2.325) 6.040 ======================= Grid point 455 (262/309) ======================= q-point: (-0.24 0.20 0.42) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 510 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.196 ( -12.877 6.790 2.157) 14.717 1.393 ( -8.006 6.140 6.290) 11.889 1.615 ( -5.414 -1.762 2.118) 6.075 1.779 ( 0.754 4.419 -0.972) 4.587 1.929 ( -8.283 -2.785 4.630) 9.890 2.128 ( -0.678 -4.859 3.225) 5.871 2.445 ( -13.518 3.487 7.317) 15.762 2.631 ( -16.485 3.674 -1.353) 16.943 2.745 ( -8.580 -4.160 -2.539) 9.867 3.062 ( -3.942 -0.652 -0.352) 4.011 4.628 ( -3.917 -4.195 -0.756) 5.788 4.679 ( -1.775 -6.522 0.866) 6.814 5.811 ( -1.295 5.112 -2.667) 5.909 6.266 ( -1.049 -7.951 -2.493) 8.398 6.793 ( 2.358 2.200 -1.370) 3.504 6.878 ( 2.467 -0.771 -2.120) 3.343 7.240 ( -11.321 2.991 7.172) 13.732 7.680 ( -6.780 -11.863 -2.370) 13.868 7.913 ( -1.696 0.487 1.479) 2.302 7.987 ( -3.726 -1.425 0.594) 4.033 8.306 ( -3.477 17.040 -2.907) 17.633 8.760 ( 4.660 5.474 -0.148) 7.190 9.144 ( -1.729 -7.249 -2.199) 7.770 9.273 ( 2.434 -4.637 -3.151) 6.112 ======================= Grid point 456 (263/309) ======================= q-point: (-0.18 0.20 0.42) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 510 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.056 ( -10.625 5.605 4.524) 12.836 1.385 ( -5.967 3.574 6.690) 9.650 1.566 ( -5.954 -1.274 3.450) 6.998 1.768 ( -1.088 5.706 -0.301) 5.816 1.855 ( -10.241 -1.505 4.680) 11.360 2.054 ( -11.152 -4.433 -0.375) 12.007 2.303 ( -15.534 1.743 3.240) 15.964 2.425 ( -13.095 4.979 3.626) 14.471 2.675 ( 0.025 -4.621 2.341) 5.180 3.022 ( -0.996 -0.410 -0.108) 1.083 4.615 ( 0.455 -3.426 2.845) 4.476 4.702 ( 0.990 -6.811 3.272) 7.621 5.904 ( 10.101 4.108 6.560) 12.725 6.293 ( 4.182 -6.946 2.966) 8.633 6.815 ( 3.066 1.950 -1.435) 3.907 6.886 ( 2.972 -0.620 -2.720) 4.076 7.171 ( -11.905 2.295 8.205) 14.639 7.521 ( -10.411 -9.296 -1.848) 14.079 7.865 ( -4.692 0.739 -1.128) 4.882 7.907 ( -6.828 -0.884 -0.637) 6.914 8.259 ( -1.400 15.195 1.554) 15.338 8.814 ( 4.612 3.474 -2.682) 6.367 9.095 ( -1.027 -6.824 -1.597) 7.084 9.267 ( 2.823 -3.958 -3.446) 5.959 ======================= Grid point 457 (264/309) ======================= q-point: (-0.12 0.20 0.42) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 510 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.049 ( -2.331 1.391 9.607) 9.983 1.378 ( -4.081 -3.588 3.301) 6.358 1.533 ( -7.581 0.838 6.062) 9.743 1.717 ( -9.715 0.848 3.470) 10.351 1.780 ( -1.280 3.207 0.007) 3.453 1.873 ( -10.682 -1.741 -0.389) 10.830 2.114 ( -14.197 1.352 3.507) 14.686 2.332 ( -8.527 8.300 6.163) 13.401 2.750 ( 2.428 -5.516 3.721) 7.083 3.033 ( 1.530 2.121 1.047) 2.818 4.702 ( 3.173 -3.735 4.894) 6.926 4.785 ( 2.397 -6.683 4.589) 8.454 6.246 ( 17.283 1.313 10.962) 20.509 6.457 ( 8.130 -4.624 6.615) 11.456 6.843 ( 3.178 1.815 -1.399) 3.918 6.893 ( 2.738 -0.210 -2.423) 3.662 7.113 ( -11.330 1.227 8.871) 14.442 7.332 ( -12.871 -5.446 0.299) 13.979 7.760 ( -5.472 0.523 -2.649) 6.102 7.780 ( -7.512 -0.316 -1.887) 7.752 8.290 ( -0.233 11.515 4.091) 12.223 8.815 ( 2.419 1.469 -4.915) 5.672 9.080 ( 0.944 -4.787 -0.303) 4.888 9.263 ( 2.585 -3.567 -3.117) 5.397 ======================= Grid point 458 (265/309) ======================= q-point: (-0.06 0.20 0.42) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 510 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.221 ( 4.951 -0.619 10.079) 11.246 1.390 ( 0.596 -3.786 4.250) 5.723 1.503 ( -8.166 0.356 7.438) 11.051 1.653 ( -5.254 1.441 4.257) 6.914 1.734 ( -5.698 1.293 -1.687) 6.082 1.799 ( 2.148 -1.091 0.220) 2.420 1.989 ( -10.284 0.044 5.330) 11.583 2.321 ( -3.470 7.680 4.344) 9.481 2.828 ( 0.959 -2.039 4.236) 4.798 3.076 ( 1.871 4.591 0.491) 4.982 4.815 ( 2.633 -4.696 4.617) 7.092 4.880 ( 1.756 -6.607 4.014) 7.927 6.634 ( 12.744 -1.763 7.339) 14.811 6.690 ( 12.203 -1.887 6.617) 14.009 6.870 ( 2.771 1.927 -1.462) 3.678 6.905 ( 1.879 0.426 -0.502) 1.991 7.085 ( -8.648 0.056 8.948) 12.444 7.172 ( -12.296 -2.242 5.687) 13.732 7.626 ( -6.618 0.148 -3.759) 7.612 7.653 ( -3.814 -0.412 -3.993) 5.537 8.352 ( 0.145 8.630 5.008) 9.979 8.758 ( 0.463 0.743 -6.145) 6.208 9.110 ( 2.138 -3.272 0.892) 4.009 9.254 ( 1.283 -3.440 -2.611) 4.506 ======================= Grid point 459 (266/309) ======================= q-point: ( 0.00 0.40 0.42) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 510 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.430 ( 1.765 1.216 7.047) 7.366 1.460 ( 0.020 -2.013 6.849) 7.139 1.553 ( -1.372 4.491 11.005) 11.965 1.649 ( 0.230 -4.632 9.617) 10.677 1.706 ( 0.914 2.775 -3.394) 4.478 1.758 ( 1.431 -2.586 -4.682) 5.537 2.058 ( -0.343 8.317 -0.300) 8.329 2.233 ( 0.342 -8.785 -5.253) 10.242 3.048 ( -0.297 9.080 6.969) 11.450 3.149 ( 0.220 -0.682 2.078) 2.198 4.797 ( 0.432 -3.311 2.307) 4.058 4.812 ( 0.053 -4.784 1.824) 5.120 6.772 ( 0.264 1.198 2.539) 2.820 6.809 ( 0.382 -2.506 0.802) 2.659 6.911 ( -0.965 1.304 0.242) 1.640 6.935 ( -1.176 -1.164 -0.276) 1.678 7.155 ( 2.429 1.564 11.635) 11.988 7.188 ( 1.247 -1.819 11.440) 11.651 7.499 ( -2.509 1.402 -5.895) 6.558 7.527 ( -1.352 -1.531 -5.864) 6.210 8.571 ( 0.380 7.762 1.844) 7.987 8.674 ( -0.150 -2.358 -3.193) 3.972 9.110 ( 0.799 -0.540 0.222) 0.990 9.149 ( -0.386 -3.987 -1.899) 4.433 ======================= Grid point 460 (267/309) ======================= q-point: ( 0.06 0.40 0.42) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 510 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.476 ( -4.181 0.984 3.604) 5.607 1.491 ( -2.518 -0.797 1.982) 3.302 1.630 ( -1.738 3.293 1.222) 3.919 1.684 ( -0.506 -1.896 -3.999) 4.454 1.783 ( 9.685 3.111 1.820) 10.334 1.817 ( 9.383 1.203 -0.143) 9.460 2.124 ( 5.383 -0.588 4.106) 6.796 2.194 ( 5.091 -6.505 -5.132) 9.724 3.107 ( -1.810 6.585 3.772) 7.802 3.147 ( -1.214 2.721 -1.089) 3.173 4.805 ( -2.100 -4.012 0.275) 4.537 4.811 ( -1.757 -4.449 0.488) 4.808 6.739 ( -7.084 0.095 0.803) 7.130 6.752 ( -6.749 -1.267 -0.701) 6.903 6.868 ( -6.317 1.037 1.179) 6.509 6.884 ( -5.702 -0.599 1.377) 5.897 7.373 ( 5.240 0.523 0.741) 5.318 7.383 ( 7.824 -0.486 6.012) 9.879 7.434 ( 4.747 1.068 0.651) 4.909 7.460 ( 4.100 -1.515 -4.695) 6.415 8.608 ( 0.632 4.219 2.242) 4.819 8.632 ( 0.281 1.727 -2.810) 3.310 9.102 ( -2.699 -2.236 -1.389) 3.770 9.111 ( -1.526 -3.106 0.549) 3.504 ======================= Grid point 461 (268/309) ======================= q-point: ( 0.12 0.40 -0.58) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 510 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.403 ( -0.004 2.516 -6.031) 6.534 1.449 ( -0.331 -2.301 -5.464) 5.938 1.658 ( -0.448 0.852 2.980) 3.131 1.670 ( -0.269 -0.675 6.217) 6.259 1.909 ( 10.603 3.833 -4.558) 12.161 1.950 ( 10.157 0.651 -2.694) 10.528 2.242 ( 8.593 -1.293 -2.314) 8.993 2.288 ( 7.382 -4.996 3.258) 9.491 3.076 ( -2.574 5.978 -3.351) 7.321 3.108 ( -2.896 2.945 0.144) 4.132 4.750 ( -3.823 -3.173 -1.555) 5.206 4.769 ( -3.549 -5.105 -0.910) 6.284 6.569 ( -12.480 0.664 -4.146) 13.168 6.598 ( -10.532 -2.346 -3.380) 11.307 6.784 ( -7.455 1.729 2.655) 8.100 6.810 ( -7.359 -0.910 2.653) 7.875 7.392 ( 7.515 2.050 -5.737) 9.674 7.434 ( 7.707 -2.353 -6.326) 10.245 7.616 ( 7.600 0.465 5.757) 9.545 7.625 ( 8.201 -0.412 5.973) 10.154 8.600 ( 0.673 5.808 -2.372) 6.309 8.656 ( 0.965 0.844 2.574) 2.876 9.033 ( -4.266 -0.779 -0.684) 4.390 9.084 ( -3.547 -5.086 1.136) 6.304 ======================= Grid point 462 (269/309) ======================= q-point: ( 0.18 0.40 -0.58) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 510 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.354 ( 5.323 2.868 -6.314) 8.743 1.415 ( 5.403 -3.273 -3.044) 7.012 1.720 ( 0.340 3.541 5.058) 6.183 1.769 ( 1.365 -1.743 6.224) 6.606 1.997 ( 10.274 2.519 -5.474) 11.911 2.041 ( 9.388 -1.340 -4.959) 10.701 2.353 ( 8.988 1.853 -0.908) 9.222 2.430 ( 7.514 -5.233 1.298) 9.248 2.981 ( -1.728 7.084 -4.952) 8.814 3.051 ( -3.236 0.383 -1.062) 3.428 4.659 ( -4.332 -2.443 -2.348) 5.500 4.687 ( -4.328 -5.355 -2.084) 7.194 6.283 ( -13.769 3.327 -7.539) 16.047 6.361 ( -11.579 -4.927 -5.887) 13.893 6.727 ( -6.738 1.344 4.521) 8.224 6.749 ( -7.061 -0.795 4.314) 8.313 7.446 ( 8.678 1.785 -4.654) 10.008 7.485 ( 8.834 -2.323 -4.691) 10.268 7.793 ( 7.110 0.985 4.032) 8.233 7.810 ( 7.148 -0.745 4.161) 8.305 8.584 ( 1.106 9.478 -1.941) 9.738 8.705 ( 0.804 -1.164 2.547) 2.913 8.966 ( -4.425 -0.488 0.640) 4.498 9.045 ( -4.456 -6.469 2.170) 8.150 ======================= Grid point 463 (270/309) ======================= q-point: ( 0.24 0.40 -0.58) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 510 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.406 ( 9.070 5.557 -2.472) 10.920 1.499 ( 7.831 -3.958 -0.935) 8.824 1.784 ( -0.096 5.603 3.622) 6.672 1.859 ( 0.808 -1.915 3.766) 4.302 2.055 ( 7.305 0.441 -6.081) 9.515 2.091 ( 5.871 -2.774 -4.712) 8.023 2.487 ( 8.413 2.494 1.714) 8.940 2.557 ( 8.082 -4.266 0.739) 9.168 2.918 ( 1.396 7.337 -3.035) 8.062 3.013 ( -0.179 -1.786 0.217) 1.808 4.574 ( -2.789 -2.202 -1.476) 3.848 4.602 ( -3.006 -5.245 -1.584) 6.250 6.004 ( -9.565 6.144 -5.933) 12.823 6.134 ( -8.267 -7.586 -4.172) 11.970 6.704 ( -5.630 0.927 5.410) 7.863 6.719 ( -6.081 -0.548 5.636) 8.310 7.511 ( 8.108 2.089 -4.420) 9.468 7.559 ( 7.810 -3.029 -3.061) 8.918 7.930 ( 5.354 0.866 1.883) 5.741 7.944 ( 4.831 -0.723 2.221) 5.366 8.582 ( 1.453 12.807 -0.909) 12.921 8.747 ( 0.195 -0.478 2.415) 2.469 8.927 ( -3.037 -2.432 2.122) 4.432 9.018 ( -4.064 -7.555 3.359) 9.213 ======================= Grid point 464 (271/309) ======================= q-point: ( 0.29 0.40 -0.58) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 510 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.522 ( 8.484 5.356 -1.002) 10.083 1.589 ( 5.997 -1.424 -1.467) 6.336 1.813 ( -0.851 5.054 1.591) 5.366 1.883 ( -0.717 -1.335 0.064) 1.516 2.041 ( 2.069 -0.281 -5.414) 5.803 2.079 ( 1.649 -3.337 -5.387) 6.548 2.646 ( 7.014 2.520 3.883) 8.404 2.711 ( 8.948 -3.913 3.272) 10.300 2.951 ( 4.981 7.431 0.921) 8.993 3.059 ( 3.850 -3.181 2.432) 5.555 4.553 ( 0.320 -2.711 1.178) 2.973 4.571 ( -0.100 -4.774 0.696) 4.825 5.882 ( -0.902 7.515 0.627) 7.595 6.037 ( -1.399 -8.815 1.377) 9.031 6.703 ( -4.543 1.167 5.633) 7.330 6.722 ( -4.528 -0.755 6.240) 7.746 7.563 ( 6.662 2.716 -4.230) 8.346 7.626 ( 5.762 -4.034 -2.186) 7.366 7.992 ( 2.008 0.672 -0.935) 2.315 8.008 ( 1.414 -0.922 0.031) 1.689 8.611 ( 2.368 14.800 1.075) 15.027 8.775 ( -0.708 3.359 2.198) 4.076 8.937 ( -0.755 -6.360 3.381) 7.242 9.015 ( -3.092 -8.408 4.014) 9.817 ======================= Grid point 465 (272/309) ======================= q-point: ( 0.35 0.40 -0.58) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 510 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.600 ( 4.279 3.300 -1.634) 5.646 1.639 ( 4.175 -0.563 -2.416) 4.857 1.802 ( -2.407 3.950 0.995) 4.732 1.869 ( -1.517 -2.502 0.578) 2.983 1.991 ( 0.941 1.477 -4.210) 4.560 2.028 ( 2.151 -1.622 -4.679) 5.399 2.776 ( 3.888 4.664 3.375) 6.947 2.881 ( 6.362 -6.049 3.757) 9.549 3.090 ( 7.364 7.304 5.159) 11.584 3.193 ( 7.013 -2.910 4.872) 9.021 4.602 ( 1.714 -3.533 2.897) 4.879 4.612 ( 1.908 -4.491 2.886) 5.669 5.994 ( 7.340 6.687 7.757) 12.600 6.133 ( 5.582 -7.919 7.464) 12.230 6.722 ( -3.410 1.827 5.733) 6.916 6.750 ( -3.004 -1.189 6.074) 6.880 7.594 ( 5.044 3.168 -3.886) 7.112 7.668 ( 3.611 -4.779 -1.756) 6.242 7.967 ( -1.407 1.097 -3.055) 3.538 7.992 ( -1.681 -1.435 -1.671) 2.771 8.677 ( 3.025 14.242 2.233) 14.730 8.788 ( -1.044 6.548 1.761) 6.860 8.988 ( 0.462 -8.251 3.948) 9.158 9.033 ( -2.120 -8.783 4.209) 9.968 ======================= Grid point 466 (273/309) ======================= q-point: ( 0.41 0.40 -0.58) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 510 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.638 ( 3.517 0.685 -0.236) 3.591 1.648 ( 1.926 -0.191 -1.797) 2.641 1.785 ( -2.330 2.528 1.518) 3.758 1.835 ( -4.936 -2.767 1.698) 5.908 1.980 ( 3.722 3.786 -3.043) 6.119 2.021 ( 3.406 0.053 -2.914) 4.483 2.878 ( 3.452 5.325 4.059) 7.533 3.001 ( 4.097 -7.263 2.733) 8.775 3.271 ( 5.145 7.620 6.476) 11.246 3.367 ( 5.895 -1.976 5.022) 7.992 4.671 ( 1.703 -3.838 3.205) 5.282 4.685 ( 1.703 -5.103 3.255) 6.288 6.265 ( 10.297 5.025 10.717) 15.689 6.370 ( 8.453 -6.029 10.307) 14.630 6.754 ( -2.797 2.502 5.412) 6.586 6.793 ( -2.131 -1.637 5.504) 6.125 7.611 ( 3.935 3.250 -3.243) 6.047 7.688 ( 2.091 -4.956 -1.355) 5.547 7.880 ( -3.510 1.928 -3.894) 5.586 7.923 ( -3.344 -2.594 -2.518) 4.925 8.748 ( 2.414 11.971 1.758) 12.338 8.795 ( -0.815 7.896 1.330) 8.049 9.045 ( -0.327 -7.260 3.845) 8.222 9.070 ( -0.357 -8.716 3.963) 9.581 ======================= Grid point 467 (274/309) ======================= q-point: ( 0.47 0.40 -0.58) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 510 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.673 ( 2.100 1.771 1.021) 2.931 1.701 ( 2.939 -1.032 1.305) 3.378 1.768 ( -1.919 0.607 0.945) 2.223 1.781 ( -4.619 -0.783 1.310) 4.864 1.994 ( 1.911 3.906 -1.625) 4.642 2.032 ( 2.463 0.518 -2.466) 3.524 2.983 ( 2.207 3.490 4.356) 6.002 3.076 ( 1.805 -6.027 1.479) 6.463 3.401 ( 1.117 7.355 5.525) 9.266 3.481 ( 1.888 -0.714 2.920) 3.549 4.731 ( 0.723 -4.335 2.623) 5.118 4.743 ( 0.726 -5.384 2.341) 5.916 6.546 ( 7.567 3.659 9.393) 12.605 6.621 ( 5.904 -4.147 9.176) 11.673 6.775 ( -3.273 3.034 4.019) 6.006 6.827 ( -2.481 -2.261 4.007) 5.227 7.631 ( 3.876 3.050 -1.997) 5.321 7.700 ( 1.165 -3.729 -0.544) 3.945 7.769 ( -3.426 1.871 -3.865) 5.494 7.833 ( -3.609 -4.235 -2.774) 6.217 8.787 ( -0.240 9.409 1.283) 9.499 8.805 ( 0.842 8.352 0.492) 8.409 9.089 ( -0.397 -5.933 3.541) 6.921 9.118 ( 0.364 -7.709 2.642) 8.157 ======================= Grid point 468 (275/309) ======================= q-point: (-0.47 0.40 0.42) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 510 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.689 ( -5.275 0.517 0.768) 5.356 1.693 ( -3.901 0.188 1.685) 4.254 1.774 ( 2.577 1.855 1.008) 3.331 1.803 ( 4.170 -1.098 0.337) 4.325 1.980 ( -1.726 3.996 -0.934) 4.452 2.020 ( 0.230 0.126 -2.167) 2.183 3.040 ( -1.895 0.964 2.819) 3.531 3.085 ( -1.549 -3.563 -0.363) 3.902 3.453 ( -2.901 5.899 3.942) 7.665 3.503 ( -2.060 0.964 0.726) 2.388 4.758 ( -0.923 -4.576 1.407) 4.875 4.768 ( -0.482 -5.455 0.982) 5.563 6.693 ( -5.005 3.223 4.736) 7.607 6.745 ( -1.790 -0.535 3.972) 4.389 6.788 ( -0.433 0.363 3.165) 3.215 6.832 ( 0.176 -2.616 1.633) 3.089 7.641 ( -4.444 3.990 -2.286) 6.395 7.680 ( 4.273 2.618 -0.214) 5.016 7.741 ( -1.366 -5.234 -1.188) 5.538 7.763 ( 2.286 -5.119 -0.881) 5.675 8.789 ( -1.195 9.523 1.047) 9.655 8.822 ( 0.883 7.023 -0.279) 7.084 9.127 ( 0.013 -5.498 2.242) 5.938 9.147 ( 0.213 -6.595 0.885) 6.658 ======================= Grid point 469 (276/309) ======================= q-point: (-0.41 0.40 0.42) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 510 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.612 ( -5.980 0.725 0.725) 6.068 1.628 ( -6.438 -0.977 0.912) 6.576 1.825 ( 1.534 2.071 0.105) 2.579 1.855 ( 1.100 -1.021 0.118) 1.506 1.925 ( -2.656 5.421 -0.746) 6.083 1.989 ( -0.666 -1.317 -1.201) 1.903 2.979 ( -7.483 2.240 -0.811) 7.853 3.038 ( -4.708 -4.067 0.034) 6.222 3.411 ( -7.422 4.891 0.726) 8.918 3.450 ( -5.521 1.302 -0.046) 5.672 4.741 ( -2.473 -4.215 -0.103) 4.888 4.755 ( -1.997 -5.506 -0.191) 5.860 6.572 ( -10.897 4.550 -2.124) 11.998 6.662 ( -9.388 -4.811 -1.843) 10.709 6.828 ( 0.734 2.201 0.952) 2.508 6.866 ( 0.045 -1.785 1.039) 2.066 7.550 ( -4.896 5.438 -0.579) 7.340 7.680 ( -2.586 -8.301 -0.698) 8.722 7.765 ( 4.720 2.765 1.206) 5.602 7.830 ( 4.028 -4.078 1.438) 5.909 8.784 ( -0.721 10.447 0.290) 10.476 8.823 ( 0.132 6.559 -0.566) 6.585 9.146 ( 0.068 -6.175 -0.041) 6.176 9.147 ( -0.173 -6.026 -0.408) 6.043 ======================= Grid point 470 (277/309) ======================= q-point: (-0.35 0.40 0.42) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 510 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.532 ( -7.606 0.979 1.843) 7.887 1.545 ( -6.052 -0.519 1.821) 6.341 1.795 ( -7.454 2.322 1.513) 7.952 1.813 ( -3.276 0.476 0.266) 3.321 1.932 ( 2.505 2.177 -0.677) 3.387 1.981 ( 1.503 -1.974 -0.851) 2.623 2.830 ( -10.433 5.625 -0.489) 11.862 2.941 ( -7.886 -6.137 -0.136) 9.994 3.257 ( -11.764 5.701 -1.979) 13.222 3.327 ( -9.678 -0.870 -1.434) 9.823 4.686 ( -3.505 -3.588 -1.119) 5.139 4.704 ( -3.451 -5.192 -1.191) 6.347 6.340 ( -11.563 5.577 -6.448) 14.366 6.455 ( -10.075 -6.614 -6.093) 13.504 6.833 ( 0.108 2.031 -0.627) 2.129 6.864 ( -0.294 -1.364 -0.461) 1.469 7.477 ( -6.301 6.534 1.821) 9.258 7.633 ( -3.797 -10.024 0.393) 10.727 7.850 ( 3.273 2.555 2.132) 4.667 7.906 ( 2.673 -3.343 1.924) 4.693 8.765 ( -0.703 11.773 -2.053) 11.971 8.820 ( 0.279 6.584 0.118) 6.591 9.116 ( -1.132 -5.794 -2.022) 6.240 9.146 ( 0.689 -7.647 -1.132) 7.761 ======================= Grid point 471 (278/309) ======================= q-point: (-0.29 0.40 0.42) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 510 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.445 ( -8.982 4.147 3.194) 10.396 1.491 ( -6.352 -0.599 3.301) 7.184 1.707 ( -8.678 3.904 4.085) 10.356 1.782 ( -3.265 -2.745 3.281) 5.381 1.942 ( 0.118 1.737 -0.967) 1.992 2.003 ( 2.023 -3.550 -0.299) 4.097 2.676 ( -11.380 7.246 1.998) 13.638 2.805 ( -9.979 -6.545 -0.529) 11.946 3.021 ( -14.817 7.146 -2.393) 16.623 3.140 ( -11.409 -4.111 -1.598) 12.232 4.615 ( -3.566 -3.322 -1.209) 5.021 4.626 ( -4.081 -4.205 -1.546) 6.060 6.086 ( -8.455 6.907 -7.316) 13.143 6.230 ( -7.167 -8.305 -6.686) 12.846 6.826 ( 1.040 1.901 -1.300) 2.527 6.856 ( 0.915 -1.291 -1.261) 2.024 7.406 ( -8.445 6.942 3.839) 11.586 7.570 ( -6.275 -10.419 1.257) 12.228 7.912 ( 0.859 1.908 2.193) 3.032 7.955 ( 0.209 -2.585 1.794) 3.153 8.704 ( -2.000 13.924 -3.584) 14.516 8.834 ( 1.496 4.036 -0.436) 4.326 9.064 ( -1.434 -4.723 -2.465) 5.517 9.142 ( 1.724 -8.583 -1.915) 8.961 ======================= Grid point 472 (279/309) ======================= q-point: (-0.24 0.40 0.42) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 510 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.334 ( -11.245 6.982 2.653) 13.500 1.433 ( -7.672 -2.864 2.907) 8.690 1.660 ( -8.088 6.964 7.103) 12.821 1.802 ( -4.054 -5.975 5.945) 9.353 1.913 ( -1.674 4.710 -0.963) 5.090 2.022 ( -0.510 -6.070 0.774) 6.141 2.526 ( -12.694 4.742 1.367) 13.620 2.617 ( -12.034 -4.861 -2.364) 13.193 2.804 ( -12.116 10.168 2.174) 15.966 2.989 ( -7.961 -7.624 1.637) 11.144 4.554 ( -2.609 -2.569 -0.269) 3.672 4.566 ( -1.918 -4.063 0.161) 4.495 5.936 ( -1.116 7.935 -2.518) 8.400 6.098 ( -1.042 -9.229 -2.416) 9.597 6.831 ( 2.221 1.725 -1.559) 3.215 6.859 ( 2.201 -1.271 -1.776) 3.100 7.327 ( -10.427 6.416 5.203) 13.303 7.478 ( -8.995 -9.585 1.985) 13.293 7.927 ( -2.243 1.075 1.169) 2.748 7.954 ( -3.019 -1.774 0.939) 3.625 8.621 ( -2.441 15.752 -3.164) 16.251 8.838 ( 0.903 -3.158 -2.048) 3.871 9.022 ( 0.450 -0.007 -1.905) 1.957 9.146 ( 2.821 -8.401 -2.524) 9.215 ======================= Grid point 473 (280/309) ======================= q-point: (-0.18 0.40 0.42) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 510 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.197 ( -11.153 8.482 2.771) 14.283 1.342 ( -8.485 -6.431 1.973) 10.828 1.631 ( -11.020 6.659 8.679) 15.527 1.767 ( -11.291 -6.922 5.605) 14.381 1.892 ( 0.227 5.987 -1.236) 6.118 1.981 ( -5.333 -3.699 -0.676) 6.525 2.347 ( -12.032 3.491 0.269) 12.531 2.434 ( -8.481 -4.799 -0.239) 9.748 2.736 ( -5.665 11.383 6.843) 14.439 2.945 ( -3.534 -8.440 4.191) 10.064 4.556 ( 0.964 -1.764 2.627) 3.308 4.581 ( 1.243 -4.621 2.765) 5.527 6.008 ( 8.026 6.731 5.334) 11.755 6.147 ( 5.955 -7.992 4.068) 10.765 6.848 ( 2.870 1.444 -1.591) 3.585 6.871 ( 2.825 -1.017 -2.042) 3.631 7.239 ( -11.610 5.034 6.058) 14.030 7.359 ( -11.167 -7.718 2.785) 13.858 7.875 ( -5.143 0.512 -0.625) 5.206 7.888 ( -5.959 -0.970 -0.537) 6.062 8.559 ( -1.618 15.710 -1.244) 15.842 8.806 ( -0.435 -8.695 -2.647) 9.099 9.027 ( 2.973 3.870 -1.665) 5.157 9.156 ( 3.413 -7.487 -2.948) 8.740 ======================= Grid point 474 (281/309) ======================= q-point: (-0.12 0.40 0.42) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 510 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.125 ( -5.132 6.362 6.447) 10.411 1.262 ( -5.392 -7.592 3.068) 9.805 1.573 ( -13.297 3.526 10.133) 17.085 1.658 ( -13.869 -5.114 7.683) 16.659 1.855 ( -1.355 2.526 -3.177) 4.279 1.871 ( -5.725 0.322 -1.978) 6.066 2.196 ( -8.272 7.627 0.427) 11.260 2.352 ( -3.895 -6.819 0.332) 7.860 2.805 ( -0.751 10.835 9.240) 14.260 2.994 ( 0.306 -6.820 5.927) 9.040 4.639 ( 3.059 -1.903 4.041) 5.414 4.664 ( 2.852 -4.757 4.154) 6.929 6.288 ( 14.001 3.264 9.690) 17.337 6.365 ( 10.847 -4.777 8.073) 14.341 6.872 ( 2.927 1.136 -1.295) 3.396 6.887 ( 2.770 -0.522 -1.695) 3.289 7.152 ( -11.683 3.080 6.929) 13.928 7.229 ( -12.170 -5.077 4.072) 13.801 7.766 ( -6.335 0.228 -2.328) 6.753 7.772 ( -6.859 -0.425 -2.029) 7.166 8.538 ( -0.624 13.791 0.448) 13.812 8.763 ( -0.478 -8.758 -2.614) 9.153 9.054 ( 3.419 3.797 -1.447) 5.310 9.165 ( 3.109 -6.458 -2.867) 7.719 ======================= Grid point 475 (282/309) ======================= q-point: (-0.06 0.40 0.42) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 510 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.238 ( 4.386 2.575 9.478) 10.756 1.309 ( 2.795 -4.597 7.085) 8.897 1.525 ( -11.700 2.463 10.684) 16.035 1.595 ( -11.558 -4.710 11.267) 16.815 1.764 ( -2.714 2.205 -2.948) 4.574 1.801 ( -0.141 -1.217 -3.543) 3.749 2.106 ( -4.279 10.510 -0.471) 11.358 2.299 ( -1.797 -8.333 -2.390) 8.854 2.934 ( 0.470 10.473 9.073) 13.864 3.087 ( 1.262 -4.074 4.974) 6.552 4.735 ( 2.405 -2.476 3.505) 4.919 4.758 ( 2.069 -4.874 3.564) 6.383 6.620 ( 11.617 0.506 7.243) 13.699 6.649 ( 12.257 -2.241 6.895) 14.241 6.899 ( 2.888 1.133 -1.212) 3.331 6.910 ( 2.526 -0.059 -0.273) 2.542 7.093 ( -9.817 0.994 8.673) 13.137 7.125 ( -10.981 -2.369 7.604) 13.565 7.631 ( -5.836 0.457 -3.811) 6.985 7.642 ( -4.822 -0.683 -3.918) 6.250 8.547 ( -0.012 11.033 1.295) 11.109 8.720 ( -0.294 -6.152 -2.944) 6.827 9.086 ( 2.558 2.023 -0.592) 3.315 9.167 ( 1.771 -5.395 -2.381) 6.158 ======================= Grid point 510 (283/309) ======================= q-point: ( 0.00 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 156 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.519 ( -7.550 0.000 -3.932) 8.512 1.519 ( 7.550 0.000 3.932) 8.512 1.568 ( -0.275 0.000 -0.114) 0.298 1.568 ( 0.275 0.000 0.114) 0.298 1.686 ( 1.651 0.000 -7.347) 7.530 1.686 ( -1.651 0.000 7.347) 7.530 2.287 ( -0.244 0.000 -0.296) 0.384 2.287 ( 0.244 0.000 0.296) 0.384 2.926 ( -0.871 0.000 -1.015) 1.337 2.926 ( 0.871 0.000 1.015) 1.337 5.009 ( -0.532 0.000 -1.341) 1.443 5.009 ( 0.532 0.000 1.341) 1.443 6.827 ( 0.458 0.000 -1.388) 1.462 6.827 ( -0.458 0.000 1.388) 1.462 6.913 ( 1.410 0.000 -1.142) 1.814 6.913 ( -1.410 0.000 1.142) 1.814 7.325 ( -4.676 0.000 -8.849) 10.009 7.325 ( 4.676 0.000 8.849) 10.009 7.424 ( -0.527 0.000 -8.484) 8.500 7.424 ( 0.527 0.000 8.484) 8.500 8.508 ( -0.172 0.000 -7.520) 7.522 8.508 ( 0.172 0.000 7.520) 7.522 9.219 ( -1.442 0.000 -1.697) 2.226 9.219 ( 1.442 0.000 1.697) 2.226 ======================= Grid point 512 (284/309) ======================= q-point: ( 0.06 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 309 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.368 ( -4.905 0.000 -3.154) 5.831 1.511 ( -2.097 0.000 -6.157) 6.505 1.542 ( -0.665 0.000 -1.235) 1.402 1.668 ( 5.449 0.000 2.334) 5.928 1.679 ( 7.954 0.000 -4.121) 8.958 1.787 ( 4.062 0.000 4.170) 5.822 2.272 ( 4.718 0.000 -6.164) 7.762 2.291 ( 6.669 0.000 -6.517) 9.324 2.904 ( -2.194 0.000 1.493) 2.654 2.942 ( -1.401 0.000 1.262) 1.885 4.950 ( -2.901 0.000 -3.347) 4.429 5.001 ( -1.826 0.000 -1.049) 2.106 6.758 ( -8.267 0.000 -3.237) 8.878 6.802 ( -11.242 0.000 -2.814) 11.589 6.814 ( -3.458 0.000 1.671) 3.841 6.883 ( -3.594 0.000 0.713) 3.664 7.221 ( 5.909 0.000 -6.641) 8.889 7.341 ( 6.157 0.000 -8.699) 10.658 7.532 ( 8.120 0.000 5.959) 10.072 7.562 ( 4.245 0.000 6.007) 7.356 8.404 ( -0.132 0.000 -7.330) 7.331 8.609 ( -0.440 0.000 7.283) 7.296 9.165 ( -2.671 0.000 -1.188) 2.923 9.247 ( -0.842 0.000 1.727) 1.921 ======================= Grid point 513 (285/309) ======================= q-point: ( 0.12 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 309 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.256 ( -0.509 0.000 -9.374) 9.388 1.452 ( 1.478 0.000 1.588) 2.169 1.511 ( 1.053 0.000 -3.976) 4.113 1.753 ( 2.295 0.000 1.199) 2.589 1.780 ( 11.679 0.000 -2.795) 12.009 1.905 ( 8.541 0.000 -0.102) 8.541 2.288 ( 8.506 0.000 -4.929) 9.831 2.324 ( 12.320 0.000 -8.986) 15.249 2.904 ( -3.895 0.000 -1.324) 4.113 2.905 ( -2.105 0.000 3.462) 4.052 4.839 ( -4.333 0.000 -4.517) 6.259 4.933 ( -3.252 0.000 -2.906) 4.361 6.435 ( -18.693 0.000 -9.074) 20.779 6.617 ( -8.276 0.000 -5.084) 9.713 6.783 ( -4.208 0.000 2.314) 4.802 6.844 ( -4.590 0.000 2.680) 5.315 7.257 ( 8.719 0.000 -6.070) 10.624 7.391 ( 10.626 0.000 -2.683) 10.960 7.693 ( 5.416 0.000 3.637) 6.524 7.730 ( 8.295 0.000 3.787) 9.119 8.306 ( 0.123 0.000 -7.106) 7.107 8.685 ( -2.119 0.000 6.209) 6.561 9.122 ( -1.827 0.000 0.322) 1.856 9.245 ( -2.616 0.000 2.132) 3.375 ======================= Grid point 514 (286/309) ======================= q-point: ( 0.18 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 309 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.150 ( 5.086 0.000 -8.885) 10.238 1.467 ( 2.518 0.000 -6.015) 6.521 1.549 ( 4.123 0.000 3.719) 5.552 1.765 ( 2.490 0.000 -3.632) 4.403 1.937 ( 12.497 0.000 -2.003) 12.657 2.062 ( 10.183 0.000 2.142) 10.406 2.396 ( 10.615 0.000 -0.640) 10.634 2.420 ( 14.878 0.000 -6.853) 16.380 2.801 ( -4.302 0.000 -3.446) 5.512 2.938 ( -0.513 0.000 4.174) 4.206 4.718 ( -3.298 0.000 -3.862) 5.079 4.841 ( -2.910 0.000 -3.121) 4.267 6.031 ( -16.176 0.000 -9.697) 18.860 6.433 ( -6.960 0.000 -4.058) 8.057 6.754 ( -3.994 0.000 2.473) 4.698 6.823 ( -4.463 0.000 4.165) 6.105 7.306 ( 9.708 0.000 -6.936) 11.931 7.551 ( 9.810 0.000 2.767) 10.193 7.812 ( 5.347 0.000 2.017) 5.714 7.888 ( 7.163 0.000 2.303) 7.525 8.214 ( 0.496 0.000 -6.859) 6.877 8.710 ( -4.191 0.000 4.384) 6.065 9.126 ( -0.013 0.000 2.075) 2.075 9.237 ( -2.998 0.000 3.060) 4.284 ======================= Grid point 515 (287/309) ======================= q-point: ( 0.24 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 309 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.182 ( 10.632 0.000 -4.156) 11.416 1.439 ( 5.089 0.000 -5.674) 7.622 1.640 ( 3.418 0.000 1.076) 3.583 1.755 ( 3.389 0.000 -3.860) 5.137 2.053 ( 7.652 0.000 -4.004) 8.636 2.204 ( 2.319 0.000 1.247) 2.633 2.554 ( 12.246 0.000 -4.759) 13.138 2.572 ( 12.216 0.000 1.348) 12.291 2.753 ( 3.565 0.000 0.520) 3.603 3.002 ( 1.840 0.000 3.618) 4.059 4.666 ( 0.946 0.000 -0.482) 1.062 4.778 ( -0.877 0.000 -1.608) 1.832 5.759 ( -6.438 0.000 -3.016) 7.109 6.326 ( -3.068 0.000 0.006) 3.068 6.732 ( -3.418 0.000 2.415) 4.185 6.821 ( -3.705 0.000 4.444) 5.786 7.355 ( 9.397 0.000 -6.770) 11.582 7.734 ( 6.452 0.000 5.553) 8.513 7.903 ( 4.247 0.000 0.679) 4.301 7.992 ( 3.212 0.000 0.158) 3.216 8.151 ( 3.101 0.000 -4.672) 5.607 8.685 ( -5.011 0.000 2.356) 5.537 9.168 ( 0.702 0.000 2.872) 2.957 9.244 ( -2.314 0.000 3.772) 4.425 ======================= Grid point 516 (288/309) ======================= q-point: ( 0.29 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 309 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.326 ( 12.559 0.000 -1.069) 12.604 1.476 ( 7.633 0.000 -2.799) 8.130 1.678 ( 1.588 0.000 -1.074) 1.917 1.765 ( 3.465 0.000 -2.276) 4.146 2.058 ( 1.023 0.000 -4.042) 4.169 2.146 ( -6.083 0.000 -2.777) 6.687 2.636 ( 8.825 0.000 -5.139) 10.212 2.801 ( 11.784 0.000 4.856) 12.745 2.917 ( 11.370 0.000 4.246) 12.136 3.087 ( 3.981 0.000 2.393) 4.644 4.730 ( 4.613 0.000 2.904) 5.451 4.777 ( 1.717 0.000 0.620) 1.826 5.782 ( 5.342 0.000 6.629) 8.513 6.351 ( 1.932 0.000 4.973) 5.335 6.720 ( -2.498 0.000 2.477) 3.518 6.832 ( -2.388 0.000 3.789) 4.479 7.400 ( 8.304 0.000 -6.019) 10.257 7.878 ( 1.609 0.000 6.102) 6.311 7.935 ( 0.190 0.000 -3.035) 3.041 7.987 ( 0.165 0.000 -0.470) 0.498 8.203 ( 6.852 0.000 -0.463) 6.868 8.635 ( -4.056 0.000 0.652) 4.108 9.215 ( 0.332 0.000 2.786) 2.806 9.267 ( -1.467 0.000 3.648) 3.932 ======================= Grid point 517 (289/309) ======================= q-point: ( 0.35 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 309 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.498 ( 10.603 0.000 -0.382) 10.610 1.578 ( 7.588 0.000 0.451) 7.601 1.667 ( 0.603 0.000 -1.809) 1.907 1.790 ( 3.367 0.000 -1.627) 3.740 1.999 ( -2.583 0.000 -1.878) 3.193 2.007 ( -6.552 0.000 -2.708) 7.089 2.725 ( 9.735 0.000 -0.918) 9.778 3.020 ( 7.102 0.000 6.007) 9.302 3.145 ( 11.375 0.000 2.595) 11.668 3.181 ( 4.923 0.000 1.465) 5.136 4.838 ( 3.381 0.000 2.157) 4.011 4.849 ( 4.505 0.000 3.514) 5.714 6.042 ( 11.488 0.000 10.677) 15.684 6.505 ( 5.867 0.000 7.997) 9.919 6.725 ( -1.516 0.000 2.580) 2.992 6.855 ( -0.704 0.000 3.047) 3.127 7.440 ( 6.943 0.000 -4.726) 8.399 7.854 ( -3.035 0.000 -3.977) 5.002 7.942 ( -2.778 0.000 4.642) 5.410 7.991 ( -0.573 0.000 0.147) 0.591 8.307 ( 7.130 0.000 -0.076) 7.130 8.593 ( -2.253 0.000 0.287) 2.271 9.252 ( -0.218 0.000 2.411) 2.421 9.294 ( -0.908 0.000 2.722) 2.869 ======================= Grid point 518 (290/309) ======================= q-point: ( 0.41 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 309 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.593 ( 3.224 0.000 -0.537) 3.268 1.685 ( 3.035 0.000 2.321) 3.821 1.692 ( 5.141 0.000 -0.646) 5.181 1.817 ( 3.839 0.000 -2.844) 4.778 1.891 ( -4.546 0.000 -1.332) 4.737 1.948 ( -2.669 0.000 0.381) 2.696 2.898 ( 10.188 0.000 3.492) 10.770 3.165 ( 2.175 0.000 4.639) 5.123 3.268 ( 4.021 0.000 1.280) 4.220 3.298 ( 7.031 0.000 -0.657) 7.062 4.920 ( 3.224 0.000 2.065) 3.828 4.943 ( 2.463 0.000 2.427) 3.457 6.358 ( 11.666 0.000 8.776) 14.598 6.709 ( 6.423 0.000 7.077) 9.557 6.738 ( -1.494 0.000 2.090) 2.569 6.890 ( 0.283 0.000 2.197) 2.215 7.482 ( 5.858 0.000 -2.832) 6.506 7.748 ( -4.586 0.000 -3.157) 5.567 7.936 ( -3.958 0.000 2.702) 4.792 7.970 ( -1.658 0.000 -0.609) 1.766 8.408 ( 6.604 0.000 -0.301) 6.611 8.572 ( -1.962 0.000 0.819) 2.126 9.277 ( -0.378 0.000 2.076) 2.111 9.311 ( -0.555 0.000 1.268) 1.384 ======================= Grid point 519 (291/309) ======================= q-point: ( 0.47 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 309 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.638 ( 2.914 0.000 1.228) 3.162 1.701 ( -2.907 0.000 -0.190) 2.913 1.753 ( 4.028 0.000 -1.072) 4.168 1.790 ( -2.292 0.000 -0.398) 2.326 1.887 ( 4.108 0.000 -1.301) 4.309 1.922 ( -2.984 0.000 1.432) 3.310 3.090 ( 7.814 0.000 3.547) 8.581 3.197 ( -3.214 0.000 0.677) 3.284 3.328 ( 1.355 0.000 1.425) 1.966 3.345 ( 2.453 0.000 -2.068) 3.208 4.978 ( 1.700 0.000 0.715) 1.844 4.987 ( 0.291 0.000 0.926) 0.970 6.600 ( 8.208 0.000 4.317) 9.274 6.718 ( -3.861 0.000 -0.127) 3.863 6.859 ( 3.743 0.000 3.285) 4.981 6.909 ( -0.691 0.000 0.323) 0.762 7.544 ( 5.512 0.000 -0.375) 5.524 7.637 ( -5.432 0.000 -1.847) 5.737 7.919 ( -1.829 0.000 1.790) 2.560 7.935 ( -0.833 0.000 -1.332) 1.571 8.491 ( 5.292 0.000 -0.632) 5.330 8.546 ( -3.449 0.000 0.932) 3.572 9.298 ( -0.141 0.000 1.504) 1.510 9.312 ( -0.222 0.000 -0.318) 0.388 ======================= Grid point 528 (292/309) ======================= q-point: ( 0.00 0.20 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 258 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.526 ( -4.157 0.373 -4.354) 6.031 1.526 ( 4.157 0.373 4.354) 6.031 1.612 ( 2.008 4.572 -3.820) 6.287 1.612 ( -2.008 4.572 3.820) 6.287 1.682 ( 1.615 -0.359 -5.941) 6.167 1.682 ( -1.615 -0.359 5.941) 6.167 2.221 ( 0.669 -5.870 -8.582) 10.419 2.221 ( -0.669 -5.870 8.582) 10.419 3.011 ( 0.431 7.647 -5.232) 9.275 3.011 ( -0.431 7.647 5.232) 9.275 4.941 ( -0.518 -6.437 -1.079) 6.548 4.941 ( 0.518 -6.437 1.079) 6.548 6.813 ( 0.241 -1.017 -1.942) 2.205 6.813 ( -0.241 -1.017 1.942) 2.205 6.924 ( 0.238 0.648 -1.588) 1.732 6.924 ( -0.238 0.648 1.588) 1.732 7.328 ( -3.992 0.302 -7.901) 8.857 7.328 ( 3.992 0.302 7.901) 8.857 7.418 ( -0.635 -0.631 -7.606) 7.659 7.418 ( 0.635 -0.631 7.606) 7.659 8.545 ( -0.289 3.601 -6.348) 7.304 8.545 ( 0.289 3.601 6.348) 7.304 9.185 ( -1.381 -3.266 -1.697) 3.931 9.185 ( 1.381 -3.266 1.697) 3.931 ======================= Grid point 530 (293/309) ======================= q-point: ( 0.06 0.20 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 511 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.369 ( -4.811 0.702 -5.570) 7.393 1.493 ( -3.562 -1.747 -5.265) 6.593 1.599 ( 2.099 4.235 -1.963) 5.118 1.692 ( 5.852 1.853 -1.978) 6.449 1.695 ( 3.835 2.224 2.252) 4.972 1.780 ( 5.753 -0.516 2.116) 6.151 2.150 ( 7.543 -5.981 -9.640) 13.623 2.330 ( 3.535 -2.338 3.375) 5.418 2.929 ( -1.022 6.004 -5.723) 8.357 3.051 ( -1.980 7.115 3.024) 7.980 4.888 ( -2.783 -5.818 -2.853) 7.052 4.931 ( -1.814 -6.685 -1.160) 7.023 6.732 ( -7.817 -1.742 -3.321) 8.670 6.766 ( -9.550 -2.066 -1.009) 9.823 6.850 ( -5.305 1.974 0.052) 5.661 6.900 ( -3.839 0.991 0.462) 3.991 7.229 ( 5.902 0.819 -7.049) 9.230 7.326 ( 6.048 -1.548 -8.647) 10.665 7.534 ( 7.757 0.193 5.859) 9.723 7.558 ( 4.713 -0.389 5.996) 7.637 8.458 ( -0.097 5.440 -5.879) 8.011 8.636 ( -0.038 2.383 6.406) 6.835 9.130 ( -2.886 -3.206 -1.308) 4.508 9.212 ( -0.955 -3.539 1.784) 4.077 ======================= Grid point 531 (294/309) ======================= q-point: ( 0.12 0.20 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 511 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.237 ( 0.004 -0.436 -9.141) 9.151 1.412 ( 1.746 -3.427 -1.921) 4.300 1.610 ( 2.161 7.281 -1.273) 7.700 1.758 ( 3.393 1.160 0.354) 3.603 1.793 ( 8.889 0.683 -1.224) 8.999 1.889 ( 9.900 -1.505 -2.144) 10.241 2.195 ( 11.851 -3.372 -5.457) 13.476 2.414 ( 6.339 1.328 -1.464) 6.640 2.834 ( -1.522 1.962 -5.150) 5.717 3.036 ( -3.159 5.807 0.893) 6.671 4.788 ( -4.143 -4.839 -3.882) 7.460 4.861 ( -3.351 -6.816 -2.980) 8.158 6.437 ( -17.433 0.387 -8.573) 19.431 6.573 ( -9.525 -3.682 -5.212) 11.465 6.803 ( -4.553 1.599 2.525) 5.446 6.852 ( -4.427 0.583 1.934) 4.866 7.262 ( 8.971 0.583 -6.144) 10.889 7.366 ( 10.262 -2.326 -3.749) 11.171 7.699 ( 6.088 0.500 3.818) 7.203 7.727 ( 8.160 -0.318 3.751) 8.987 8.383 ( 0.247 7.733 -5.346) 9.404 8.711 ( -1.357 2.191 5.738) 6.290 9.077 ( -2.472 -4.053 -0.128) 4.749 9.210 ( -2.729 -3.704 2.271) 5.130 ======================= Grid point 532 (295/309) ======================= q-point: ( 0.18 0.20 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 511 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.165 ( 6.639 2.690 -7.066) 10.062 1.458 ( 5.201 -2.947 -1.533) 6.171 1.628 ( 2.857 8.380 -1.226) 8.938 1.791 ( 2.975 2.545 -2.310) 4.546 1.922 ( 11.173 -1.723 -2.563) 11.592 2.035 ( 10.153 -2.777 0.776) 10.555 2.337 ( 12.689 -2.056 -1.020) 12.895 2.495 ( 9.008 1.979 -2.768) 9.629 2.747 ( -0.421 -0.238 -5.001) 5.024 3.007 ( -1.607 3.755 1.187) 4.253 4.676 ( -3.312 -3.943 -3.401) 6.171 4.766 ( -3.071 -7.040 -3.172) 8.310 6.059 ( -15.097 2.906 -9.006) 17.818 6.367 ( -8.002 -5.957 -4.493) 10.941 6.775 ( -4.180 1.628 2.810) 5.293 6.825 ( -4.311 0.080 3.582) 5.606 7.316 ( 9.816 1.135 -6.606) 11.886 7.497 ( 9.523 -4.565 0.293) 10.565 7.832 ( 6.005 1.318 2.308) 6.567 7.883 ( 7.128 -0.612 2.112) 7.459 8.321 ( 0.657 10.577 -4.455) 11.496 8.744 ( -3.391 3.226 4.297) 6.353 9.063 ( -0.546 -5.865 1.497) 6.077 9.202 ( -3.187 -3.889 3.163) 5.940 ======================= Grid point 533 (296/309) ======================= q-point: ( 0.24 0.20 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 511 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.239 ( 11.167 5.887 -2.795) 12.929 1.492 ( 4.734 2.512 -3.839) 6.593 1.666 ( 4.787 4.475 -1.803) 6.797 1.792 ( 2.099 3.632 -2.865) 5.080 2.020 ( 7.158 -3.425 -4.024) 8.898 2.156 ( 2.286 -4.955 0.401) 5.471 2.520 ( 11.522 -1.123 -0.065) 11.577 2.622 ( 11.222 0.702 0.110) 11.245 2.728 ( 5.960 1.338 -1.904) 6.398 3.034 ( 1.915 1.735 2.233) 3.415 4.624 ( 0.474 -3.952 -0.454) 4.006 4.702 ( -0.815 -7.038 -1.480) 7.238 5.808 ( -6.048 4.846 -2.615) 8.179 6.243 ( -3.523 -7.622 -0.246) 8.400 6.755 ( -3.425 1.870 2.674) 4.731 6.819 ( -3.562 -0.307 4.094) 5.435 7.371 ( 9.309 1.767 -6.308) 11.383 7.637 ( 6.828 -7.108 1.822) 10.024 7.928 ( 4.000 1.019 0.088) 4.129 7.990 ( 4.252 -0.903 0.640) 4.393 8.296 ( 2.266 13.799 -1.660) 14.082 8.732 ( -4.299 4.638 2.575) 6.828 9.096 ( 0.790 -7.005 2.621) 7.521 9.205 ( -2.671 -4.345 3.731) 6.319 ======================= Grid point 534 (297/309) ======================= q-point: ( 0.29 0.20 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 511 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.384 ( 11.091 5.575 -1.364) 12.488 1.522 ( 5.965 3.275 -2.846) 7.376 1.710 ( 4.112 3.836 -1.931) 5.946 1.783 ( 1.904 2.053 -2.289) 3.616 2.029 ( 1.883 -3.008 -3.923) 5.290 2.105 ( -5.265 -4.172 -2.223) 7.076 2.645 ( 8.432 1.376 -2.925) 9.030 2.840 ( 12.936 2.000 4.149) 13.732 2.869 ( 9.891 -1.715 2.961) 10.466 3.120 ( 5.242 1.747 2.499) 6.064 4.676 ( 3.783 -5.083 2.605) 6.851 4.707 ( 1.971 -6.507 0.863) 6.853 5.830 ( 4.926 4.830 6.395) 9.407 6.267 ( 2.235 -7.730 5.127) 9.541 6.748 ( -2.364 2.218 2.653) 4.189 6.828 ( -2.225 -0.444 3.615) 4.268 7.420 ( 8.028 2.164 -5.572) 10.009 7.742 ( 3.586 -8.707 2.103) 9.648 7.940 ( 0.273 0.622 -2.846) 2.926 8.023 ( 0.456 -0.713 -0.478) 0.972 8.353 ( 4.592 14.397 1.870) 15.227 8.697 ( -3.426 6.091 1.118) 7.077 9.148 ( 0.895 -6.760 2.904) 7.412 9.221 ( -1.937 -5.003 3.553) 6.435 ======================= Grid point 535 (298/309) ======================= q-point: ( 0.35 0.20 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 511 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.520 ( 9.007 2.319 -0.607) 9.320 1.582 ( 5.029 0.423 -1.591) 5.291 1.731 ( 1.264 5.407 -0.013) 5.553 1.802 ( 5.012 1.494 -2.541) 5.814 1.977 ( -3.328 -2.090 -2.987) 4.936 2.002 ( -3.590 -0.784 -0.631) 3.729 2.743 ( 8.620 2.248 -0.029) 8.908 3.038 ( 7.567 -4.108 1.594) 8.757 3.080 ( 9.381 2.938 5.659) 11.343 3.256 ( 7.759 3.569 2.522) 8.905 4.765 ( 3.269 -6.654 2.326) 7.771 4.785 ( 3.894 -6.208 3.042) 7.935 6.079 ( 10.998 3.732 10.438) 15.615 6.433 ( 6.594 -6.451 8.369) 12.455 6.757 ( -1.322 2.537 2.624) 3.882 6.852 ( -0.606 -0.460 2.928) 3.025 7.460 ( 6.548 2.226 -4.364) 8.178 7.798 ( 0.350 -8.277 1.637) 8.445 7.876 ( -2.345 0.579 -3.436) 4.200 8.000 ( -1.863 -1.901 -1.122) 2.889 8.455 ( 4.619 13.422 2.230) 14.368 8.668 ( -1.875 7.193 0.559) 7.454 9.195 ( 0.260 -5.781 2.625) 6.355 9.242 ( -1.127 -5.479 2.781) 6.247 ======================= Grid point 536 (299/309) ======================= q-point: ( 0.41 0.20 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 511 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.604 ( 3.400 1.079 -0.780) 3.651 1.652 ( 5.852 -1.108 0.653) 5.992 1.755 ( -0.121 3.499 1.367) 3.759 1.852 ( 5.290 3.777 -2.793) 7.075 1.882 ( -4.193 -0.955 -0.852) 4.384 1.968 ( -1.186 1.652 0.099) 2.037 2.901 ( 8.442 0.790 3.634) 9.224 3.135 ( 4.144 -4.824 -0.128) 6.361 3.262 ( 4.982 4.573 5.316) 8.602 3.383 ( 5.720 4.648 0.157) 7.372 4.844 ( 2.938 -7.088 2.076) 7.948 4.869 ( 2.260 -7.101 2.170) 7.761 6.387 ( 11.326 2.949 8.799) 14.642 6.652 ( 6.950 -4.521 7.373) 11.095 6.774 ( -1.071 2.499 2.143) 3.462 6.885 ( 0.216 -0.679 1.958) 2.084 7.500 ( 5.461 2.037 -2.568) 6.369 7.760 ( -4.360 0.979 -2.651) 5.196 7.831 ( -0.989 -7.567 1.011) 7.698 7.944 ( -2.708 -3.368 -1.699) 4.643 8.542 ( 4.059 12.049 0.985) 12.752 8.654 ( -1.407 7.825 0.803) 7.991 9.228 ( -0.258 -5.048 2.267) 5.540 9.260 ( -0.438 -5.343 1.400) 5.541 ======================= Grid point 537 (300/309) ======================= q-point: ( 0.47 0.20 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 511 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.656 ( 3.428 1.757 1.080) 4.001 1.711 ( -0.217 0.761 -0.420) 0.896 1.759 ( 1.518 0.777 -0.486) 1.773 1.798 ( -3.811 0.458 0.135) 3.841 1.917 ( 4.202 3.095 -0.714) 5.267 1.954 ( -1.731 2.808 0.386) 3.321 3.064 ( 5.390 -1.769 3.997) 6.940 3.150 ( -0.413 -3.906 -2.063) 4.436 3.375 ( 1.441 5.413 4.311) 7.068 3.421 ( 1.885 5.395 -2.644) 6.297 4.899 ( 1.487 -7.439 0.851) 7.634 4.908 ( 0.350 -7.453 0.710) 7.495 6.626 ( 7.936 2.617 4.509) 9.495 6.741 ( -3.171 2.152 -0.127) 3.834 6.834 ( 3.899 -2.412 3.648) 5.858 6.896 ( -1.023 -1.405 -0.154) 1.745 7.560 ( 5.241 1.793 -0.195) 5.543 7.652 ( -5.330 1.655 -1.934) 5.907 7.841 ( 0.099 -6.643 1.632) 6.841 7.882 ( -1.999 -4.964 -1.907) 5.681 8.603 ( 3.439 10.260 -0.210) 10.823 8.639 ( -2.350 8.742 0.824) 9.089 9.251 ( -0.183 -4.803 1.600) 5.066 9.264 ( -0.087 -4.945 -0.270) 4.953 ======================= Grid point 546 (301/309) ======================= q-point: ( 0.00 0.40 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 258 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.531 ( -1.113 0.115 -1.890) 2.197 1.531 ( 1.113 0.115 1.890) 2.197 1.669 ( -0.327 -0.029 -2.185) 2.209 1.669 ( 0.327 -0.029 2.185) 2.209 1.711 ( 0.576 3.635 -3.538) 5.105 1.711 ( -0.576 3.635 3.538) 5.106 2.115 ( 0.386 -4.103 -5.940) 7.229 2.115 ( -0.386 -4.103 5.940) 7.229 3.143 ( 0.254 4.674 -2.673) 5.390 3.143 ( -0.254 4.674 2.673) 5.390 4.824 ( -0.227 -4.331 -0.459) 4.361 4.824 ( 0.227 -4.331 0.459) 4.361 6.801 ( 0.017 -0.262 -0.978) 1.013 6.801 ( -0.017 -0.262 0.978) 1.013 6.928 ( -0.080 -0.062 -0.731) 0.738 6.928 ( 0.080 -0.062 0.731) 0.738 7.335 ( -1.737 0.260 -3.767) 4.157 7.335 ( 1.737 0.260 3.767) 4.157 7.406 ( -0.455 -0.464 -3.656) 3.713 7.406 ( 0.455 -0.464 3.656) 3.713 8.615 ( -0.259 2.795 -2.720) 3.909 8.615 ( 0.259 2.795 2.720) 3.909 9.122 ( -0.712 -2.556 -0.981) 2.829 9.122 ( 0.712 -2.556 0.981) 2.829 ======================= Grid point 548 (302/309) ======================= q-point: ( 0.06 0.40 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 511 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.400 ( -4.586 2.350 -7.212) 8.864 1.449 ( -4.096 -2.756 -6.599) 8.241 1.670 ( 1.891 3.214 0.100) 3.731 1.713 ( -0.802 -1.196 4.513) 4.737 1.730 ( 7.830 2.641 -3.909) 9.142 1.777 ( 9.340 -1.068 -5.264) 10.774 2.113 ( 6.192 3.054 -1.970) 7.180 2.226 ( 3.736 -7.260 4.952) 9.549 3.078 ( -1.124 7.505 -5.569) 9.413 3.142 ( -1.700 1.308 -0.630) 2.236 4.787 ( -2.413 -3.297 -1.909) 4.510 4.805 ( -1.994 -5.065 -1.309) 5.599 6.715 ( -8.552 0.071 -2.975) 9.055 6.732 ( -9.346 -1.525 -1.880) 9.654 6.882 ( -4.499 1.458 0.406) 4.747 6.903 ( -3.944 -0.645 0.520) 4.030 7.252 ( 5.852 1.673 -7.864) 9.944 7.289 ( 5.880 -2.141 -8.415) 10.487 7.539 ( 6.855 0.410 5.769) 8.969 7.549 ( 5.738 -0.552 5.872) 8.228 8.581 ( 0.154 6.634 -2.204) 6.992 8.661 ( 0.535 -1.047 2.975) 3.199 9.084 ( -2.828 -0.402 -0.417) 2.886 9.130 ( -1.649 -4.475 1.410) 4.973 ======================= Grid point 549 (303/309) ======================= q-point: ( 0.12 0.40 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 511 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.263 ( 1.193 3.058 -7.665) 8.338 1.336 ( 1.878 -4.334 -4.899) 6.806 1.715 ( 5.105 4.032 -1.332) 6.641 1.771 ( 2.302 -1.644 2.348) 3.677 1.810 ( 8.722 2.279 -3.243) 9.581 1.856 ( 10.460 -2.210 -4.241) 11.501 2.209 ( 8.765 5.053 -1.053) 10.172 2.339 ( 5.275 -7.305 1.684) 9.166 2.968 ( -1.241 9.232 -7.319) 11.846 3.082 ( -2.417 -1.755 -3.028) 4.254 4.706 ( -3.805 -2.436 -2.900) 5.369 4.733 ( -3.581 -5.259 -2.808) 6.955 6.457 ( -14.804 1.803 -7.430) 16.662 6.505 ( -12.120 -3.299 -6.153) 13.987 6.832 ( -4.787 1.427 2.395) 5.539 6.853 ( -4.564 -0.623 1.818) 4.952 7.281 ( 9.494 1.477 -6.089) 11.375 7.318 ( 9.873 -2.452 -5.334) 11.487 7.708 ( 7.038 0.506 3.794) 8.011 7.718 ( 7.726 -0.575 3.702) 8.586 8.560 ( 0.653 10.109 -1.690) 10.271 8.710 ( 0.615 -4.251 2.824) 5.141 9.033 ( -3.931 1.324 0.623) 4.195 9.116 ( -3.339 -5.852 2.156) 7.075 ======================= Grid point 550 (304/309) ======================= q-point: ( 0.18 0.40 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 511 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.256 ( 8.272 6.383 -3.779) 11.111 1.374 ( 7.670 -5.709 -1.571) 9.689 1.771 ( 5.590 5.754 -3.016) 8.571 1.841 ( 2.997 -0.076 1.352) 3.288 1.889 ( 9.209 1.092 -4.758) 10.423 1.965 ( 7.749 -4.531 -0.635) 8.999 2.346 ( 10.674 3.174 0.064) 11.136 2.438 ( 7.221 -5.737 -0.293) 9.227 2.867 ( 1.462 9.974 -6.563) 12.029 3.012 ( -0.557 -4.006 -2.824) 4.933 4.609 ( -3.346 -1.994 -2.720) 4.751 4.637 ( -3.335 -5.133 -2.908) 6.777 6.135 ( -12.765 5.142 -7.455) 15.651 6.245 ( -10.245 -6.525 -5.790) 13.456 6.802 ( -4.413 1.224 3.176) 5.573 6.820 ( -4.301 -0.635 3.088) 5.333 7.350 ( 9.933 2.571 -5.358) 11.575 7.413 ( 9.736 -4.094 -2.969) 10.971 7.851 ( 6.498 0.825 1.986) 6.844 7.867 ( 6.858 -0.924 1.866) 7.167 8.556 ( 1.252 13.140 -0.806) 13.224 8.755 ( 0.524 -5.716 2.604) 6.303 8.991 ( -3.756 1.757 1.781) 4.513 9.096 ( -3.875 -6.886 3.039) 8.465 ======================= Grid point 551 (305/309) ======================= q-point: ( 0.24 0.40 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 511 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.372 ( 10.539 7.209 -1.452) 12.851 1.476 ( 7.885 -3.565 -1.626) 8.805 1.792 ( 4.608 6.954 -4.650) 9.551 1.870 ( 0.120 2.349 -0.924) 2.527 1.946 ( 6.757 -1.818 -4.717) 8.438 2.036 ( 2.115 -7.160 -0.897) 7.519 2.524 ( 11.235 1.537 1.450) 11.432 2.573 ( 10.514 -3.504 1.567) 11.193 2.859 ( 6.452 9.750 -3.080) 12.091 3.011 ( 3.541 -5.033 -0.522) 6.176 4.555 ( -0.352 -2.223 -0.483) 2.302 4.576 ( -0.726 -4.763 -0.959) 4.912 5.927 ( -5.248 7.604 -1.786) 9.411 6.083 ( -4.369 -8.868 -0.933) 9.929 6.786 ( -3.499 1.394 3.196) 4.940 6.808 ( -3.459 -0.897 3.562) 5.045 7.423 ( 8.892 3.834 -4.701) 10.764 7.514 ( 7.968 -5.822 -1.863) 10.043 7.943 ( 3.993 0.903 -0.296) 4.104 7.965 ( 4.225 -1.399 0.036) 4.451 8.581 ( 2.183 15.196 0.940) 15.381 8.794 ( -0.115 -3.403 2.398) 4.165 8.976 ( -2.066 -0.517 2.687) 3.428 9.086 ( -3.429 -7.809 3.518) 9.226 ======================= Grid point 552 (306/309) ======================= q-point: ( 0.29 0.40 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 511 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.496 ( 8.379 5.174 -1.965) 10.042 1.550 ( 5.859 -0.560 -2.611) 6.439 1.802 ( 5.758 4.761 -4.483) 8.713 1.836 ( -0.862 2.430 -2.009) 3.269 1.964 ( 3.159 -2.475 -3.346) 5.225 2.007 ( -2.770 -5.473 -1.173) 6.246 2.695 ( 8.830 3.690 0.631) 9.590 2.772 ( 10.341 -4.460 2.778) 11.600 2.977 ( 10.513 8.041 1.898) 13.371 3.103 ( 7.547 -4.180 2.093) 8.877 4.585 ( 2.320 -3.247 1.862) 4.404 4.593 ( 2.253 -4.140 1.546) 4.960 5.949 ( 4.057 7.607 5.924) 10.460 6.105 ( 3.091 -8.920 5.473) 10.912 6.786 ( -2.215 1.751 3.027) 4.139 6.813 ( -2.101 -1.162 3.317) 4.094 7.483 ( 7.118 4.706 -4.028) 9.436 7.594 ( 5.566 -7.042 -1.288) 9.068 7.958 ( 0.526 1.327 -2.319) 2.723 7.990 ( 0.705 -2.010 -1.618) 2.674 8.645 ( 2.893 15.066 2.458) 15.537 8.813 ( -1.027 2.239 1.619) 2.948 9.005 ( 0.146 -4.786 3.449) 5.901 9.090 ( -2.514 -8.367 3.450) 9.393 ======================= Grid point 553 (307/309) ======================= q-point: ( 0.35 0.40 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 511 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.567 ( 5.595 2.135 -1.716) 6.230 1.588 ( 4.376 -0.098 -2.609) 5.096 1.815 ( -0.205 3.232 0.098) 3.240 1.844 ( 5.786 1.371 -2.661) 6.514 1.940 ( -1.449 -0.568 -1.632) 2.255 1.972 ( 0.264 -2.386 -0.458) 2.444 2.817 ( 7.073 5.396 1.083) 8.962 2.928 ( 7.152 -6.189 1.352) 9.554 3.190 ( 10.213 6.566 4.717) 13.025 3.277 ( 9.123 -1.885 3.648) 10.005 4.653 ( 2.790 -3.571 2.266) 5.066 4.667 ( 2.957 -4.809 2.530) 6.186 6.173 ( 9.833 6.095 9.860) 15.201 6.300 ( 8.272 -7.285 9.137) 14.318 6.802 ( -1.001 2.126 2.696) 3.576 6.835 ( -0.665 -1.373 2.777) 3.168 7.526 ( 5.309 4.979 -3.121) 7.919 7.645 ( 3.273 -7.549 -0.851) 8.272 7.904 ( -2.362 2.069 -3.246) 4.517 7.950 ( -2.037 -2.801 -2.426) 4.229 8.721 ( 2.479 13.128 2.339) 13.563 8.813 ( -0.887 5.792 0.830) 5.918 9.062 ( 0.680 -6.365 3.466) 7.279 9.105 ( -1.393 -8.153 3.064) 8.820 ======================= Grid point 554 (308/309) ======================= q-point: ( 0.41 0.40 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 511 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.625 ( 4.256 0.961 -0.734) 4.425 1.638 ( 5.415 -0.542 -0.081) 5.443 1.812 ( -1.986 2.683 1.204) 3.549 1.855 ( -3.095 -1.885 0.318) 3.638 1.934 ( 4.243 4.155 -1.587) 6.147 1.983 ( 1.993 -0.732 -0.779) 2.261 2.943 ( 6.008 3.769 2.681) 7.582 3.033 ( 4.830 -5.483 0.781) 7.348 3.375 ( 6.228 5.871 3.985) 9.441 3.435 ( 6.041 0.126 1.955) 6.351 4.721 ( 2.277 -4.098 1.887) 5.054 4.735 ( 1.946 -5.370 1.826) 5.997 6.461 ( 10.397 4.725 8.706) 14.360 6.557 ( 8.915 -5.381 8.293) 13.312 6.822 ( -0.863 2.480 1.763) 3.162 6.862 ( -0.220 -1.759 1.720) 2.470 7.562 ( 4.189 4.676 -1.708) 6.506 7.674 ( 1.960 -7.159 -0.160) 7.424 7.809 ( -4.135 2.718 -3.187) 5.885 7.872 ( -3.552 -3.855 -2.601) 5.852 8.775 ( 1.637 10.714 1.065) 10.891 8.812 ( -0.530 7.002 0.604) 7.048 9.111 ( 0.048 -5.925 2.801) 6.554 9.130 ( -0.216 -7.292 2.060) 7.581 ======================= Grid point 555 (309/309) ======================= q-point: ( 0.47 0.40 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.25e-05 1.25e-05 1.25e-05 1.25e-05 1.65e-04 1.65e-04 1.65e-04 1.65e-04 Number of triplets: 511 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.692 ( 4.409 1.778 0.533) 4.783 1.715 ( 4.138 -0.545 -0.218) 4.179 1.782 ( -3.094 1.322 0.345) 3.383 1.799 ( -4.412 -0.433 0.594) 4.473 1.979 ( 2.646 2.690 -0.268) 3.782 1.997 ( 0.572 0.980 -0.524) 1.250 3.049 ( 2.957 0.497 2.350) 3.810 3.083 ( 1.293 -2.943 -0.599) 3.270 3.481 ( 2.076 4.483 2.412) 5.497 3.503 ( 1.845 2.306 -0.489) 2.993 4.765 ( 1.008 -4.810 0.799) 4.979 4.770 ( 0.508 -5.302 0.562) 5.356 6.688 ( 7.100 3.749 4.704) 9.306 6.755 ( 4.623 -2.625 3.791) 6.529 6.811 ( -1.792 1.864 0.114) 2.588 6.859 ( -1.925 -2.519 -0.609) 3.228 7.614 ( 4.278 4.065 0.298) 5.909 7.695 ( -3.065 1.077 -1.077) 3.422 7.719 ( 0.787 -3.940 -0.120) 4.020 7.783 ( -3.642 -5.083 -2.165) 6.618 8.802 ( 1.229 8.783 -0.131) 8.870 8.812 ( -0.818 7.620 0.606) 7.688 9.140 ( -0.220 -5.670 1.602) 5.896 9.146 ( 0.192 -6.240 0.233) 6.247 =================== 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 3/24480 10.0 237.842 251.290 182.817 0.000 -6.678 0.000 3/24480 20.0 103.152 77.838 56.789 0.000 -0.233 0.000 3/24480 30.0 62.903 43.698 30.916 0.000 -0.081 0.000 3/24480 40.0 44.574 30.538 21.121 0.000 -0.059 0.000 3/24480 50.0 33.761 23.123 15.891 0.000 -0.053 0.000 3/24480 60.0 26.707 18.317 12.622 0.000 -0.051 0.000 3/24480 70.0 21.855 15.010 10.408 0.000 -0.051 0.000 3/24480 80.0 18.384 12.644 8.828 0.000 -0.050 0.000 3/24480 90.0 15.815 10.894 7.654 0.000 -0.049 0.000 3/24480 100.0 13.855 9.560 6.752 0.000 -0.047 0.000 3/24480 110.0 12.319 8.516 6.041 0.000 -0.045 0.000 3/24480 120.0 11.089 7.679 5.466 0.000 -0.043 0.000 3/24480 130.0 10.082 6.994 4.993 0.000 -0.041 0.000 3/24480 140.0 9.245 6.425 4.596 0.000 -0.039 0.000 3/24480 150.0 8.538 5.943 4.259 0.000 -0.038 0.000 3/24480 160.0 7.934 5.530 3.969 0.000 -0.036 0.000 3/24480 170.0 7.411 5.173 3.717 0.000 -0.034 0.000 3/24480 180.0 6.954 4.860 3.495 0.000 -0.033 0.000 3/24480 190.0 6.551 4.584 3.299 0.000 -0.031 0.000 3/24480 200.0 6.194 4.339 3.125 0.000 -0.030 0.000 3/24480 210.0 5.874 4.119 2.968 0.000 -0.029 0.000 3/24480 220.0 5.586 3.921 2.826 0.000 -0.028 0.000 3/24480 230.0 5.326 3.741 2.698 0.000 -0.027 0.000 3/24480 240.0 5.090 3.578 2.581 0.000 -0.026 0.000 3/24480 250.0 4.874 3.428 2.473 0.000 -0.025 0.000 3/24480 260.0 4.676 3.291 2.375 0.000 -0.024 0.000 3/24480 270.0 4.493 3.164 2.284 0.000 -0.023 0.000 3/24480 280.0 4.325 3.047 2.200 0.000 -0.022 0.000 3/24480 290.0 4.169 2.939 2.122 0.000 -0.022 0.000 3/24480 300.0 4.024 2.838 2.049 0.000 -0.021 0.000 3/24480 310.0 3.889 2.744 1.982 0.000 -0.020 0.000 3/24480 320.0 3.763 2.656 1.918 0.000 -0.020 0.000 3/24480 330.0 3.645 2.574 1.859 0.000 -0.019 0.000 3/24480 340.0 3.534 2.496 1.803 0.000 -0.019 0.000 3/24480 350.0 3.430 2.423 1.750 0.000 -0.018 0.000 3/24480 360.0 3.332 2.355 1.701 0.000 -0.018 0.000 3/24480 370.0 3.239 2.290 1.654 0.000 -0.017 0.000 3/24480 380.0 3.151 2.229 1.610 0.000 -0.017 0.000 3/24480 390.0 3.069 2.170 1.568 0.000 -0.016 0.000 3/24480 400.0 2.990 2.115 1.528 0.000 -0.016 0.000 3/24480 410.0 2.915 2.063 1.491 0.000 -0.016 0.000 3/24480 420.0 2.844 2.013 1.455 0.000 -0.015 0.000 3/24480 430.0 2.777 1.966 1.420 0.000 -0.015 0.000 3/24480 440.0 2.713 1.921 1.388 0.000 -0.015 0.000 3/24480 450.0 2.651 1.877 1.356 0.000 -0.014 0.000 3/24480 460.0 2.592 1.836 1.327 0.000 -0.014 0.000 3/24480 470.0 2.536 1.797 1.298 0.000 -0.014 0.000 3/24480 480.0 2.483 1.759 1.271 0.000 -0.014 0.000 3/24480 490.0 2.431 1.722 1.245 0.000 -0.013 0.000 3/24480 500.0 2.382 1.688 1.220 0.000 -0.013 0.000 3/24480 510.0 2.334 1.654 1.195 0.000 -0.013 0.000 3/24480 520.0 2.289 1.622 1.172 0.000 -0.012 0.000 3/24480 530.0 2.245 1.591 1.150 0.000 -0.012 0.000 3/24480 540.0 2.203 1.562 1.129 0.000 -0.012 0.000 3/24480 550.0 2.162 1.533 1.108 0.000 -0.012 0.000 3/24480 560.0 2.123 1.505 1.088 0.000 -0.012 0.000 3/24480 570.0 2.086 1.479 1.069 0.000 -0.011 0.000 3/24480 580.0 2.049 1.453 1.050 0.000 -0.011 0.000 3/24480 590.0 2.014 1.428 1.032 0.000 -0.011 0.000 3/24480 600.0 1.980 1.404 1.015 0.000 -0.011 0.000 3/24480 610.0 1.947 1.381 0.998 0.000 -0.011 0.000 3/24480 620.0 1.916 1.359 0.982 0.000 -0.011 0.000 3/24480 630.0 1.885 1.337 0.966 0.000 -0.010 0.000 3/24480 640.0 1.855 1.316 0.951 0.000 -0.010 0.000 3/24480 650.0 1.826 1.296 0.936 0.000 -0.010 0.000 3/24480 660.0 1.799 1.276 0.922 0.000 -0.010 0.000 3/24480 670.0 1.772 1.257 0.908 0.000 -0.010 0.000 3/24480 680.0 1.745 1.238 0.895 0.000 -0.010 0.000 3/24480 690.0 1.720 1.220 0.882 0.000 -0.009 0.000 3/24480 700.0 1.695 1.203 0.869 0.000 -0.009 0.000 3/24480 710.0 1.671 1.186 0.857 0.000 -0.009 0.000 3/24480 720.0 1.648 1.169 0.845 0.000 -0.009 0.000 3/24480 730.0 1.625 1.153 0.833 0.000 -0.009 0.000 3/24480 740.0 1.603 1.138 0.822 0.000 -0.009 0.000 3/24480 750.0 1.581 1.122 0.811 0.000 -0.009 0.000 3/24480 760.0 1.560 1.108 0.800 0.000 -0.009 0.000 3/24480 770.0 1.540 1.093 0.790 0.000 -0.009 0.000 3/24480 780.0 1.520 1.079 0.780 0.000 -0.008 0.000 3/24480 790.0 1.501 1.065 0.770 0.000 -0.008 0.000 3/24480 800.0 1.482 1.052 0.760 0.000 -0.008 0.000 3/24480 810.0 1.463 1.039 0.751 0.000 -0.008 0.000 3/24480 820.0 1.445 1.026 0.742 0.000 -0.008 0.000 3/24480 830.0 1.428 1.014 0.733 0.000 -0.008 0.000 3/24480 840.0 1.411 1.002 0.724 0.000 -0.008 0.000 3/24480 850.0 1.394 0.990 0.715 0.000 -0.008 0.000 3/24480 860.0 1.378 0.978 0.707 0.000 -0.008 0.000 3/24480 870.0 1.362 0.967 0.699 0.000 -0.008 0.000 3/24480 880.0 1.346 0.956 0.691 0.000 -0.007 0.000 3/24480 890.0 1.331 0.945 0.683 0.000 -0.007 0.000 3/24480 900.0 1.316 0.935 0.676 0.000 -0.007 0.000 3/24480 910.0 1.302 0.925 0.668 0.000 -0.007 0.000 3/24480 920.0 1.288 0.915 0.661 0.000 -0.007 0.000 3/24480 930.0 1.274 0.905 0.654 0.000 -0.007 0.000 3/24480 940.0 1.260 0.895 0.647 0.000 -0.007 0.000 3/24480 950.0 1.247 0.886 0.640 0.000 -0.007 0.000 3/24480 960.0 1.234 0.876 0.633 0.000 -0.007 0.000 3/24480 970.0 1.221 0.867 0.627 0.000 -0.007 0.000 3/24480 980.0 1.209 0.858 0.620 0.000 -0.007 0.000 3/24480 990.0 1.196 0.850 0.614 0.000 -0.007 0.000 3/24480 1000.0 1.184 0.841 0.608 0.000 -0.007 0.000 3/24480 Thermal conductivity related properties were written into "kappa-m17512.hdf5". Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-08 20:47:03]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|