----------------------------- ------- calculate fc2 ------- ----------------------------- _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1 -------------------------[time 2026-01-07 18:35:33]------------------------- Compiled with OpenMP support (max 48 threads). Running in phonopy.load mode. Python version 3.14.2 Spglib version 2.6.1 Crystal structure was read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". Unit of length: angstrom Settings: Supercell: [2 1 1] Primitive matrix: [0. 0.5 0.5] [0.5 0. 0.5] [0.5 0.5 0. ] Spacegroup: Fddd (70) Number of symmetry operations in supercell: 64 ------------------------------ primitive cell ------------------------------ Lattice vectors: a 0.000000000000000 5.493695655000000 5.579979745000000 b 2.951580880000000 0.000000000000000 5.579979745000000 c 2.951580880000000 5.493695655000000 0.000000000000000 Atomic positions (fractional): *1 N 0.40380191680615 0.84825053157859 0.95893690869299 14.007 2 N 0.78901064292227 0.95893690869299 0.84825053157859 14.007 *3 N 0.87586003143890 0.87586003143890 0.62413996856110 14.007 4 N 0.62413996856110 0.62413996856110 0.87586003143890 14.007 5 N 0.37413996856110 0.37413996856110 0.62586003143890 14.007 6 N 0.62586003143890 0.62586003143890 0.37413996856110 14.007 7 N 0.40174946842141 0.84619808319385 0.46098935707773 14.007 8 N 0.29106309130701 0.46098935707773 0.84619808319385 14.007 9 N 0.46098935707773 0.29106309130701 0.40174946842141 14.007 10 N 0.84619808319385 0.40174946842141 0.29106309130701 14.007 11 N 0.84825053157859 0.40380191680615 0.78901064292227 14.007 12 N 0.95893690869299 0.78901064292227 0.40380191680615 14.007 *13 Ca 0.00000000000000 0.00000000000000 0.00000000000000 40.078 14 Ca 0.25000000000000 0.25000000000000 0.25000000000000 40.078 -------------------------------- unit cell --------------------------------- Lattice vectors: a 5.903161760000000 0.000000000000000 0.000000000000000 b 0.000000000000000 10.987391310000000 0.000000000000000 c 0.000000000000000 0.000000000000000 11.159959490000000 Atomic positions (fractional): *1 N 0.90359372013579 0.68136941274957 0.62602622419237 14.007 > 1 2 N 0.90359372013579 0.81863058725043 0.87397377580763 14.007 > 2 *3 N 0.75000000000000 0.75000000000000 0.87586003143890 14.007 > 3 4 N 0.75000000000000 0.75000000000000 0.62413996856110 14.007 > 4 5 N 0.50000000000000 0.00000000000000 0.87413996856110 14.007 > 5 6 N 0.00000000000000 0.00000000000000 0.62586003143890 14.007 > 6 7 N 0.15359372013579 0.93136941274957 0.62397377580763 14.007 > 7 8 N 0.15359372013579 0.56863058725043 0.87602622419237 14.007 > 8 9 N 0.34640627986421 0.93136941274957 0.87602622419237 14.007 > 9 10 N 0.34640627986421 0.56863058725043 0.62397377580763 14.007 > 10 11 N 0.59640627986421 0.81863058725043 0.62602622419237 14.007 > 11 12 N 0.59640627986421 0.68136941274957 0.87397377580763 14.007 > 12 13 N 0.90359372013579 0.18136941274957 0.12602622419237 14.007 > 1 14 N 0.90359372013579 0.31863058725043 0.37397377580763 14.007 > 2 15 N 0.75000000000000 0.25000000000000 0.37586003143890 14.007 > 3 16 N 0.75000000000000 0.25000000000000 0.12413996856110 14.007 > 4 17 N 0.50000000000000 0.50000000000000 0.37413996856110 14.007 > 5 18 N 0.00000000000000 0.50000000000000 0.12586003143890 14.007 > 6 19 N 0.15359372013579 0.43136941274957 0.12397377580763 14.007 > 7 20 N 0.15359372013579 0.06863058725043 0.37602622419237 14.007 > 8 21 N 0.34640627986421 0.43136941274957 0.37602622419237 14.007 > 9 22 N 0.34640627986421 0.06863058725043 0.12397377580763 14.007 > 10 23 N 0.59640627986421 0.31863058725043 0.12602622419237 14.007 > 11 24 N 0.59640627986421 0.18136941274957 0.37397377580763 14.007 > 12 25 N 0.40359372013579 0.68136941274957 0.12602622419237 14.007 > 1 26 N 0.40359372013579 0.81863058725043 0.37397377580763 14.007 > 2 27 N 0.25000000000000 0.75000000000000 0.37586003143890 14.007 > 3 28 N 0.25000000000000 0.75000000000000 0.12413996856110 14.007 > 4 29 N 0.00000000000000 0.00000000000000 0.37413996856110 14.007 > 5 30 N 0.50000000000000 0.00000000000000 0.12586003143890 14.007 > 6 31 N 0.65359372013579 0.93136941274957 0.12397377580763 14.007 > 7 32 N 0.65359372013579 0.56863058725043 0.37602622419237 14.007 > 8 33 N 0.84640627986421 0.93136941274957 0.37602622419237 14.007 > 9 34 N 0.84640627986421 0.56863058725043 0.12397377580763 14.007 > 10 35 N 0.09640627986421 0.81863058725043 0.12602622419237 14.007 > 11 36 N 0.09640627986421 0.68136941274957 0.37397377580763 14.007 > 12 37 N 0.40359372013579 0.18136941274957 0.62602622419237 14.007 > 1 38 N 0.40359372013579 0.31863058725043 0.87397377580763 14.007 > 2 39 N 0.25000000000000 0.25000000000000 0.87586003143890 14.007 > 3 40 N 0.25000000000000 0.25000000000000 0.62413996856110 14.007 > 4 41 N 0.00000000000000 0.50000000000000 0.87413996856110 14.007 > 5 42 N 0.50000000000000 0.50000000000000 0.62586003143890 14.007 > 6 43 N 0.65359372013579 0.43136941274957 0.62397377580763 14.007 > 7 44 N 0.65359372013579 0.06863058725043 0.87602622419237 14.007 > 8 45 N 0.84640627986421 0.43136941274957 0.87602622419237 14.007 > 9 46 N 0.84640627986421 0.06863058725043 0.62397377580763 14.007 > 10 47 N 0.09640627986421 0.31863058725043 0.62602622419237 14.007 > 11 48 N 0.09640627986421 0.18136941274957 0.87397377580763 14.007 > 12 *49 Ca 0.00000000000000 0.00000000000000 0.00000000000000 40.078 > 13 50 Ca 0.25000000000000 0.75000000000000 0.75000000000000 40.078 > 14 51 Ca 0.00000000000000 0.50000000000000 0.50000000000000 40.078 > 13 52 Ca 0.25000000000000 0.25000000000000 0.25000000000000 40.078 > 14 53 Ca 0.50000000000000 0.00000000000000 0.50000000000000 40.078 > 13 54 Ca 0.75000000000000 0.75000000000000 0.25000000000000 40.078 > 14 55 Ca 0.50000000000000 0.50000000000000 0.00000000000000 40.078 > 13 56 Ca 0.75000000000000 0.25000000000000 0.75000000000000 40.078 > 14 -------------------------------- super cell -------------------------------- Lattice vectors: a 11.806323519999999 0.000000000000000 0.000000000000000 b 0.000000000000000 10.987391310000000 0.000000000000000 c 0.000000000000000 0.000000000000000 11.159959490000000 Atomic positions (fractional): *1 N 0.45179686006789 0.68136941274957 0.62602622419237 14.007 > 1 2 N 0.95179686006789 0.68136941274957 0.62602622419237 14.007 > 1 3 N 0.45179686006789 0.81863058725043 0.87397377580763 14.007 > 2 4 N 0.95179686006789 0.81863058725043 0.87397377580763 14.007 > 2 *5 N 0.37500000000000 0.75000000000000 0.87586003143890 14.007 > 3 6 N 0.87500000000000 0.75000000000000 0.87586003143890 14.007 > 3 7 N 0.37500000000000 0.75000000000000 0.62413996856110 14.007 > 4 8 N 0.87500000000000 0.75000000000000 0.62413996856110 14.007 > 4 9 N 0.25000000000000 0.00000000000000 0.87413996856110 14.007 > 5 10 N 0.75000000000000 0.00000000000000 0.87413996856110 14.007 > 5 11 N 0.00000000000000 0.00000000000000 0.62586003143890 14.007 > 6 12 N 0.50000000000000 0.00000000000000 0.62586003143890 14.007 > 6 13 N 0.07679686006789 0.93136941274957 0.62397377580763 14.007 > 7 14 N 0.57679686006789 0.93136941274957 0.62397377580763 14.007 > 7 15 N 0.07679686006789 0.56863058725043 0.87602622419237 14.007 > 8 16 N 0.57679686006789 0.56863058725043 0.87602622419237 14.007 > 8 17 N 0.17320313993211 0.93136941274957 0.87602622419237 14.007 > 9 18 N 0.67320313993211 0.93136941274957 0.87602622419237 14.007 > 9 19 N 0.17320313993211 0.56863058725043 0.62397377580763 14.007 > 10 20 N 0.67320313993211 0.56863058725043 0.62397377580763 14.007 > 10 21 N 0.29820313993211 0.81863058725043 0.62602622419237 14.007 > 11 22 N 0.79820313993211 0.81863058725043 0.62602622419237 14.007 > 11 23 N 0.29820313993211 0.68136941274957 0.87397377580763 14.007 > 12 24 N 0.79820313993211 0.68136941274957 0.87397377580763 14.007 > 12 25 N 0.45179686006789 0.18136941274957 0.12602622419237 14.007 > 1 26 N 0.95179686006789 0.18136941274957 0.12602622419237 14.007 > 1 27 N 0.45179686006789 0.31863058725043 0.37397377580763 14.007 > 2 28 N 0.95179686006789 0.31863058725043 0.37397377580763 14.007 > 2 29 N 0.37500000000000 0.25000000000000 0.37586003143890 14.007 > 3 30 N 0.87500000000000 0.25000000000000 0.37586003143890 14.007 > 3 31 N 0.37500000000000 0.25000000000000 0.12413996856110 14.007 > 4 32 N 0.87500000000000 0.25000000000000 0.12413996856110 14.007 > 4 33 N 0.25000000000000 0.50000000000000 0.37413996856110 14.007 > 5 34 N 0.75000000000000 0.50000000000000 0.37413996856110 14.007 > 5 35 N 0.00000000000000 0.50000000000000 0.12586003143890 14.007 > 6 36 N 0.50000000000000 0.50000000000000 0.12586003143890 14.007 > 6 37 N 0.07679686006789 0.43136941274957 0.12397377580763 14.007 > 7 38 N 0.57679686006789 0.43136941274957 0.12397377580763 14.007 > 7 39 N 0.07679686006789 0.06863058725043 0.37602622419237 14.007 > 8 40 N 0.57679686006789 0.06863058725043 0.37602622419237 14.007 > 8 41 N 0.17320313993211 0.43136941274957 0.37602622419237 14.007 > 9 42 N 0.67320313993211 0.43136941274957 0.37602622419237 14.007 > 9 43 N 0.17320313993211 0.06863058725043 0.12397377580763 14.007 > 10 44 N 0.67320313993211 0.06863058725043 0.12397377580763 14.007 > 10 45 N 0.29820313993211 0.31863058725043 0.12602622419237 14.007 > 11 46 N 0.79820313993211 0.31863058725043 0.12602622419237 14.007 > 11 47 N 0.29820313993211 0.18136941274957 0.37397377580763 14.007 > 12 48 N 0.79820313993211 0.18136941274957 0.37397377580763 14.007 > 12 49 N 0.20179686006789 0.68136941274957 0.12602622419237 14.007 > 1 50 N 0.70179686006789 0.68136941274957 0.12602622419237 14.007 > 1 51 N 0.20179686006789 0.81863058725043 0.37397377580763 14.007 > 2 52 N 0.70179686006789 0.81863058725043 0.37397377580763 14.007 > 2 53 N 0.12500000000000 0.75000000000000 0.37586003143890 14.007 > 3 54 N 0.62500000000000 0.75000000000000 0.37586003143890 14.007 > 3 55 N 0.12500000000000 0.75000000000000 0.12413996856110 14.007 > 4 56 N 0.62500000000000 0.75000000000000 0.12413996856110 14.007 > 4 57 N 0.00000000000000 0.00000000000000 0.37413996856110 14.007 > 5 58 N 0.50000000000000 0.00000000000000 0.37413996856110 14.007 > 5 59 N 0.25000000000000 0.00000000000000 0.12586003143890 14.007 > 6 60 N 0.75000000000000 0.00000000000000 0.12586003143890 14.007 > 6 61 N 0.32679686006789 0.93136941274957 0.12397377580763 14.007 > 7 62 N 0.82679686006789 0.93136941274957 0.12397377580763 14.007 > 7 63 N 0.32679686006789 0.56863058725043 0.37602622419237 14.007 > 8 64 N 0.82679686006789 0.56863058725043 0.37602622419237 14.007 > 8 65 N 0.42320313993211 0.93136941274957 0.37602622419237 14.007 > 9 66 N 0.92320313993211 0.93136941274957 0.37602622419237 14.007 > 9 67 N 0.42320313993211 0.56863058725043 0.12397377580763 14.007 > 10 68 N 0.92320313993211 0.56863058725043 0.12397377580763 14.007 > 10 69 N 0.04820313993211 0.81863058725043 0.12602622419237 14.007 > 11 70 N 0.54820313993211 0.81863058725043 0.12602622419237 14.007 > 11 71 N 0.04820313993211 0.68136941274957 0.37397377580763 14.007 > 12 72 N 0.54820313993211 0.68136941274957 0.37397377580763 14.007 > 12 73 N 0.20179686006789 0.18136941274957 0.62602622419237 14.007 > 1 74 N 0.70179686006789 0.18136941274957 0.62602622419237 14.007 > 1 75 N 0.20179686006789 0.31863058725043 0.87397377580763 14.007 > 2 76 N 0.70179686006789 0.31863058725043 0.87397377580763 14.007 > 2 77 N 0.12500000000000 0.25000000000000 0.87586003143890 14.007 > 3 78 N 0.62500000000000 0.25000000000000 0.87586003143890 14.007 > 3 79 N 0.12500000000000 0.25000000000000 0.62413996856110 14.007 > 4 80 N 0.62500000000000 0.25000000000000 0.62413996856110 14.007 > 4 81 N 0.00000000000000 0.50000000000000 0.87413996856110 14.007 > 5 82 N 0.50000000000000 0.50000000000000 0.87413996856110 14.007 > 5 83 N 0.25000000000000 0.50000000000000 0.62586003143890 14.007 > 6 84 N 0.75000000000000 0.50000000000000 0.62586003143890 14.007 > 6 85 N 0.32679686006789 0.43136941274957 0.62397377580763 14.007 > 7 86 N 0.82679686006789 0.43136941274957 0.62397377580763 14.007 > 7 87 N 0.32679686006789 0.06863058725043 0.87602622419237 14.007 > 8 88 N 0.82679686006789 0.06863058725043 0.87602622419237 14.007 > 8 89 N 0.42320313993211 0.43136941274957 0.87602622419237 14.007 > 9 90 N 0.92320313993211 0.43136941274957 0.87602622419237 14.007 > 9 91 N 0.42320313993211 0.06863058725043 0.62397377580763 14.007 > 10 92 N 0.92320313993211 0.06863058725043 0.62397377580763 14.007 > 10 93 N 0.04820313993211 0.31863058725043 0.62602622419237 14.007 > 11 94 N 0.54820313993211 0.31863058725043 0.62602622419237 14.007 > 11 95 N 0.04820313993211 0.18136941274957 0.87397377580763 14.007 > 12 96 N 0.54820313993211 0.18136941274957 0.87397377580763 14.007 > 12 *97 Ca 0.00000000000000 0.00000000000000 0.00000000000000 40.078 > 13 98 Ca 0.50000000000000 0.00000000000000 0.00000000000000 40.078 > 13 99 Ca 0.12500000000000 0.75000000000000 0.75000000000000 40.078 > 14 100 Ca 0.62500000000000 0.75000000000000 0.75000000000000 40.078 > 14 101 Ca 0.00000000000000 0.50000000000000 0.50000000000000 40.078 > 13 102 Ca 0.50000000000000 0.50000000000000 0.50000000000000 40.078 > 13 103 Ca 0.12500000000000 0.25000000000000 0.25000000000000 40.078 > 14 104 Ca 0.62500000000000 0.25000000000000 0.25000000000000 40.078 > 14 105 Ca 0.25000000000000 0.00000000000000 0.50000000000000 40.078 > 13 106 Ca 0.75000000000000 0.00000000000000 0.50000000000000 40.078 > 13 107 Ca 0.37500000000000 0.75000000000000 0.25000000000000 40.078 > 14 108 Ca 0.87500000000000 0.75000000000000 0.25000000000000 40.078 > 14 109 Ca 0.25000000000000 0.50000000000000 0.00000000000000 40.078 > 13 110 Ca 0.75000000000000 0.50000000000000 0.00000000000000 40.078 > 13 111 Ca 0.37500000000000 0.25000000000000 0.75000000000000 40.078 > 14 112 Ca 0.87500000000000 0.25000000000000 0.75000000000000 40.078 > 14 ---------------------------------------------------------------------------- NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". --------------------------- Dielectric constant ---------------------------- 3.9584472 0.0000000 0.0000000 0.0000000 3.3142002 0.0000000 0.0000000 0.0000000 2.4405456 -------------------------- Born effective charges -------------------------- 1 N -1.9026312 1.0188956 -0.0585535 0.9447352 -1.4038907 -0.1156410 -0.1124520 -0.1552528 -0.5336038 2 N -1.9026312 -1.0188956 0.0585535 -0.9447352 -1.4038907 -0.1156410 0.1124520 -0.1552528 -0.5336038 3 N 2.1325340 1.7795415 0.0000000 1.5479593 1.3816165 0.0000000 0.0000000 0.0000000 -0.0561840 4 N 2.1325340 -1.7795415 0.0000000 -1.5479593 1.3816165 0.0000000 0.0000000 0.0000000 -0.0561840 5 N 2.1325340 1.7795415 0.0000000 1.5479593 1.3816165 0.0000000 0.0000000 0.0000000 -0.0561840 6 N 2.1325340 -1.7795415 0.0000000 -1.5479593 1.3816165 0.0000000 0.0000000 0.0000000 -0.0561840 7 N -1.9026312 1.0188956 0.0585535 0.9447352 -1.4038907 0.1156410 0.1124520 0.1552528 -0.5336038 8 N -1.9026312 -1.0188956 -0.0585535 -0.9447352 -1.4038907 0.1156410 -0.1124520 0.1552528 -0.5336038 9 N -1.9026312 -1.0188956 0.0585535 -0.9447352 -1.4038907 -0.1156410 0.1124520 -0.1552528 -0.5336038 10 N -1.9026312 1.0188956 -0.0585535 0.9447352 -1.4038907 -0.1156410 -0.1124520 -0.1552528 -0.5336038 11 N -1.9026312 1.0188956 0.0585535 0.9447352 -1.4038907 0.1156410 0.1124520 0.1552528 -0.5336038 12 N -1.9026312 -1.0188956 -0.0585535 -0.9447352 -1.4038907 0.1156410 -0.1124520 0.1552528 -0.5336038 13 Ca 3.3454566 0.0000000 0.0000000 0.0000000 2.8523300 0.0000000 0.0000000 0.0000000 2.2467833 14 Ca 3.3454566 0.0000000 0.0000000 0.0000000 2.8523300 0.0000000 0.0000000 0.0000000 2.2467833 ---------------------------------------------------------------------------- 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: 336/336 Permutation basis: 11094/11094 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 972 Number of blocks in projector: 972 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: 202 Use standard eigh solver. --- Eigsh_solver_block: 2 / 6 --- Block_size: 188 Use standard eigh solver. --- Eigsh_solver_block: 3 / 6 --- Block_size: 186 Use standard eigh solver. --- Eigsh_solver_block: 4 / 6 --- Block_size: 132 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 132 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 132 Use standard eigh solver. Tree of FC basis block matrices: - (972, 955), data: False |-- (132, 129), data: True |-- (132, 129), data: True |-- (132, 129), data: True |-- (186, 184), data: True |-- (188, 186), data: True |-- (202, 198), data: True ----- Solver_atoms: 1 -- 112 / 112 Time (Solver_compr_matrix_reshape): 0.002 Solver_block: 100 / 240 - Time: 0.275 Solver_block: 200 / 240 - Time: 0.271 Solver_block: 240 / 240 - Time: 0.153 Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 0.712 --------------------------------- Symfc end -------------------------------- Max drift of force constants: -0.00000000 (xx) -0.00000000 (xx) Permutation basis: 336/336 Permutation basis: 11094/11094 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 972 Number of blocks in projector: 972 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: 202 Use standard eigh solver. --- Eigsh_solver_block: 2 / 6 --- Block_size: 188 Use standard eigh solver. --- Eigsh_solver_block: 3 / 6 --- Block_size: 186 Use standard eigh solver. --- Eigsh_solver_block: 4 / 6 --- Block_size: 132 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 132 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 132 Use standard eigh solver. Tree of FC basis block matrices: - (972, 955), data: False |-- (132, 129), data: True |-- (132, 129), data: True |-- (132, 129), data: True |-- (186, 184), data: True |-- (188, 186), data: True |-- (202, 198), data: True Max drift after symmetrization by symfc projector: -0.00000000 (xx) -0.00000000 (xx) Force constants are written into "force_constants.hdf5". ---------------------------------------------------------------------------- One of the following run modes may be specified for phonon calculations. - Mesh sampling (MESH, --mesh) - Q-points (QPOINTS, --qpoints) - Band structure (BAND, --band) - Animation (ANIME, --anime) - Modulation (MODULATION, --modulation) - Characters of Irreps (IRREPS, --irreps) - Create displacements (CREATE_DISPLACEMENTS, -d) ---------------------------------------------------------------------------- Summary of calculation was written in "phonopy.yaml". -------------------------[time 2026-01-07 18:35:42]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate fc3 ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-07 18:35:43]------------------------- Compiled with OpenMP support (max 48 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: force constants HDF5 data compression filter: gzip Crystal structure was read from "phono3py_mlp_eval_fc3_disp.yaml.xz". Supercell (dim): [2 1 1] Primitive matrix: [0. 0.5 0.5] [0.5 0. 0.5] [0.5 0.5 0. ] Spacegroup: Fddd (70) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 0.000000000000000 5.493695655000000 5.579979745000000 b 2.951580880000000 0.000000000000000 5.579979745000000 c 2.951580880000000 5.493695655000000 0.000000000000000 Atomic positions (fractional): 1 N 0.40380191680615 0.84825053157859 0.95893690869299 14.007 2 N 0.78901064292227 0.95893690869299 0.84825053157859 14.007 3 N 0.87586003143890 0.87586003143890 0.62413996856110 14.007 4 N 0.62413996856110 0.62413996856110 0.87586003143890 14.007 5 N 0.37413996856110 0.37413996856110 0.62586003143890 14.007 6 N 0.62586003143890 0.62586003143890 0.37413996856110 14.007 7 N 0.40174946842141 0.84619808319385 0.46098935707773 14.007 8 N 0.29106309130701 0.46098935707773 0.84619808319385 14.007 9 N 0.46098935707773 0.29106309130701 0.40174946842141 14.007 10 N 0.84619808319385 0.40174946842141 0.29106309130701 14.007 11 N 0.84825053157859 0.40380191680615 0.78901064292227 14.007 12 N 0.95893690869299 0.78901064292227 0.40380191680615 14.007 13 Ca 0.00000000000000 0.00000000000000 0.00000000000000 40.078 14 Ca 0.25000000000000 0.25000000000000 0.25000000000000 40.078 -------------------------------- supercell --------------------------------- Lattice vectors: a 11.806323519999999 0.000000000000000 0.000000000000000 b 0.000000000000000 10.987391310000000 0.000000000000000 c 0.000000000000000 0.000000000000000 11.159959490000000 Atomic positions (fractional): 1 N 0.45179686006789 0.68136941274957 0.62602622419237 14.007 > 1 2 N 0.95179686006789 0.68136941274957 0.62602622419237 14.007 > 1 3 N 0.45179686006789 0.81863058725043 0.87397377580763 14.007 > 3 4 N 0.95179686006789 0.81863058725043 0.87397377580763 14.007 > 3 5 N 0.37500000000000 0.75000000000000 0.87586003143890 14.007 > 5 6 N 0.87500000000000 0.75000000000000 0.87586003143890 14.007 > 5 7 N 0.37500000000000 0.75000000000000 0.62413996856110 14.007 > 7 8 N 0.87500000000000 0.75000000000000 0.62413996856110 14.007 > 7 9 N 0.25000000000000 0.00000000000000 0.87413996856110 14.007 > 9 10 N 0.75000000000000 0.00000000000000 0.87413996856110 14.007 > 9 11 N 0.00000000000000 0.00000000000000 0.62586003143890 14.007 > 11 12 N 0.50000000000000 0.00000000000000 0.62586003143890 14.007 > 11 13 N 0.07679686006789 0.93136941274957 0.62397377580763 14.007 > 13 14 N 0.57679686006789 0.93136941274957 0.62397377580763 14.007 > 13 15 N 0.07679686006789 0.56863058725043 0.87602622419237 14.007 > 15 16 N 0.57679686006789 0.56863058725043 0.87602622419237 14.007 > 15 17 N 0.17320313993211 0.93136941274957 0.87602622419237 14.007 > 17 18 N 0.67320313993211 0.93136941274957 0.87602622419237 14.007 > 17 19 N 0.17320313993211 0.56863058725043 0.62397377580763 14.007 > 19 20 N 0.67320313993211 0.56863058725043 0.62397377580763 14.007 > 19 21 N 0.29820313993211 0.81863058725043 0.62602622419237 14.007 > 21 22 N 0.79820313993211 0.81863058725043 0.62602622419237 14.007 > 21 23 N 0.29820313993211 0.68136941274957 0.87397377580763 14.007 > 23 24 N 0.79820313993211 0.68136941274957 0.87397377580763 14.007 > 23 25 N 0.45179686006789 0.18136941274957 0.12602622419237 14.007 > 1 26 N 0.95179686006789 0.18136941274957 0.12602622419237 14.007 > 1 27 N 0.45179686006789 0.31863058725043 0.37397377580763 14.007 > 3 28 N 0.95179686006789 0.31863058725043 0.37397377580763 14.007 > 3 29 N 0.37500000000000 0.25000000000000 0.37586003143890 14.007 > 5 30 N 0.87500000000000 0.25000000000000 0.37586003143890 14.007 > 5 31 N 0.37500000000000 0.25000000000000 0.12413996856110 14.007 > 7 32 N 0.87500000000000 0.25000000000000 0.12413996856110 14.007 > 7 33 N 0.25000000000000 0.50000000000000 0.37413996856110 14.007 > 9 34 N 0.75000000000000 0.50000000000000 0.37413996856110 14.007 > 9 35 N 0.00000000000000 0.50000000000000 0.12586003143890 14.007 > 11 36 N 0.50000000000000 0.50000000000000 0.12586003143890 14.007 > 11 37 N 0.07679686006789 0.43136941274957 0.12397377580763 14.007 > 13 38 N 0.57679686006789 0.43136941274957 0.12397377580763 14.007 > 13 39 N 0.07679686006789 0.06863058725043 0.37602622419237 14.007 > 15 40 N 0.57679686006789 0.06863058725043 0.37602622419237 14.007 > 15 41 N 0.17320313993211 0.43136941274957 0.37602622419237 14.007 > 17 42 N 0.67320313993211 0.43136941274957 0.37602622419237 14.007 > 17 43 N 0.17320313993211 0.06863058725043 0.12397377580763 14.007 > 19 44 N 0.67320313993211 0.06863058725043 0.12397377580763 14.007 > 19 45 N 0.29820313993211 0.31863058725043 0.12602622419237 14.007 > 21 46 N 0.79820313993211 0.31863058725043 0.12602622419237 14.007 > 21 47 N 0.29820313993211 0.18136941274957 0.37397377580763 14.007 > 23 48 N 0.79820313993211 0.18136941274957 0.37397377580763 14.007 > 23 49 N 0.20179686006789 0.68136941274957 0.12602622419237 14.007 > 1 50 N 0.70179686006789 0.68136941274957 0.12602622419237 14.007 > 1 51 N 0.20179686006789 0.81863058725043 0.37397377580763 14.007 > 3 52 N 0.70179686006789 0.81863058725043 0.37397377580763 14.007 > 3 53 N 0.12500000000000 0.75000000000000 0.37586003143890 14.007 > 5 54 N 0.62500000000000 0.75000000000000 0.37586003143890 14.007 > 5 55 N 0.12500000000000 0.75000000000000 0.12413996856110 14.007 > 7 56 N 0.62500000000000 0.75000000000000 0.12413996856110 14.007 > 7 57 N 0.00000000000000 0.00000000000000 0.37413996856110 14.007 > 9 58 N 0.50000000000000 0.00000000000000 0.37413996856110 14.007 > 9 59 N 0.25000000000000 0.00000000000000 0.12586003143890 14.007 > 11 60 N 0.75000000000000 0.00000000000000 0.12586003143890 14.007 > 11 61 N 0.32679686006789 0.93136941274957 0.12397377580763 14.007 > 13 62 N 0.82679686006789 0.93136941274957 0.12397377580763 14.007 > 13 63 N 0.32679686006789 0.56863058725043 0.37602622419237 14.007 > 15 64 N 0.82679686006789 0.56863058725043 0.37602622419237 14.007 > 15 65 N 0.42320313993211 0.93136941274957 0.37602622419237 14.007 > 17 66 N 0.92320313993211 0.93136941274957 0.37602622419237 14.007 > 17 67 N 0.42320313993211 0.56863058725043 0.12397377580763 14.007 > 19 68 N 0.92320313993211 0.56863058725043 0.12397377580763 14.007 > 19 69 N 0.04820313993211 0.81863058725043 0.12602622419237 14.007 > 21 70 N 0.54820313993211 0.81863058725043 0.12602622419237 14.007 > 21 71 N 0.04820313993211 0.68136941274957 0.37397377580763 14.007 > 23 72 N 0.54820313993211 0.68136941274957 0.37397377580763 14.007 > 23 73 N 0.20179686006789 0.18136941274957 0.62602622419237 14.007 > 1 74 N 0.70179686006789 0.18136941274957 0.62602622419237 14.007 > 1 75 N 0.20179686006789 0.31863058725043 0.87397377580763 14.007 > 3 76 N 0.70179686006789 0.31863058725043 0.87397377580763 14.007 > 3 77 N 0.12500000000000 0.25000000000000 0.87586003143890 14.007 > 5 78 N 0.62500000000000 0.25000000000000 0.87586003143890 14.007 > 5 79 N 0.12500000000000 0.25000000000000 0.62413996856110 14.007 > 7 80 N 0.62500000000000 0.25000000000000 0.62413996856110 14.007 > 7 81 N 0.00000000000000 0.50000000000000 0.87413996856110 14.007 > 9 82 N 0.50000000000000 0.50000000000000 0.87413996856110 14.007 > 9 83 N 0.25000000000000 0.50000000000000 0.62586003143890 14.007 > 11 84 N 0.75000000000000 0.50000000000000 0.62586003143890 14.007 > 11 85 N 0.32679686006789 0.43136941274957 0.62397377580763 14.007 > 13 86 N 0.82679686006789 0.43136941274957 0.62397377580763 14.007 > 13 87 N 0.32679686006789 0.06863058725043 0.87602622419237 14.007 > 15 88 N 0.82679686006789 0.06863058725043 0.87602622419237 14.007 > 15 89 N 0.42320313993211 0.43136941274957 0.87602622419237 14.007 > 17 90 N 0.92320313993211 0.43136941274957 0.87602622419237 14.007 > 17 91 N 0.42320313993211 0.06863058725043 0.62397377580763 14.007 > 19 92 N 0.92320313993211 0.06863058725043 0.62397377580763 14.007 > 19 93 N 0.04820313993211 0.31863058725043 0.62602622419237 14.007 > 21 94 N 0.54820313993211 0.31863058725043 0.62602622419237 14.007 > 21 95 N 0.04820313993211 0.18136941274957 0.87397377580763 14.007 > 23 96 N 0.54820313993211 0.18136941274957 0.87397377580763 14.007 > 23 97 Ca 0.00000000000000 0.00000000000000 0.00000000000000 40.078 > 97 98 Ca 0.50000000000000 0.00000000000000 0.00000000000000 40.078 > 97 99 Ca 0.12500000000000 0.75000000000000 0.75000000000000 40.078 > 99 100 Ca 0.62500000000000 0.75000000000000 0.75000000000000 40.078 > 99 101 Ca 0.00000000000000 0.50000000000000 0.50000000000000 40.078 > 97 102 Ca 0.50000000000000 0.50000000000000 0.50000000000000 40.078 > 97 103 Ca 0.12500000000000 0.25000000000000 0.25000000000000 40.078 > 99 104 Ca 0.62500000000000 0.25000000000000 0.25000000000000 40.078 > 99 105 Ca 0.25000000000000 0.00000000000000 0.50000000000000 40.078 > 97 106 Ca 0.75000000000000 0.00000000000000 0.50000000000000 40.078 > 97 107 Ca 0.37500000000000 0.75000000000000 0.25000000000000 40.078 > 99 108 Ca 0.87500000000000 0.75000000000000 0.25000000000000 40.078 > 99 109 Ca 0.25000000000000 0.50000000000000 0.00000000000000 40.078 > 97 110 Ca 0.75000000000000 0.50000000000000 0.00000000000000 40.078 > 97 111 Ca 0.37500000000000 0.25000000000000 0.75000000000000 40.078 > 99 112 Ca 0.87500000000000 0.25000000000000 0.75000000000000 40.078 > 99 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz". --------------------------- Dielectric constant ---------------------------- 3.9584472 0.0000000 0.0000000 0.0000000 3.3142002 0.0000000 0.0000000 0.0000000 2.4405456 -------------------------- Born effective charges -------------------------- 1 N -1.9026312 1.0188956 -0.0585535 0.9447352 -1.4038907 -0.1156410 -0.1124520 -0.1552528 -0.5336038 2 N -1.9026312 -1.0188956 0.0585535 -0.9447352 -1.4038907 -0.1156410 0.1124520 -0.1552528 -0.5336038 3 N 2.1325340 1.7795415 0.0000000 1.5479593 1.3816165 0.0000000 0.0000000 0.0000000 -0.0561840 4 N 2.1325340 -1.7795415 0.0000000 -1.5479593 1.3816165 0.0000000 0.0000000 0.0000000 -0.0561840 5 N 2.1325340 1.7795415 0.0000000 1.5479593 1.3816165 0.0000000 0.0000000 0.0000000 -0.0561840 6 N 2.1325340 -1.7795415 0.0000000 -1.5479593 1.3816165 0.0000000 0.0000000 0.0000000 -0.0561840 7 N -1.9026312 1.0188956 0.0585535 0.9447352 -1.4038907 0.1156410 0.1124520 0.1552528 -0.5336038 8 N -1.9026312 -1.0188956 -0.0585535 -0.9447352 -1.4038907 0.1156410 -0.1124520 0.1552528 -0.5336038 9 N -1.9026312 -1.0188956 0.0585535 -0.9447352 -1.4038907 -0.1156410 0.1124520 -0.1552528 -0.5336038 10 N -1.9026312 1.0188956 -0.0585535 0.9447352 -1.4038907 -0.1156410 -0.1124520 -0.1552528 -0.5336038 11 N -1.9026312 1.0188956 0.0585535 0.9447352 -1.4038907 0.1156410 0.1124520 0.1552528 -0.5336038 12 N -1.9026312 -1.0188956 -0.0585535 -0.9447352 -1.4038907 0.1156410 -0.1124520 0.1552528 -0.5336038 13 Ca 3.3454566 0.0000000 0.0000000 0.0000000 2.8523300 0.0000000 0.0000000 0.0000000 2.2467833 14 Ca 3.3454566 0.0000000 0.0000000 0.0000000 2.8523300 0.0000000 0.0000000 0.0000000 2.2467833 ---------------------------------------------------------------------------- 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] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100] Computing fc3[ 5, 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] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100] Computing fc3[ 97, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100] Expanding fc3. Symmetrizing fc3 by traditional approach (N=3). Symmetrizing fc2 by traditional approach (N=3). Max drift of fc3: 0.00000005 (xzy) 0.00000005 (xzy) 0.00000005 (xyz) fc3 was written into "fc3.hdf5". Max drift of fc2: 0.00000002 (xy) 0.00000002 (xy) fc2 was written into "fc2.hdf5". --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperatures: 0.0 300.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 ----------- None of ph-ph interaction calculation was performed. ----------- Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-07 18:35:52]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate LTC ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-07 18:35:52]------------------------- Compiled with OpenMP support (max 48 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: conductivity-RTA HDF5 data compression filter: gzip Crystal structure was read from "phono3py.yaml". Supercell (dim): [2 1 1] Primitive matrix: [0. 0.5 0.5] [0.5 0. 0.5] [0.5 0.5 0. ] Spacegroup: Fddd (70) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 0.000000000000000 5.493695655000000 5.579979745000000 b 2.951580880000000 0.000000000000000 5.579979745000000 c 2.951580880000000 5.493695655000000 0.000000000000000 Atomic positions (fractional): 1 N 0.40380191680615 0.84825053157859 0.95893690869299 14.007 2 N 0.78901064292227 0.95893690869299 0.84825053157859 14.007 3 N 0.87586003143890 0.87586003143890 0.62413996856110 14.007 4 N 0.62413996856110 0.62413996856110 0.87586003143890 14.007 5 N 0.37413996856110 0.37413996856110 0.62586003143890 14.007 6 N 0.62586003143890 0.62586003143890 0.37413996856110 14.007 7 N 0.40174946842141 0.84619808319385 0.46098935707773 14.007 8 N 0.29106309130701 0.46098935707773 0.84619808319385 14.007 9 N 0.46098935707773 0.29106309130701 0.40174946842141 14.007 10 N 0.84619808319385 0.40174946842141 0.29106309130701 14.007 11 N 0.84825053157859 0.40380191680615 0.78901064292227 14.007 12 N 0.95893690869299 0.78901064292227 0.40380191680615 14.007 13 Ca 0.00000000000000 0.00000000000000 0.00000000000000 40.078 14 Ca 0.25000000000000 0.25000000000000 0.25000000000000 40.078 -------------------------------- supercell --------------------------------- Lattice vectors: a 11.806323519999999 0.000000000000000 0.000000000000000 b 0.000000000000000 10.987391310000000 0.000000000000000 c 0.000000000000000 0.000000000000000 11.159959490000000 Atomic positions (fractional): 1 N 0.45179686006789 0.68136941274957 0.62602622419237 14.007 > 1 2 N 0.95179686006789 0.68136941274957 0.62602622419237 14.007 > 1 3 N 0.45179686006789 0.81863058725043 0.87397377580763 14.007 > 3 4 N 0.95179686006789 0.81863058725043 0.87397377580763 14.007 > 3 5 N 0.37500000000000 0.75000000000000 0.87586003143890 14.007 > 5 6 N 0.87500000000000 0.75000000000000 0.87586003143890 14.007 > 5 7 N 0.37500000000000 0.75000000000000 0.62413996856110 14.007 > 7 8 N 0.87500000000000 0.75000000000000 0.62413996856110 14.007 > 7 9 N 0.25000000000000 0.00000000000000 0.87413996856110 14.007 > 9 10 N 0.75000000000000 0.00000000000000 0.87413996856110 14.007 > 9 11 N 0.00000000000000 0.00000000000000 0.62586003143890 14.007 > 11 12 N 0.50000000000000 0.00000000000000 0.62586003143890 14.007 > 11 13 N 0.07679686006789 0.93136941274957 0.62397377580763 14.007 > 13 14 N 0.57679686006789 0.93136941274957 0.62397377580763 14.007 > 13 15 N 0.07679686006789 0.56863058725043 0.87602622419237 14.007 > 15 16 N 0.57679686006789 0.56863058725043 0.87602622419237 14.007 > 15 17 N 0.17320313993211 0.93136941274957 0.87602622419237 14.007 > 17 18 N 0.67320313993211 0.93136941274957 0.87602622419237 14.007 > 17 19 N 0.17320313993211 0.56863058725043 0.62397377580763 14.007 > 19 20 N 0.67320313993211 0.56863058725043 0.62397377580763 14.007 > 19 21 N 0.29820313993211 0.81863058725043 0.62602622419237 14.007 > 21 22 N 0.79820313993211 0.81863058725043 0.62602622419237 14.007 > 21 23 N 0.29820313993211 0.68136941274957 0.87397377580763 14.007 > 23 24 N 0.79820313993211 0.68136941274957 0.87397377580763 14.007 > 23 25 N 0.45179686006789 0.18136941274957 0.12602622419237 14.007 > 1 26 N 0.95179686006789 0.18136941274957 0.12602622419237 14.007 > 1 27 N 0.45179686006789 0.31863058725043 0.37397377580763 14.007 > 3 28 N 0.95179686006789 0.31863058725043 0.37397377580763 14.007 > 3 29 N 0.37500000000000 0.25000000000000 0.37586003143890 14.007 > 5 30 N 0.87500000000000 0.25000000000000 0.37586003143890 14.007 > 5 31 N 0.37500000000000 0.25000000000000 0.12413996856110 14.007 > 7 32 N 0.87500000000000 0.25000000000000 0.12413996856110 14.007 > 7 33 N 0.25000000000000 0.50000000000000 0.37413996856110 14.007 > 9 34 N 0.75000000000000 0.50000000000000 0.37413996856110 14.007 > 9 35 N 0.00000000000000 0.50000000000000 0.12586003143890 14.007 > 11 36 N 0.50000000000000 0.50000000000000 0.12586003143890 14.007 > 11 37 N 0.07679686006789 0.43136941274957 0.12397377580763 14.007 > 13 38 N 0.57679686006789 0.43136941274957 0.12397377580763 14.007 > 13 39 N 0.07679686006789 0.06863058725043 0.37602622419237 14.007 > 15 40 N 0.57679686006789 0.06863058725043 0.37602622419237 14.007 > 15 41 N 0.17320313993211 0.43136941274957 0.37602622419237 14.007 > 17 42 N 0.67320313993211 0.43136941274957 0.37602622419237 14.007 > 17 43 N 0.17320313993211 0.06863058725043 0.12397377580763 14.007 > 19 44 N 0.67320313993211 0.06863058725043 0.12397377580763 14.007 > 19 45 N 0.29820313993211 0.31863058725043 0.12602622419237 14.007 > 21 46 N 0.79820313993211 0.31863058725043 0.12602622419237 14.007 > 21 47 N 0.29820313993211 0.18136941274957 0.37397377580763 14.007 > 23 48 N 0.79820313993211 0.18136941274957 0.37397377580763 14.007 > 23 49 N 0.20179686006789 0.68136941274957 0.12602622419237 14.007 > 1 50 N 0.70179686006789 0.68136941274957 0.12602622419237 14.007 > 1 51 N 0.20179686006789 0.81863058725043 0.37397377580763 14.007 > 3 52 N 0.70179686006789 0.81863058725043 0.37397377580763 14.007 > 3 53 N 0.12500000000000 0.75000000000000 0.37586003143890 14.007 > 5 54 N 0.62500000000000 0.75000000000000 0.37586003143890 14.007 > 5 55 N 0.12500000000000 0.75000000000000 0.12413996856110 14.007 > 7 56 N 0.62500000000000 0.75000000000000 0.12413996856110 14.007 > 7 57 N 0.00000000000000 0.00000000000000 0.37413996856110 14.007 > 9 58 N 0.50000000000000 0.00000000000000 0.37413996856110 14.007 > 9 59 N 0.25000000000000 0.00000000000000 0.12586003143890 14.007 > 11 60 N 0.75000000000000 0.00000000000000 0.12586003143890 14.007 > 11 61 N 0.32679686006789 0.93136941274957 0.12397377580763 14.007 > 13 62 N 0.82679686006789 0.93136941274957 0.12397377580763 14.007 > 13 63 N 0.32679686006789 0.56863058725043 0.37602622419237 14.007 > 15 64 N 0.82679686006789 0.56863058725043 0.37602622419237 14.007 > 15 65 N 0.42320313993211 0.93136941274957 0.37602622419237 14.007 > 17 66 N 0.92320313993211 0.93136941274957 0.37602622419237 14.007 > 17 67 N 0.42320313993211 0.56863058725043 0.12397377580763 14.007 > 19 68 N 0.92320313993211 0.56863058725043 0.12397377580763 14.007 > 19 69 N 0.04820313993211 0.81863058725043 0.12602622419237 14.007 > 21 70 N 0.54820313993211 0.81863058725043 0.12602622419237 14.007 > 21 71 N 0.04820313993211 0.68136941274957 0.37397377580763 14.007 > 23 72 N 0.54820313993211 0.68136941274957 0.37397377580763 14.007 > 23 73 N 0.20179686006789 0.18136941274957 0.62602622419237 14.007 > 1 74 N 0.70179686006789 0.18136941274957 0.62602622419237 14.007 > 1 75 N 0.20179686006789 0.31863058725043 0.87397377580763 14.007 > 3 76 N 0.70179686006789 0.31863058725043 0.87397377580763 14.007 > 3 77 N 0.12500000000000 0.25000000000000 0.87586003143890 14.007 > 5 78 N 0.62500000000000 0.25000000000000 0.87586003143890 14.007 > 5 79 N 0.12500000000000 0.25000000000000 0.62413996856110 14.007 > 7 80 N 0.62500000000000 0.25000000000000 0.62413996856110 14.007 > 7 81 N 0.00000000000000 0.50000000000000 0.87413996856110 14.007 > 9 82 N 0.50000000000000 0.50000000000000 0.87413996856110 14.007 > 9 83 N 0.25000000000000 0.50000000000000 0.62586003143890 14.007 > 11 84 N 0.75000000000000 0.50000000000000 0.62586003143890 14.007 > 11 85 N 0.32679686006789 0.43136941274957 0.62397377580763 14.007 > 13 86 N 0.82679686006789 0.43136941274957 0.62397377580763 14.007 > 13 87 N 0.32679686006789 0.06863058725043 0.87602622419237 14.007 > 15 88 N 0.82679686006789 0.06863058725043 0.87602622419237 14.007 > 15 89 N 0.42320313993211 0.43136941274957 0.87602622419237 14.007 > 17 90 N 0.92320313993211 0.43136941274957 0.87602622419237 14.007 > 17 91 N 0.42320313993211 0.06863058725043 0.62397377580763 14.007 > 19 92 N 0.92320313993211 0.06863058725043 0.62397377580763 14.007 > 19 93 N 0.04820313993211 0.31863058725043 0.62602622419237 14.007 > 21 94 N 0.54820313993211 0.31863058725043 0.62602622419237 14.007 > 21 95 N 0.04820313993211 0.18136941274957 0.87397377580763 14.007 > 23 96 N 0.54820313993211 0.18136941274957 0.87397377580763 14.007 > 23 97 Ca 0.00000000000000 0.00000000000000 0.00000000000000 40.078 > 97 98 Ca 0.50000000000000 0.00000000000000 0.00000000000000 40.078 > 97 99 Ca 0.12500000000000 0.75000000000000 0.75000000000000 40.078 > 99 100 Ca 0.62500000000000 0.75000000000000 0.75000000000000 40.078 > 99 101 Ca 0.00000000000000 0.50000000000000 0.50000000000000 40.078 > 97 102 Ca 0.50000000000000 0.50000000000000 0.50000000000000 40.078 > 97 103 Ca 0.12500000000000 0.25000000000000 0.25000000000000 40.078 > 99 104 Ca 0.62500000000000 0.25000000000000 0.25000000000000 40.078 > 99 105 Ca 0.25000000000000 0.00000000000000 0.50000000000000 40.078 > 97 106 Ca 0.75000000000000 0.00000000000000 0.50000000000000 40.078 > 97 107 Ca 0.37500000000000 0.75000000000000 0.25000000000000 40.078 > 99 108 Ca 0.87500000000000 0.75000000000000 0.25000000000000 40.078 > 99 109 Ca 0.25000000000000 0.50000000000000 0.00000000000000 40.078 > 97 110 Ca 0.75000000000000 0.50000000000000 0.00000000000000 40.078 > 97 111 Ca 0.37500000000000 0.25000000000000 0.75000000000000 40.078 > 99 112 Ca 0.87500000000000 0.25000000000000 0.75000000000000 40.078 > 99 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py.yaml". --------------------------- Dielectric constant ---------------------------- 3.9584472 0.0000000 0.0000000 0.0000000 3.3142002 0.0000000 0.0000000 0.0000000 2.4405456 -------------------------- Born effective charges -------------------------- 1 N -1.9026312 1.0188956 -0.0585535 0.9447352 -1.4038907 -0.1156410 -0.1124520 -0.1552528 -0.5336038 2 N -1.9026312 -1.0188956 0.0585535 -0.9447352 -1.4038907 -0.1156410 0.1124520 -0.1552528 -0.5336038 3 N 2.1325340 1.7795415 0.0000000 1.5479593 1.3816165 0.0000000 0.0000000 0.0000000 -0.0561840 4 N 2.1325340 -1.7795415 0.0000000 -1.5479593 1.3816165 0.0000000 0.0000000 0.0000000 -0.0561840 5 N 2.1325340 1.7795415 0.0000000 1.5479593 1.3816165 0.0000000 0.0000000 0.0000000 -0.0561840 6 N 2.1325340 -1.7795415 0.0000000 -1.5479593 1.3816165 0.0000000 0.0000000 0.0000000 -0.0561840 7 N -1.9026312 1.0188956 0.0585535 0.9447352 -1.4038907 0.1156410 0.1124520 0.1552528 -0.5336038 8 N -1.9026312 -1.0188956 -0.0585535 -0.9447352 -1.4038907 0.1156410 -0.1124520 0.1552528 -0.5336038 9 N -1.9026312 -1.0188956 0.0585535 -0.9447352 -1.4038907 -0.1156410 0.1124520 -0.1552528 -0.5336038 10 N -1.9026312 1.0188956 -0.0585535 0.9447352 -1.4038907 -0.1156410 -0.1124520 -0.1552528 -0.5336038 11 N -1.9026312 1.0188956 0.0585535 0.9447352 -1.4038907 0.1156410 0.1124520 0.1552528 -0.5336038 12 N -1.9026312 -1.0188956 -0.0585535 -0.9447352 -1.4038907 0.1156410 -0.1124520 0.1552528 -0.5336038 13 Ca 3.3454566 0.0000000 0.0000000 0.0000000 2.8523300 0.0000000 0.0000000 0.0000000 2.2467833 14 Ca 3.3454566 0.0000000 0.0000000 0.0000000 2.8523300 0.0000000 0.0000000 0.0000000 2.2467833 ---------------------------------------------------------------------------- fc3 was read from "fc3.hdf5". fc2 was read from "fc2.hdf5". ----------------------------- Force constants ------------------------------ Max drift of fc3: 0.00000005 (xzy) 0.00000005 (xzy) 0.00000005 (xyz) Max drift of fc2: -0.00000000 (xx) -0.00000000 (xx) --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperature: 0.0 10.0 20.0 30.0 40.0 ... 1000.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 Length for sampling mesh generation: 50.00 Generating grid system ... [ 11 11 11 ] fc3-r2q-transformation over three atoms: True --------------------------- Phonon calculations ---------------------------- Use NAC by Gonze et al. (no real space sum in current implementation) PRB 50, 13035(R) (1994), PRB 55, 10355 (1997) G-cutoff distance: 0.73, Number of G-points: 317, Lambda: 0.14 Running harmonic phonon calculations... -------------------- Lattice thermal conductivity (RTA) -------------------- ======================= Grid point 0 (1/216) ======================= q-point: ( 0.00 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 216 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 1.958 ( 0.000 0.000 0.000) 0.000 2.005 ( 0.000 0.000 0.000) 0.000 3.896 ( 0.000 0.000 0.000) 0.000 4.668 ( 0.000 0.000 0.000) 0.000 4.828 ( 0.000 0.000 0.000) 0.000 4.831 ( 0.000 0.000 0.000) 0.000 4.914 ( 0.000 0.000 0.000) 0.000 5.202 ( 0.000 0.000 0.000) 0.000 5.489 ( 0.000 0.000 0.000) 0.000 5.642 ( 0.000 0.000 0.000) 0.000 5.894 ( 0.000 0.000 0.000) 0.000 5.900 ( 0.000 0.000 -0.000) 0.000 6.332 ( 0.000 0.000 0.000) 0.000 6.355 ( 0.000 0.000 0.000) 0.000 6.438 ( 0.000 0.000 0.000) 0.000 6.672 ( 0.000 0.000 0.000) 0.000 6.744 ( 0.000 0.000 -0.000) 0.000 6.748 ( 0.000 0.000 0.000) 0.000 7.502 ( 0.000 0.000 0.000) 0.000 7.638 ( 0.000 0.000 -0.000) 0.000 7.705 ( 0.000 0.000 0.000) 0.000 7.723 ( 0.000 0.000 0.000) 0.000 9.026 ( 0.000 0.000 -0.000) 0.000 18.874 ( 0.000 0.000 0.000) 0.000 18.926 ( 0.000 0.000 0.000) 0.000 18.934 ( 0.000 0.000 0.000) 0.000 19.042 ( 0.000 0.000 0.000) 0.000 19.381 ( 0.000 0.000 0.000) 0.000 19.493 ( 0.000 0.000 0.000) 0.000 19.527 ( 0.000 0.000 0.000) 0.000 19.584 ( 0.000 0.000 0.000) 0.000 42.398 ( 0.000 0.000 -0.000) 0.000 42.418 ( 0.000 0.000 0.000) 0.000 42.633 ( 0.000 0.000 -0.000) 0.000 42.664 ( 0.000 0.000 0.000) 0.000 65.500 ( 0.000 0.000 0.000) 0.000 66.942 ( 0.000 0.000 -0.000) 0.000 67.417 ( 0.000 0.000 0.000) 0.000 67.658 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 1 (2/216) ======================= q-point: ( 0.09 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.580 ( -18.442 11.227 24.768) 32.857 0.873 ( -41.785 10.909 8.160) 43.950 1.306 ( -57.415 30.146 10.026) 65.618 2.030 ( -6.016 1.687 5.701) 8.458 2.200 ( -17.326 12.278 1.756) 21.307 4.016 ( -15.776 2.835 -4.777) 16.725 4.664 ( 1.073 1.698 -1.783) 2.686 4.795 ( 7.950 3.696 0.111) 8.768 4.886 ( -4.688 0.525 2.151) 5.185 4.908 ( 2.531 3.365 1.319) 4.412 5.050 ( 17.275 -0.231 7.520) 18.842 5.577 ( -3.521 -5.530 -0.651) 6.588 5.681 ( -4.366 3.151 3.094) 6.210 5.920 ( -4.196 -4.200 0.431) 5.953 6.132 ( 3.468 -12.563 -2.739) 13.318 6.217 ( 15.985 -1.647 -0.558) 16.079 6.329 ( 1.920 0.644 -3.105) 3.707 6.442 ( 0.266 10.903 -4.176) 11.679 6.713 ( 2.096 -3.655 0.044) 4.214 6.765 ( 0.258 0.053 2.472) 2.486 7.379 ( -15.264 -18.525 -5.515) 24.629 7.547 ( 6.913 -0.848 -0.397) 6.977 7.723 ( -0.745 -5.524 5.367) 7.738 7.748 ( -2.983 -0.117 0.191) 2.992 8.992 ( 2.422 -2.980 -0.616) 3.889 9.555 ( -3.807 -1.578 -22.829) 23.198 18.902 ( -1.536 -1.932 -0.466) 2.512 18.930 ( -0.296 0.155 0.275) 0.433 18.980 ( 0.037 5.612 -3.356) 6.539 19.076 ( 3.130 0.389 5.443) 6.290 19.381 ( 0.102 0.239 -0.022) 0.261 19.489 ( 0.342 -0.122 -0.125) 0.384 19.524 ( 0.051 -0.773 0.040) 0.776 19.578 ( 0.431 -0.372 -0.076) 0.574 42.416 ( -2.115 -0.148 0.032) 2.121 42.435 ( -1.951 0.666 -0.019) 2.062 42.611 ( 3.119 -0.754 0.027) 3.209 42.653 ( 1.174 1.621 -0.609) 2.092 65.541 ( -3.278 2.416 1.149) 4.231 66.920 ( 3.030 3.046 -2.588) 5.016 67.605 ( -3.808 -11.134 0.530) 11.779 69.131 ( -27.775 -4.851 -48.557) 56.149 ======================= Grid point 2 (3/216) ======================= q-point: ( 0.18 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.154 ( -18.369 11.865 22.896) 31.661 1.559 ( -28.802 6.823 8.728) 30.859 2.234 ( -10.276 3.371 9.650) 14.494 2.285 ( -23.729 30.167 8.348) 39.279 2.823 ( -45.202 13.320 3.224) 47.234 4.288 ( -19.206 2.724 -8.999) 21.384 4.575 ( 21.817 1.739 -0.678) 21.897 4.608 ( 6.521 -1.440 -3.625) 7.598 4.822 ( 4.355 3.471 3.493) 6.574 4.993 ( 1.780 12.813 6.629) 14.536 5.089 ( -8.994 0.219 7.591) 11.771 5.557 ( 3.378 4.800 -2.280) 6.296 5.762 ( 7.393 -6.488 -2.780) 10.221 5.829 ( 8.332 -7.532 -5.581) 12.542 5.947 ( 4.328 -12.465 -1.075) 13.239 5.980 ( -3.845 -3.667 1.844) 5.624 6.273 ( 3.059 4.733 -4.531) 7.231 6.512 ( -3.732 6.021 -5.276) 8.833 6.634 ( 3.089 -4.671 0.889) 5.670 6.761 ( 0.560 -0.778 -0.811) 1.256 7.414 ( 2.992 -3.298 -1.510) 4.702 7.443 ( -3.869 -2.917 -0.609) 4.883 7.732 ( -0.687 -6.750 5.983) 9.046 7.791 ( -2.036 -2.093 3.411) 4.490 8.891 ( 4.417 -5.886 -2.269) 7.701 9.352 ( 6.265 -6.962 -12.950) 15.982 18.906 ( -0.646 -0.499 -0.109) 0.823 18.941 ( -0.521 0.240 0.478) 0.746 19.006 ( -0.936 3.552 -1.515) 3.974 19.077 ( 1.272 1.002 2.154) 2.694 19.382 ( 0.185 0.406 -0.028) 0.447 19.479 ( 0.605 -0.261 -0.263) 0.709 19.506 ( 0.800 -2.350 0.010) 2.482 19.570 ( 0.210 0.057 -0.092) 0.236 42.454 ( -3.178 -0.625 0.127) 3.241 42.483 ( -2.837 1.262 0.005) 3.105 42.534 ( 4.571 -2.108 0.063) 5.034 42.647 ( 1.820 3.894 -1.220) 4.469 65.651 ( -5.680 3.931 1.807) 7.140 66.867 ( 4.891 6.784 -4.438) 9.468 67.559 ( -0.906 -10.874 1.406) 11.002 69.122 ( -13.239 -3.819 -22.396) 26.295 ======================= Grid point 3 (4/216) ======================= q-point: ( 0.27 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.707 ( -17.586 12.068 19.560) 28.939 2.043 ( -19.902 6.008 7.541) 22.114 2.476 ( -8.237 1.175 10.381) 13.304 2.846 ( -12.720 22.767 7.839) 27.232 3.598 ( -35.219 8.320 1.705) 36.228 4.191 ( 25.188 2.368 1.722) 25.358 4.302 ( 9.217 -0.927 -8.661) 12.681 4.506 ( 0.990 -2.829 -2.924) 4.187 4.954 ( -4.511 13.127 -5.170) 14.812 5.181 ( 0.807 7.903 3.958) 8.875 5.309 ( 21.952 3.714 2.417) 22.395 5.332 ( -15.108 0.538 8.897) 17.541 5.508 ( 5.006 -2.842 -4.236) 7.147 5.715 ( -2.310 -3.374 -2.161) 4.625 5.871 ( -3.305 -7.758 -3.287) 9.051 6.041 ( -1.381 -1.343 0.609) 2.020 6.265 ( -4.204 0.663 -3.014) 5.215 6.509 ( 2.052 -2.606 0.119) 3.319 6.634 ( -4.692 4.046 -4.738) 7.800 6.741 ( -2.500 -2.012 -2.765) 4.236 7.305 ( 5.580 -5.585 3.641) 8.694 7.503 ( -4.442 0.783 -2.875) 5.349 7.725 ( 0.517 -6.978 6.310) 9.422 7.834 ( -1.941 -1.726 3.376) 4.259 8.715 ( 6.081 -9.552 -6.768) 13.192 9.059 ( 11.728 -8.308 -6.937) 15.959 18.911 ( -0.311 -0.053 -0.046) 0.319 18.957 ( -0.645 0.277 0.591) 0.918 19.032 ( -0.526 1.072 -0.220) 1.215 19.098 ( -0.453 3.696 0.349) 3.740 19.382 ( 0.209 0.468 0.002) 0.512 19.456 ( 1.515 -2.746 -0.137) 3.139 19.468 ( 0.852 -1.377 -0.282) 1.643 19.571 ( -0.097 0.325 -0.074) 0.347 42.453 ( 3.083 -1.773 -0.033) 3.557 42.506 ( -3.465 -0.422 0.327) 3.506 42.528 ( -1.433 0.680 0.073) 1.588 42.639 ( 2.189 4.300 -1.581) 5.078 65.793 ( -6.150 3.566 1.726) 7.316 66.827 ( 4.525 11.777 -5.298) 13.683 67.474 ( 0.743 -13.753 2.462) 13.991 69.113 ( -7.858 -3.130 -12.485) 15.081 ======================= Grid point 4 (5/216) ======================= q-point: ( 0.36 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.184 ( -13.820 10.841 11.836) 21.181 2.434 ( -16.548 7.656 7.543) 19.732 2.653 ( -5.152 -4.020 9.987) 11.935 3.150 ( -1.302 10.031 5.380) 11.457 3.865 ( 10.595 -4.882 -2.909) 12.023 4.011 ( 8.267 14.213 0.419) 16.448 4.074 ( -1.112 -2.631 -10.889) 11.257 4.486 ( 2.832 3.398 10.029) 10.961 4.746 ( 16.467 0.113 -6.127) 17.571 5.144 ( 0.929 12.880 -3.764) 13.451 5.336 ( -1.840 -10.446 -3.341) 11.121 5.400 ( -0.224 0.955 0.815) 1.275 5.592 ( -5.557 -6.109 -1.300) 8.360 5.864 ( -4.365 1.317 1.286) 4.737 5.909 ( -11.760 12.000 5.998) 17.840 6.005 ( 2.015 -0.653 -1.441) 2.562 6.343 ( -8.664 -5.160 -1.865) 10.256 6.507 ( 0.206 8.062 2.893) 8.568 6.640 ( 0.701 -1.053 -4.168) 4.356 6.845 ( -13.409 0.144 -1.895) 13.543 7.216 ( 3.412 -4.691 4.040) 7.069 7.530 ( -0.540 -0.021 -0.759) 0.932 7.711 ( 0.411 -4.873 4.378) 6.563 7.872 ( -1.644 -1.451 1.792) 2.832 8.407 ( 11.547 -13.657 -11.583) 21.308 8.798 ( 9.596 -5.176 -0.885) 10.939 18.914 ( -0.151 0.063 -0.035) 0.168 18.974 ( -0.575 0.270 0.542) 0.836 19.038 ( 0.054 -0.172 0.129) 0.222 19.156 ( -1.799 5.354 -0.242) 5.653 19.383 ( 0.194 0.299 0.040) 0.359 19.392 ( 2.168 -4.607 -0.001) 5.092 19.450 ( 0.546 -0.378 -0.390) 0.770 19.575 ( -0.127 0.255 -0.059) 0.291 42.417 ( 0.081 -0.588 -0.009) 0.594 42.531 ( 1.193 -0.137 0.058) 1.202 42.558 ( -2.861 -0.176 0.300) 2.882 42.626 ( 1.824 3.148 -1.351) 3.881 65.908 ( -4.138 1.531 1.059) 4.537 66.852 ( 1.736 16.789 -5.248) 17.676 67.350 ( 1.944 -16.729 3.493) 17.200 69.109 ( -4.418 -2.042 -6.520) 8.137 ======================= Grid point 5 (6/216) ======================= q-point: ( 0.45 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.481 ( -7.936 7.659 2.067) 11.221 2.640 ( 1.939 -3.205 2.979) 4.786 2.871 ( -13.479 3.027 10.558) 17.387 3.203 ( 1.569 2.571 1.329) 3.292 3.550 ( 13.166 -4.653 -8.033) 16.109 3.951 ( 0.609 -3.495 1.208) 3.748 3.996 ( 8.878 6.304 -2.659) 11.209 4.500 ( 2.446 5.981 -1.199) 6.572 4.762 ( -7.116 0.620 6.390) 9.584 5.173 ( 1.243 3.435 -3.904) 5.347 5.242 ( 0.950 -2.076 -1.000) 2.493 5.419 ( -0.504 1.539 -4.346) 4.638 5.505 ( 2.256 -7.244 0.518) 7.605 5.953 ( -4.297 -0.968 -0.005) 4.404 5.976 ( 2.180 1.377 2.097) 3.323 6.151 ( -4.151 3.580 1.273) 5.627 6.390 ( -2.979 -1.978 -0.143) 3.578 6.572 ( 0.837 -2.592 -1.805) 3.267 6.704 ( -6.480 16.259 0.504) 17.510 6.915 ( 2.198 -11.420 1.367) 11.710 7.341 ( -14.095 7.237 5.505) 16.774 7.524 ( 1.730 2.600 0.844) 3.235 7.696 ( 0.244 -2.816 -1.563) 3.230 7.831 ( 5.449 -9.280 -2.721) 11.100 8.051 ( 7.981 -4.798 -4.017) 10.142 8.665 ( 3.356 -1.888 -0.084) 3.852 18.916 ( -0.048 0.035 -0.015) 0.061 18.986 ( -0.252 0.134 0.242) 0.375 19.035 ( 0.082 -0.152 0.022) 0.174 19.232 ( -2.295 5.619 -0.188) 6.073 19.314 ( 2.402 -5.363 0.064) 5.876 19.385 ( 0.044 0.174 0.051) 0.186 19.439 ( 0.222 -0.160 -0.182) 0.329 19.577 ( -0.050 0.091 -0.024) 0.106 42.438 ( -2.414 0.468 -0.020) 2.459 42.493 ( 2.899 -0.738 0.042) 2.992 42.593 ( -1.341 0.078 0.124) 1.349 42.615 ( 0.930 1.058 -0.538) 1.508 65.961 ( -1.262 0.181 0.312) 1.313 66.949 ( -0.711 14.191 -3.607) 14.660 67.211 ( 1.828 -13.740 3.070) 14.197 69.108 ( -1.449 -0.702 -2.033) 2.593 ======================= Grid point 12 (7/216) ======================= q-point: ( 0.09 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 216 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.425 ( -0.000 0.000 26.241) 26.241 0.484 ( -0.000 0.000 29.344) 29.344 0.849 ( -0.000 0.000 51.796) 51.796 2.023 ( -0.000 0.000 2.128) 2.128 2.073 ( -0.000 0.000 13.606) 13.606 3.820 ( 0.000 -0.000 -8.988) 8.988 4.643 ( 0.000 -0.000 -3.061) 3.061 4.834 ( -0.000 0.000 0.213) 0.213 4.877 ( -0.000 0.000 5.639) 5.639 4.931 ( -0.000 0.000 2.093) 2.093 5.227 ( -0.000 0.000 3.068) 3.068 5.589 ( 0.000 -0.000 -6.055) 6.055 5.880 ( 0.000 -0.000 -1.471) 1.471 5.923 ( -0.000 0.000 2.423) 2.423 6.285 ( 0.000 -0.000 -5.583) 5.583 6.296 ( 0.000 -0.000 -14.768) 14.768 6.343 ( 0.000 -0.000 -1.514) 1.514 6.600 ( 0.000 -0.000 -6.756) 6.756 6.781 ( -0.000 0.000 2.113) 2.113 6.821 ( -0.000 0.000 6.762) 6.762 6.864 ( -0.000 0.000 1.641) 1.641 7.383 ( 0.000 -0.000 -10.707) 10.707 7.747 ( -0.000 0.000 4.921) 4.921 7.834 ( -0.000 0.000 9.710) 9.710 8.894 ( 0.000 -0.000 -0.216) 0.216 9.018 ( 0.000 -0.000 -0.897) 0.897 18.875 ( -0.000 0.000 0.176) 0.176 18.931 ( -0.000 0.000 0.587) 0.587 18.933 ( 0.000 -0.000 -0.120) 0.120 19.193 ( 0.000 -0.000 -0.914) 0.914 19.385 ( -0.000 0.000 0.466) 0.466 19.491 ( 0.000 -0.000 -0.237) 0.237 19.528 ( -0.000 0.000 0.096) 0.096 19.583 ( 0.000 -0.000 -0.192) 0.192 42.398 ( -0.000 0.000 0.030) 0.030 42.417 ( 0.000 -0.000 -0.078) 0.078 42.634 ( -0.000 0.000 0.122) 0.122 42.664 ( 0.000 -0.000 -0.034) 0.034 65.519 ( -0.000 0.000 2.372) 2.372 66.869 ( 0.000 -0.000 -8.090) 8.090 67.465 ( -0.000 0.000 5.035) 5.035 67.663 ( -0.000 0.000 0.518) 0.518 ======================= Grid point 13 (8/216) ======================= q-point: ( 0.18 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.035 ( -19.883 9.438 25.080) 33.368 1.109 ( -32.760 7.393 19.993) 39.085 1.653 ( -38.498 21.066 32.264) 54.468 2.160 ( -11.893 0.494 6.936) 13.777 2.304 ( -9.294 13.365 13.653) 21.246 3.874 ( -16.034 2.715 -11.993) 20.207 4.609 ( 1.570 2.492 -4.839) 5.665 4.790 ( 7.900 1.233 -0.859) 8.041 4.902 ( 5.225 4.013 1.014) 6.665 5.002 ( -6.402 -1.677 8.342) 10.648 5.206 ( 11.062 0.854 10.068) 14.982 5.521 ( -1.092 -1.649 -5.836) 6.162 5.743 ( 3.351 0.237 2.048) 3.934 5.931 ( -0.878 -5.302 0.232) 5.379 6.045 ( 6.064 -11.034 -7.593) 14.703 6.191 ( 11.731 1.694 -3.951) 12.494 6.224 ( 4.776 2.700 -7.761) 9.505 6.372 ( -0.093 6.157 -3.275) 6.975 6.695 ( 1.127 -2.769 -2.019) 3.607 6.826 ( 4.432 -1.679 3.826) 6.091 7.269 ( -13.869 -10.602 -6.834) 18.747 7.485 ( -8.497 2.633 -6.643) 11.102 7.784 ( -1.508 -0.886 5.157) 5.446 7.858 ( 0.259 -8.704 9.232) 12.691 8.971 ( 2.624 -3.832 -2.136) 5.112 9.162 ( -12.003 9.236 -18.680) 24.048 18.894 ( -1.306 -0.241 -0.259) 1.353 18.939 ( -0.228 0.213 0.741) 0.804 18.950 ( -0.671 3.181 -0.787) 3.345 19.134 ( 3.516 -0.911 1.556) 3.952 19.384 ( 0.427 0.205 0.409) 0.626 19.485 ( 0.348 -0.148 -0.364) 0.525 19.526 ( 0.090 -0.785 0.119) 0.799 19.576 ( 0.382 -0.357 -0.245) 0.577 42.417 ( -2.154 -0.125 0.083) 2.159 42.434 ( -2.025 0.655 -0.053) 2.129 42.612 ( 3.067 -0.754 0.095) 3.160 42.643 ( 1.787 0.951 -0.512) 2.088 65.577 ( -2.952 2.469 3.338) 5.094 66.829 ( 0.697 2.040 -8.611) 8.877 67.622 ( -3.640 -9.848 1.504) 10.606 68.350 ( -49.383 17.985 -34.488) 62.861 ======================= Grid point 14 (9/216) ======================= q-point: ( 0.27 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.567 ( -13.851 9.747 25.056) 30.243 1.753 ( -24.222 4.718 14.821) 28.786 2.428 ( -10.770 7.047 12.512) 17.950 2.504 ( -15.764 20.033 18.868) 31.715 2.931 ( -41.320 14.065 10.909) 44.991 4.103 ( -20.050 2.740 -12.972) 24.037 4.519 ( 7.665 -2.514 -4.856) 9.416 4.586 ( 18.060 3.489 -1.084) 18.426 4.824 ( 5.186 5.038 -1.538) 7.392 5.158 ( -1.765 3.394 10.413) 11.093 5.241 ( -5.315 0.810 10.337) 11.651 5.508 ( 3.052 8.249 -2.769) 9.221 5.693 ( 10.474 -7.744 -6.060) 14.366 5.723 ( 3.786 -8.509 -6.505) 11.360 5.913 ( 9.179 -6.176 -3.051) 11.476 6.010 ( -5.087 -1.559 1.482) 5.523 6.176 ( 0.881 5.714 -7.201) 9.235 6.418 ( -4.039 5.264 -5.838) 8.838 6.629 ( 1.895 -4.015 -1.612) 4.724 6.742 ( 4.401 -1.580 -1.504) 4.912 7.328 ( -6.306 -0.965 -5.457) 8.395 7.498 ( 0.693 -4.567 3.743) 5.945 7.847 ( -2.061 -7.941 4.553) 9.382 7.855 ( -0.723 -3.276 7.412) 8.135 8.829 ( 5.483 -8.293 -5.666) 11.443 9.121 ( 2.470 0.541 -13.316) 13.554 18.905 ( -0.528 -0.095 -0.039) 0.538 18.953 ( -0.434 0.248 0.908) 1.036 18.988 ( -1.294 3.638 -0.727) 3.929 19.102 ( 1.592 -0.043 0.810) 1.787 19.383 ( 0.324 0.324 0.268) 0.531 19.472 ( 0.589 -0.304 -0.505) 0.833 19.507 ( 0.891 -2.402 0.023) 2.562 19.568 ( 0.127 0.106 -0.175) 0.240 42.457 ( -3.207 -0.544 0.229) 3.261 42.484 ( -2.898 1.174 0.015) 3.127 42.536 ( 4.618 -1.904 0.110) 4.996 42.625 ( 2.003 3.215 -1.342) 4.019 65.695 ( -4.939 3.654 3.605) 7.124 66.759 ( 2.897 5.982 -8.701) 10.949 67.590 ( -1.567 -11.164 2.383) 11.522 68.735 ( -23.550 5.766 -22.020) 32.752 ======================= Grid point 15 (10/216) ======================= q-point: ( 0.36 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.023 ( -11.004 10.619 16.793) 22.712 2.208 ( -17.340 4.235 13.576) 22.426 2.691 ( -6.037 -0.414 15.425) 16.570 3.011 ( -9.139 21.614 12.053) 26.381 3.640 ( -28.048 3.156 3.225) 28.409 4.119 ( 9.197 -1.381 -9.662) 13.411 4.231 ( 21.088 4.365 -0.751) 21.548 4.490 ( -4.845 -0.440 1.658) 5.140 4.844 ( 2.432 12.905 -8.018) 15.387 5.197 ( 15.190 -2.122 -1.786) 15.441 5.369 ( -0.771 -3.329 -2.415) 4.184 5.387 ( -1.075 -8.854 1.118) 8.988 5.533 ( -1.325 7.111 8.328) 11.031 5.656 ( -2.139 10.143 -2.353) 10.630 5.846 ( -6.433 -6.343 -0.640) 9.057 6.060 ( 2.889 1.441 1.846) 3.719 6.199 ( -8.604 0.109 -5.111) 10.008 6.482 ( -2.485 3.682 -3.128) 5.433 6.572 ( -1.264 1.586 -2.849) 3.497 6.680 ( -2.462 -2.121 -4.439) 5.501 7.332 ( 0.011 -4.138 -0.330) 4.151 7.505 ( -1.638 -2.446 2.914) 4.143 7.826 ( -0.113 -8.778 4.710) 9.963 7.899 ( -0.323 -2.601 5.668) 6.244 8.567 ( 8.436 -12.311 -11.010) 18.546 8.943 ( 7.852 -1.958 -6.862) 10.610 18.910 ( -0.228 0.097 -0.022) 0.249 18.970 ( -0.466 0.246 0.950) 1.087 19.029 ( -0.832 2.068 -0.174) 2.236 19.101 ( -0.170 2.451 -0.091) 2.459 19.384 ( 0.213 0.304 0.222) 0.432 19.452 ( 1.108 -1.613 -0.381) 1.994 19.463 ( 1.202 -2.534 -0.263) 2.816 19.570 ( -0.135 0.338 -0.100) 0.377 42.453 ( 3.140 -1.513 -0.004) 3.485 42.512 ( -3.212 -0.202 0.452) 3.250 42.530 ( -1.587 0.490 0.084) 1.663 42.611 ( 1.869 3.758 -1.704) 4.529 65.831 ( -5.064 2.874 2.998) 6.550 66.716 ( 2.254 11.048 -8.037) 13.847 67.522 ( -0.665 -15.281 3.286) 15.644 68.902 ( -12.794 3.310 -12.427) 18.140 ======================= Grid point 16 (11/216) ======================= q-point: ( 0.45 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.331 ( -6.361 9.745 6.510) 13.335 2.607 ( -12.838 4.485 12.811) 18.683 2.854 ( -2.817 -3.083 14.020) 14.629 3.254 ( 3.375 6.498 6.649) 9.891 3.757 ( 14.906 -5.215 -8.178) 17.784 3.919 ( -5.749 -0.182 -7.422) 9.390 4.059 ( 10.291 10.878 3.461) 15.369 4.590 ( 20.671 3.248 -9.026) 22.788 4.684 ( -10.051 2.653 10.237) 14.590 5.093 ( 1.356 10.156 -2.250) 10.490 5.277 ( -2.819 -12.359 -3.443) 13.135 5.364 ( -0.536 0.073 -5.069) 5.098 5.601 ( -0.877 -6.819 2.564) 7.338 5.873 ( -4.888 0.387 -0.379) 4.918 5.963 ( -8.801 10.912 0.521) 14.029 6.044 ( 2.347 3.532 4.677) 6.314 6.310 ( -7.896 -0.607 -1.492) 8.058 6.529 ( -1.837 10.130 -0.380) 10.302 6.579 ( 0.094 -1.018 -2.737) 2.922 6.821 ( -17.174 3.230 -1.043) 17.506 7.281 ( 1.822 -4.880 3.973) 6.552 7.526 ( -0.974 -1.525 0.414) 1.857 7.771 ( 0.787 -10.845 1.746) 11.013 7.915 ( 1.059 -2.656 4.117) 5.013 8.215 ( 10.490 -11.611 -11.534) 19.440 8.762 ( 7.638 -1.679 -3.276) 8.479 18.914 ( -0.117 0.139 -0.019) 0.183 18.984 ( -0.259 0.169 0.769) 0.829 19.039 ( 0.208 0.079 -0.019) 0.223 19.151 ( -1.957 5.175 -0.348) 5.544 19.384 ( 0.299 -0.349 0.116) 0.474 19.393 ( 1.942 -4.195 0.054) 4.622 19.442 ( 0.362 -0.325 -0.522) 0.713 19.574 ( -0.152 0.274 -0.062) 0.319 42.418 ( 0.208 -0.378 0.024) 0.432 42.532 ( 1.129 -0.290 0.042) 1.167 42.563 ( -2.416 0.213 0.306) 2.444 42.605 ( 0.844 2.667 -1.255) 3.065 65.930 ( -3.012 0.818 1.598) 3.507 66.758 ( -0.864 15.777 -6.083) 16.932 67.409 ( 0.472 -19.078 3.592) 19.419 69.003 ( -6.910 3.361 -6.045) 9.777 ======================= Grid point 17 (12/216) ======================= q-point: ( 0.55 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.511 ( -2.746 8.670 1.868) 9.285 2.694 ( 7.478 -4.904 3.491) 9.600 3.012 ( 2.172 -3.102 4.282) 5.716 3.235 ( 1.640 -1.046 3.120) 3.677 3.467 ( 4.488 0.608 -1.026) 4.644 3.930 ( -4.898 -2.685 -2.237) 6.017 3.980 ( 10.149 2.242 -0.706) 10.418 4.439 ( -1.571 8.425 -5.907) 10.409 4.846 ( 1.728 -3.887 2.863) 5.127 5.149 ( 1.054 11.086 1.555) 11.244 5.246 ( -5.594 -10.728 0.534) 12.111 5.370 ( -4.265 6.153 0.058) 7.487 5.542 ( 1.789 -9.759 3.304) 10.457 5.892 ( -3.053 -0.928 -4.256) 5.319 6.049 ( 3.206 1.649 3.199) 4.819 6.124 ( -1.613 6.345 -4.294) 7.830 6.382 ( -0.474 2.998 -0.516) 3.079 6.547 ( 0.227 2.929 -0.962) 3.092 6.718 ( -6.967 11.367 1.470) 13.413 6.947 ( 2.529 -12.523 2.098) 12.947 7.420 ( -10.061 4.568 3.436) 11.571 7.525 ( -0.169 -0.565 -1.272) 1.402 7.637 ( -1.689 -7.403 -3.892) 8.532 7.830 ( 6.963 -6.703 2.440) 9.968 8.001 ( 1.393 -0.868 -2.364) 2.878 8.649 ( 3.405 1.039 -1.733) 3.959 18.916 ( -0.038 0.090 0.002) 0.098 18.990 ( 0.198 -0.075 0.319) 0.383 19.035 ( 0.207 0.110 -0.070) 0.245 19.229 ( -2.452 5.629 -0.176) 6.142 19.315 ( 2.306 -5.339 0.052) 5.816 19.386 ( -0.024 -0.206 0.062) 0.216 19.436 ( -0.078 0.022 -0.196) 0.212 19.577 ( -0.079 0.123 -0.017) 0.147 42.438 ( -2.371 0.550 0.038) 2.434 42.493 ( 2.926 -0.782 -0.007) 3.028 42.595 ( -1.152 0.354 0.106) 1.210 42.607 ( 0.004 0.839 -0.392) 0.927 65.966 ( -0.561 -0.076 0.338) 0.660 66.893 ( -3.656 15.921 -3.159) 16.638 67.257 ( 1.142 -19.654 2.527) 19.849 69.078 ( -2.933 4.123 -1.534) 5.287 ======================= Grid point 18 (13/216) ======================= q-point: (-0.36 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.434 ( 15.100 -9.986 -3.724) 18.483 2.602 ( 1.870 5.136 -1.689) 5.721 2.722 ( 17.850 -6.358 -6.760) 20.119 3.202 ( 1.848 -4.894 1.276) 5.384 3.654 ( -10.851 5.968 2.409) 12.616 3.933 ( -8.446 -4.490 0.651) 9.587 4.046 ( -12.141 -0.871 3.386) 12.634 4.498 ( -1.903 -3.736 -0.398) 4.212 4.655 ( 7.945 -2.442 -6.627) 10.630 5.240 ( -3.334 -8.231 3.422) 9.517 5.282 ( -0.234 11.626 3.257) 12.076 5.452 ( 0.757 -11.223 0.487) 11.259 5.579 ( -4.895 9.174 8.864) 13.664 5.854 ( 1.756 -0.834 -6.909) 7.177 6.028 ( 3.499 1.963 3.573) 5.372 6.087 ( 5.209 0.609 -6.283) 8.184 6.381 ( 2.821 5.742 -1.121) 6.495 6.601 ( 0.025 3.785 1.689) 4.145 6.692 ( 8.351 -16.214 -1.204) 18.278 6.915 ( -3.168 7.594 1.600) 8.382 7.250 ( 11.578 -6.203 -5.550) 14.259 7.500 ( -2.268 -0.389 -1.818) 2.933 7.716 ( 2.433 -4.844 1.580) 5.646 7.874 ( -0.357 3.768 1.718) 4.156 8.133 ( -18.338 12.254 5.593) 22.753 8.652 ( -2.331 4.488 -1.588) 5.301 18.916 ( 0.058 0.019 0.023) 0.065 18.983 ( 0.622 -0.293 -0.124) 0.698 19.034 ( 0.082 0.359 -0.073) 0.375 19.235 ( 2.172 -5.650 0.141) 6.054 19.313 ( -2.499 5.402 -0.054) 5.953 19.384 ( -0.144 -0.465 -0.029) 0.487 19.441 ( -0.473 0.285 0.119) 0.565 19.578 ( 0.024 -0.062 0.022) 0.070 42.438 ( 2.542 -0.394 0.061) 2.573 42.492 ( -2.962 0.696 -0.073) 3.044 42.591 ( 1.592 0.049 -0.088) 1.595 42.623 ( -1.895 -1.123 0.481) 2.255 65.956 ( 1.744 -0.364 -0.203) 1.794 67.007 ( -1.883 -9.729 3.387) 10.473 67.160 ( -2.357 5.449 -3.081) 6.689 69.141 ( -0.142 5.159 1.821) 5.472 ======================= Grid point 19 (14/216) ======================= q-point: (-0.27 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.991 ( 20.337 -13.912 -9.905) 26.557 2.347 ( 18.645 -6.417 -3.680) 20.059 2.539 ( 7.294 1.650 -4.013) 8.487 3.088 ( 6.426 -10.704 -2.302) 12.695 3.837 ( -16.324 -1.146 -3.708) 16.779 4.065 ( 6.419 -10.766 4.921) 13.466 4.247 ( -0.269 2.462 8.760) 9.103 4.353 ( -13.352 -1.553 -5.675) 14.591 4.799 ( -22.590 1.034 0.631) 22.622 5.211 ( 0.085 -14.169 4.236) 14.789 5.339 ( 3.464 -5.563 -3.162) 7.276 5.405 ( -0.022 9.354 2.252) 9.621 5.611 ( 13.428 -1.130 0.844) 13.502 5.765 ( 8.990 -0.937 -7.643) 11.837 5.918 ( 2.284 -0.402 4.345) 4.925 6.040 ( 1.319 3.140 1.956) 3.927 6.362 ( 7.283 3.297 0.591) 8.016 6.443 ( -1.449 -5.164 -4.454) 6.972 6.699 ( -0.848 4.503 2.640) 5.289 6.886 ( 11.439 -1.581 3.201) 11.983 7.147 ( -3.730 4.571 -4.213) 7.249 7.541 ( -1.894 3.318 0.254) 3.829 7.661 ( 1.636 -1.442 -1.316) 2.547 7.845 ( 2.642 -0.526 -1.588) 3.127 8.580 ( -10.694 12.641 9.332) 19.006 8.786 ( -12.709 9.432 -2.367) 16.002 18.915 ( 0.181 0.011 0.029) 0.183 18.967 ( 0.780 -0.333 -0.267) 0.889 19.035 ( 0.093 0.392 -0.128) 0.422 19.159 ( 1.730 -5.603 0.109) 5.864 19.383 ( -0.251 -0.528 0.010) 0.585 19.392 ( -2.249 4.726 0.008) 5.233 19.455 ( -0.671 0.388 0.204) 0.802 19.576 ( 0.110 -0.241 0.036) 0.268 42.418 ( 0.026 0.761 0.019) 0.761 42.530 ( -1.264 0.009 -0.045) 1.265 42.554 ( 3.111 0.361 -0.179) 3.137 42.646 ( -2.572 -3.384 0.898) 4.344 65.895 ( 4.762 -1.930 -0.489) 5.162 66.922 ( -3.016 -17.923 3.087) 18.435 67.302 ( -3.394 15.293 -2.256) 15.826 69.201 ( 1.635 6.412 4.385) 7.939 ======================= Grid point 20 (15/216) ======================= q-point: (-0.18 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.460 ( 22.316 -15.002 -8.800) 28.293 1.955 ( 22.462 -6.214 -2.969) 23.494 2.363 ( 9.896 -3.289 -3.417) 10.974 2.760 ( 15.119 -22.489 -2.639) 27.227 3.584 ( 37.883 -9.654 -0.263) 39.095 4.157 ( -27.196 -0.625 -1.402) 27.240 4.428 ( -5.308 0.663 5.577) 7.728 4.541 ( -11.184 1.063 0.323) 11.240 5.007 ( 17.617 -13.466 1.652) 22.236 5.127 ( 6.525 -19.109 -1.245) 20.231 5.198 ( 8.770 1.002 -5.956) 10.648 5.299 ( -30.314 0.323 0.068) 30.315 5.568 ( -3.183 -3.380 2.354) 5.205 5.712 ( -2.719 17.216 -1.206) 17.471 5.949 ( 7.212 6.299 4.760) 10.693 6.023 ( 6.175 4.859 -1.900) 8.083 6.302 ( -1.739 -5.754 1.475) 6.189 6.491 ( -3.058 8.418 -1.275) 9.046 6.707 ( 7.230 -5.303 3.320) 9.562 6.765 ( 1.069 1.978 0.221) 2.260 7.248 ( -6.319 5.917 -2.294) 8.956 7.564 ( 4.336 -0.839 3.366) 5.553 7.646 ( -0.708 6.248 -3.100) 7.010 7.784 ( 2.282 -0.273 -2.252) 3.218 8.786 ( -4.374 6.791 2.087) 8.343 9.147 ( -15.620 13.690 3.129) 21.005 18.911 ( 0.359 0.182 0.024) 0.403 18.950 ( 0.738 -0.305 -0.194) 0.821 19.036 ( 0.154 0.187 0.127) 0.273 19.092 ( 0.926 -5.233 -0.255) 5.321 19.383 ( -0.245 -0.509 0.035) 0.566 19.458 ( -1.624 3.130 0.036) 3.526 19.471 ( -0.774 0.973 0.109) 1.248 19.572 ( 0.078 -0.319 0.026) 0.330 42.454 ( -3.071 1.939 0.019) 3.631 42.502 ( 3.622 0.557 -0.120) 3.667 42.527 ( 1.348 -0.807 -0.030) 1.571 42.658 ( -2.523 -4.605 0.675) 5.294 65.774 ( 6.733 -3.885 -0.556) 7.793 66.885 ( -5.622 -12.289 1.810) 13.634 67.446 ( -1.579 12.930 -0.910) 13.058 69.269 ( 2.572 8.004 5.528) 10.062 ======================= Grid point 21 (16/216) ======================= q-point: (-0.09 0.09 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.940 ( 23.094 -15.084 -0.000) 27.584 1.485 ( 30.607 -7.558 -0.000) 31.526 2.153 ( 11.971 -5.581 -0.000) 13.208 2.217 ( 25.216 -30.353 -0.000) 39.461 2.801 ( 46.292 -12.318 -0.000) 47.903 4.368 ( 18.864 -2.944 -0.000) 19.093 4.574 ( -24.899 -0.369 0.000) 24.902 4.672 ( 2.851 -3.821 -0.000) 4.768 4.741 ( -12.731 -0.354 0.000) 12.736 4.961 ( -1.230 -15.635 0.000) 15.683 5.017 ( 10.799 1.490 -0.000) 10.901 5.575 ( -3.642 -4.206 0.000) 5.563 5.786 ( -5.802 7.103 0.000) 9.171 5.881 ( -10.000 0.354 0.000) 10.006 5.952 ( -3.260 20.201 -0.000) 20.462 5.962 ( 4.339 4.757 -0.000) 6.439 6.313 ( -3.900 -4.895 0.000) 6.259 6.567 ( 4.196 -8.192 -0.000) 9.204 6.616 ( -4.052 7.236 0.000) 8.294 6.768 ( 0.752 0.337 -0.000) 0.824 7.394 ( -8.254 3.941 0.000) 9.146 7.487 ( 8.593 4.505 -0.000) 9.703 7.678 ( 1.780 5.584 -0.000) 5.861 7.757 ( -0.129 0.258 0.000) 0.288 8.909 ( -4.124 5.128 0.000) 6.581 9.471 ( -10.309 11.113 0.000) 15.158 18.907 ( 0.666 0.733 -0.000) 0.990 18.937 ( 0.554 -0.255 -0.000) 0.610 19.038 ( -0.136 -5.520 0.000) 5.521 19.039 ( 0.021 0.340 -0.000) 0.340 19.382 ( -0.167 -0.390 0.000) 0.425 19.481 ( -0.612 0.246 0.000) 0.660 19.506 ( -0.768 2.331 -0.000) 2.454 19.571 ( -0.235 -0.043 0.000) 0.239 42.453 ( 3.166 0.656 -0.000) 3.233 42.483 ( 2.824 -1.292 -0.000) 3.106 42.534 ( -4.556 2.184 0.000) 5.052 42.659 ( -1.913 -4.152 0.000) 4.572 65.636 ( 5.965 -4.008 -0.000) 7.187 66.903 ( -5.546 -7.194 0.000) 9.084 67.547 ( 0.716 10.842 -0.000) 10.866 69.332 ( 3.522 10.498 -0.000) 11.073 ======================= Grid point 24 (17/216) ======================= q-point: ( 0.18 0.18 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 216 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.857 ( -0.000 0.000 26.795) 26.795 0.950 ( -0.000 0.000 27.702) 27.702 1.683 ( -0.000 0.000 50.385) 50.385 2.074 ( -0.000 0.000 4.028) 4.028 2.375 ( -0.000 0.000 22.526) 22.526 3.620 ( 0.000 -0.000 -15.074) 15.074 4.567 ( 0.000 -0.000 -6.324) 6.324 4.831 ( 0.000 -0.000 -0.834) 0.834 4.982 ( -0.000 0.000 4.193) 4.193 4.994 ( -0.000 0.000 8.089) 8.089 5.300 ( -0.000 0.000 5.691) 5.691 5.461 ( 0.000 -0.000 -9.259) 9.259 5.854 ( 0.000 -0.000 -1.351) 1.351 5.967 ( -0.000 0.000 2.761) 2.761 6.000 ( 0.000 -0.000 -21.149) 21.149 6.157 ( 0.000 -0.000 -9.868) 9.868 6.305 ( 0.000 -0.000 -3.103) 3.103 6.476 ( 0.000 -0.000 -8.104) 8.104 6.802 ( -0.000 0.000 0.537) 0.537 6.899 ( -0.000 0.000 2.448) 2.448 6.922 ( -0.000 0.000 5.285) 5.285 7.205 ( 0.000 -0.000 -10.629) 10.629 7.853 ( -0.000 0.000 7.563) 7.563 7.988 ( -0.000 0.000 8.743) 8.743 8.889 ( 0.000 -0.000 -0.306) 0.306 8.998 ( 0.000 -0.000 -1.585) 1.585 18.880 ( -0.000 0.000 0.331) 0.331 18.930 ( 0.000 -0.000 -0.236) 0.236 18.945 ( -0.000 0.000 1.139) 1.139 19.173 ( 0.000 -0.000 -1.603) 1.603 19.395 ( -0.000 0.000 0.752) 0.752 19.485 ( 0.000 -0.000 -0.452) 0.452 19.530 ( -0.000 0.000 0.194) 0.194 19.578 ( 0.000 -0.000 -0.356) 0.356 42.399 ( -0.000 0.000 0.061) 0.061 42.415 ( 0.000 -0.000 -0.140) 0.140 42.637 ( -0.000 0.000 0.221) 0.221 42.663 ( 0.000 -0.000 -0.076) 0.076 65.576 ( -0.000 0.000 4.632) 4.632 66.706 ( 0.000 -0.000 -11.330) 11.330 67.555 ( -0.000 0.000 5.491) 5.491 67.675 ( -0.000 0.000 0.929) 0.929 ======================= Grid point 25 (18/216) ======================= q-point: ( 0.27 0.18 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.404 ( -24.921 7.182 22.373) 34.251 1.467 ( -24.582 9.274 22.166) 34.375 2.228 ( -9.924 10.053 13.456) 19.509 2.303 ( -25.681 5.243 33.807) 42.778 2.619 ( -3.235 8.670 22.964) 24.758 3.642 ( -17.296 2.921 -16.106) 23.814 4.506 ( 1.845 3.299 -7.915) 8.772 4.767 ( 7.586 -1.178 -1.975) 7.927 4.923 ( 8.719 2.459 1.325) 9.155 5.154 ( -8.370 -1.629 9.958) 13.110 5.349 ( 2.963 -2.477 3.263) 5.056 5.422 ( -2.872 4.672 -1.835) 5.782 5.712 ( 2.567 -6.997 -7.367) 10.480 5.823 ( 7.039 0.668 -11.637) 13.617 5.974 ( -0.030 -3.392 -2.270) 4.082 6.067 ( 1.603 7.258 -6.083) 9.605 6.157 ( 13.751 -1.892 -3.453) 14.304 6.324 ( 2.872 2.314 -3.313) 4.958 6.659 ( 2.456 -2.980 -2.082) 4.387 6.866 ( 7.883 -2.234 0.481) 8.208 7.173 ( -10.733 -4.241 -4.558) 12.408 7.372 ( -22.158 -0.031 -6.498) 23.092 7.892 ( 1.569 -0.893 7.440) 7.656 8.001 ( 2.005 -6.798 7.855) 10.580 8.909 ( 2.644 -2.815 -5.366) 6.611 8.982 ( -1.340 5.296 -4.841) 7.299 18.894 ( -0.827 0.345 0.153) 0.909 18.939 ( -0.513 2.078 -0.419) 2.181 18.958 ( -0.280 0.230 1.309) 1.358 19.138 ( 1.803 -0.757 -0.791) 2.109 19.394 ( 0.697 0.001 0.795) 1.058 19.477 ( 0.362 -0.192 -0.572) 0.704 19.528 ( 0.162 -0.821 0.201) 0.861 19.571 ( 0.300 -0.313 -0.377) 0.575 42.419 ( -2.224 -0.082 0.117) 2.228 42.433 ( -2.158 0.636 -0.076) 2.251 42.614 ( 3.131 -0.761 0.150) 3.226 42.637 ( 2.476 0.488 -0.254) 2.537 65.649 ( -2.501 2.349 5.403) 6.401 66.653 ( -1.865 1.811 -12.341) 12.612 67.651 ( -3.180 -8.200 2.027) 9.026 68.008 ( -31.780 15.609 -11.032) 37.085 ======================= Grid point 26 (19/216) ======================= q-point: ( 0.36 0.18 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.917 ( -11.842 8.705 17.683) 22.994 2.036 ( -19.090 4.535 19.193) 27.448 2.623 ( -16.247 11.159 11.136) 22.639 2.859 ( -4.889 10.465 22.606) 25.386 3.189 ( -32.120 8.727 20.290) 38.981 3.887 ( -22.223 4.631 -12.498) 25.914 4.427 ( 3.628 0.164 -6.546) 7.486 4.550 ( 15.735 2.495 -3.248) 16.259 4.797 ( 9.431 4.544 -1.648) 10.597 5.233 ( -0.096 -7.302 -3.883) 8.271 5.378 ( -7.727 -2.404 5.874) 10.000 5.544 ( 1.121 13.575 7.719) 15.656 5.584 ( 4.656 -6.839 -5.605) 9.993 5.632 ( 7.056 -2.603 -3.941) 8.490 5.854 ( 11.313 -2.371 -3.900) 12.199 5.990 ( -6.523 3.509 -6.208) 9.665 6.079 ( 0.382 3.562 -1.914) 4.062 6.332 ( -3.444 4.643 -4.650) 7.418 6.585 ( 0.803 -3.862 -3.471) 5.254 6.708 ( 7.769 -1.415 -2.811) 8.382 7.263 ( -7.630 -1.897 -2.205) 8.165 7.531 ( -7.991 -7.174 -0.175) 10.740 7.907 ( 0.019 -5.588 3.817) 6.768 7.992 ( 0.918 -3.367 8.099) 8.819 8.709 ( 8.383 -9.764 -8.256) 15.290 8.957 ( 3.463 3.577 -7.005) 8.594 18.905 ( -0.331 0.146 0.069) 0.368 18.967 ( -0.625 1.289 0.614) 1.558 18.983 ( -1.101 2.455 0.342) 2.712 19.104 ( 1.198 -0.285 -0.529) 1.340 19.391 ( 0.525 0.067 0.644) 0.834 19.462 ( 0.576 -0.358 -0.705) 0.978 19.507 ( 1.021 -2.480 0.036) 2.683 19.565 ( -0.002 0.188 -0.209) 0.281 42.461 ( -3.260 -0.436 0.280) 3.301 42.484 ( -3.024 1.045 0.023) 3.199 42.538 ( 4.690 -1.632 0.123) 4.967 42.606 ( 2.542 2.466 -0.969) 3.671 65.769 ( -3.941 3.088 5.399) 7.363 66.593 ( 0.281 5.459 -11.351) 12.599 67.633 ( -2.743 -11.969 2.677) 12.568 68.447 ( -23.702 10.800 -13.222) 29.210 ======================= Grid point 27 (20/216) ======================= q-point: ( 0.45 0.18 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.228 ( -5.691 8.854 9.681) 14.301 2.479 ( -15.226 3.730 17.696) 23.641 2.946 ( -3.611 2.255 14.706) 15.310 3.216 ( -6.248 15.528 11.787) 20.472 3.687 ( -16.923 -4.817 2.265) 17.740 3.974 ( 8.705 1.132 -7.074) 11.274 4.213 ( 16.352 2.245 -1.339) 16.560 4.553 ( -10.766 7.387 5.366) 14.116 4.708 ( 8.782 10.147 -7.831) 15.537 5.130 ( 1.982 -5.764 -6.743) 9.089 5.290 ( 7.710 -9.663 -3.440) 12.832 5.377 ( 5.504 -1.854 -3.573) 6.819 5.599 ( -4.980 -1.591 0.417) 5.244 5.736 ( -0.711 18.308 8.696) 20.281 5.854 ( -8.303 -5.374 2.251) 10.144 6.057 ( -1.825 0.868 -4.855) 5.259 6.140 ( -7.439 6.212 0.918) 9.735 6.421 ( -4.912 7.039 -4.029) 9.482 6.533 ( -0.973 2.044 -2.065) 3.064 6.604 ( -1.495 -2.086 -4.582) 5.252 7.327 ( -4.773 -4.724 0.578) 6.740 7.554 ( -2.727 -7.199 1.741) 7.892 7.873 ( 0.429 -7.240 2.193) 7.577 8.019 ( 1.577 -3.497 7.859) 8.745 8.377 ( 10.956 -12.628 -11.533) 20.311 8.840 ( 6.638 1.006 -5.783) 8.861 18.910 ( -0.140 0.193 0.009) 0.239 18.987 ( -0.249 0.285 1.154) 1.215 19.027 ( -0.914 2.387 -0.099) 2.558 19.095 ( -0.283 2.028 -0.622) 2.140 19.390 ( 0.290 -0.006 0.488) 0.567 19.444 ( 0.645 -0.661 -0.655) 1.133 19.460 ( 1.588 -3.472 -0.125) 3.820 19.568 ( -0.184 0.356 -0.095) 0.411 42.453 ( 3.239 -1.256 0.041) 3.474 42.520 ( -2.909 0.016 0.481) 2.948 42.531 ( -1.816 0.308 0.071) 1.843 42.586 ( 1.729 3.186 -1.358) 3.871 65.890 ( -3.496 1.688 4.123) 5.663 66.575 ( -0.855 10.701 -8.983) 13.998 67.576 ( -2.227 -17.222 3.105) 17.641 68.728 ( -14.631 8.807 -8.657) 19.146 ======================= Grid point 28 (21/216) ======================= q-point: ( 0.55 0.18 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.422 ( -2.296 9.648 4.911) 11.067 2.814 ( -5.954 -0.757 12.011) 13.427 3.072 ( -0.521 1.140 10.986) 11.057 3.328 ( 6.072 -0.506 1.467) 6.268 3.648 ( 14.819 -6.046 -4.445) 16.611 3.849 ( -2.529 3.812 -0.497) 4.601 4.100 ( 5.255 9.663 1.111) 11.055 4.405 ( 19.582 3.125 -11.388) 22.868 4.859 ( -10.235 -0.142 8.896) 13.562 5.082 ( 1.611 9.914 1.018) 10.095 5.219 ( -9.907 -14.235 -4.718) 17.974 5.281 ( 2.415 5.152 -2.895) 6.385 5.653 ( -1.629 -3.657 3.277) 5.174 5.858 ( -1.517 -8.601 -1.121) 8.806 5.943 ( -4.726 9.452 -3.424) 11.108 6.085 ( -1.591 2.339 0.312) 2.846 6.322 ( -2.085 9.957 2.846) 10.563 6.498 ( -0.047 9.143 -2.530) 9.487 6.562 ( -5.070 1.477 0.224) 5.285 6.811 ( -20.711 6.529 -0.216) 21.717 7.346 ( -1.970 -4.697 4.089) 6.532 7.536 ( -1.000 -5.397 0.204) 5.493 7.758 ( 4.084 -17.831 -2.656) 18.485 8.001 ( 3.662 -3.977 5.415) 7.652 8.052 ( 7.433 -5.653 -7.687) 12.095 8.700 ( 6.494 0.997 -3.981) 7.682 18.914 ( -0.090 0.192 -0.001) 0.212 18.998 ( 0.130 0.005 0.851) 0.861 19.036 ( 0.284 0.301 -0.260) 0.488 19.145 ( -2.186 5.164 -0.324) 5.617 19.386 ( 0.822 -1.780 0.091) 1.963 19.395 ( 1.398 -3.130 0.190) 3.433 19.433 ( 0.137 -0.171 -0.533) 0.576 19.573 ( -0.177 0.293 -0.045) 0.345 42.418 ( 0.315 -0.201 0.045) 0.376 42.533 ( 1.092 -0.415 0.018) 1.168 42.567 ( -1.468 1.134 0.141) 1.861 42.588 ( -0.503 1.640 -0.749) 1.872 65.958 ( -1.442 -0.152 1.687) 2.224 66.664 ( -4.125 15.229 -5.103) 16.582 67.462 ( -0.678 -21.489 2.666) 21.665 68.920 ( -8.295 8.105 -3.993) 12.265 ======================= Grid point 29 (22/216) ======================= q-point: (-0.36 0.18 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.544 ( 0.807 9.878 1.975) 10.106 2.751 ( 13.461 -8.682 3.445) 16.384 2.986 ( 14.070 -6.657 -4.982) 16.343 3.328 ( 3.518 -3.545 6.662) 8.326 3.480 ( -4.712 5.356 0.890) 7.189 3.921 ( -7.013 -0.322 1.252) 7.131 3.950 ( 10.411 -3.296 -2.592) 11.223 4.340 ( -5.853 11.614 -5.173) 13.996 4.855 ( 8.698 -8.584 -0.711) 12.241 5.194 ( 0.804 15.399 2.663) 15.648 5.233 ( -10.690 -13.769 -1.537) 17.499 5.445 ( -9.202 11.033 7.479) 16.197 5.602 ( 1.713 -14.142 3.707) 14.720 5.824 ( -0.769 -0.070 -3.806) 3.884 6.006 ( -2.604 4.285 -7.499) 9.021 6.093 ( 3.226 2.373 0.674) 4.062 6.375 ( 4.428 6.883 -0.352) 8.192 6.543 ( 1.330 11.536 0.237) 11.614 6.755 ( -9.123 6.596 2.852) 11.614 6.973 ( 3.197 -12.781 1.002) 13.213 7.422 ( 6.144 -9.288 -4.168) 11.890 7.474 ( -3.095 -8.489 -1.528) 9.164 7.645 ( -18.207 10.213 3.210) 21.121 7.879 ( 7.619 -7.070 3.034) 10.827 7.965 ( 0.464 -1.232 -2.263) 2.618 8.618 ( 3.257 3.661 -1.806) 5.222 18.916 ( -0.032 0.129 0.008) 0.133 18.995 ( 0.613 -0.307 0.255) 0.731 19.033 ( 0.229 0.383 -0.104) 0.459 19.227 ( -2.583 5.662 -0.105) 6.224 19.316 ( 2.239 -5.333 0.029) 5.784 19.387 ( -0.041 -0.553 0.045) 0.556 19.433 ( -0.333 0.208 -0.132) 0.414 19.577 ( -0.102 0.148 -0.008) 0.180 42.439 ( -2.401 0.614 0.049) 2.478 42.493 ( 3.013 -0.819 -0.024) 3.122 42.596 ( -1.300 0.951 0.014) 1.611 42.602 ( -0.393 0.282 -0.145) 0.505 65.971 ( 0.121 -0.318 0.227) 0.410 66.851 ( -6.063 16.410 -1.870) 17.594 67.290 ( 0.607 -23.330 1.431) 23.382 69.059 ( -3.930 7.785 -0.767) 8.754 ======================= Grid point 30 (23/216) ======================= q-point: (-0.27 0.18 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.379 ( 20.489 -14.218 -2.165) 25.033 2.581 ( 6.258 7.893 -0.838) 10.108 2.658 ( 15.906 -6.865 -1.506) 17.390 3.232 ( 5.549 -5.324 1.612) 7.857 3.634 ( -7.017 1.618 -2.379) 7.584 3.961 ( -16.139 -2.224 1.243) 16.339 4.110 ( -13.866 -0.273 3.495) 14.303 4.499 ( -6.650 1.591 0.253) 6.843 4.560 ( 11.914 -7.952 -3.992) 14.870 5.276 ( -6.312 -7.971 1.032) 10.219 5.321 ( 2.425 14.977 1.272) 15.226 5.468 ( 0.637 -16.893 1.152) 16.944 5.741 ( -4.326 5.932 8.992) 11.609 5.761 ( 2.498 2.581 -3.134) 4.767 5.960 ( 5.894 4.341 -8.274) 11.048 6.072 ( 1.864 0.996 1.515) 2.600 6.363 ( 3.968 9.018 -0.711) 9.878 6.628 ( 2.160 4.739 1.677) 5.471 6.665 ( 9.794 -16.428 -1.811) 19.212 6.956 ( -6.097 5.375 2.390) 8.472 7.170 ( 10.607 -6.115 -3.537) 12.744 7.477 ( -1.794 0.988 -0.805) 2.200 7.742 ( 3.725 -7.519 1.085) 8.461 7.887 ( 2.372 -0.932 0.207) 2.556 8.208 ( -25.543 16.091 2.835) 30.322 8.625 ( -0.088 6.059 -1.221) 6.181 18.917 ( 0.065 0.053 0.011) 0.084 18.981 ( 0.830 -0.383 -0.033) 0.914 19.033 ( 0.192 0.478 -0.039) 0.517 19.236 ( 2.108 -5.689 0.052) 6.067 19.313 ( -2.562 5.436 -0.021) 6.009 19.384 ( -0.218 -0.616 -0.009) 0.653 19.443 ( -0.613 0.346 0.040) 0.705 19.578 ( 0.009 -0.045 0.009) 0.046 42.439 ( 2.670 -0.348 0.034) 2.692 42.491 ( -3.049 0.669 -0.038) 3.122 42.590 ( 1.752 0.104 -0.031) 1.755 42.629 ( -2.501 -1.134 0.195) 2.753 65.954 ( 1.966 -0.452 -0.069) 2.019 67.058 ( -4.086 1.758 2.776) 5.243 67.112 ( -1.913 -8.297 -2.685) 8.927 69.162 ( -1.211 7.814 0.741) 7.942 ======================= Grid point 31 (24/216) ======================= q-point: (-0.18 0.18 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.905 ( 22.561 -15.568 -0.000) 27.411 2.315 ( 19.703 -5.269 -0.000) 20.395 2.509 ( 8.302 0.187 -0.000) 8.304 3.070 ( 8.850 -10.638 -0.000) 13.838 3.801 ( -18.455 -2.384 0.000) 18.608 4.117 ( 19.845 -13.143 -0.000) 23.803 4.276 ( -19.293 1.624 0.000) 19.361 4.352 ( -6.670 3.038 0.000) 7.329 4.795 ( -25.771 0.179 0.000) 25.771 5.268 ( 0.328 -20.631 0.000) 20.634 5.289 ( 2.608 0.246 -0.000) 2.619 5.428 ( 4.335 6.511 -0.000) 7.823 5.628 ( 3.607 -5.619 -0.000) 6.677 5.682 ( 21.290 1.360 -0.000) 21.333 5.969 ( -2.568 7.596 0.000) 8.019 6.055 ( 4.373 3.830 -0.000) 5.813 6.370 ( 1.803 -14.516 0.000) 14.628 6.393 ( 2.270 10.834 -0.000) 11.069 6.720 ( -0.770 6.843 -0.000) 6.887 6.924 ( 11.999 -4.746 -0.000) 12.904 7.102 ( -5.072 5.948 0.000) 7.817 7.540 ( -2.772 5.815 0.000) 6.442 7.656 ( 2.104 -4.648 -0.000) 5.102 7.829 ( 3.147 -1.514 -0.000) 3.493 8.688 ( -2.252 6.778 0.000) 7.142 8.736 ( -22.044 16.421 0.000) 27.488 18.915 ( 0.193 0.042 -0.000) 0.197 18.965 ( 0.849 -0.354 -0.000) 0.920 19.034 ( 0.155 0.480 -0.000) 0.504 19.159 ( 1.714 -5.719 0.000) 5.970 19.383 ( -0.290 -0.584 0.000) 0.652 19.392 ( -2.271 4.753 0.000) 5.268 19.456 ( -0.715 0.388 0.000) 0.814 19.576 ( 0.105 -0.237 -0.000) 0.259 42.418 ( 0.069 0.828 -0.000) 0.831 42.530 ( -1.297 -0.041 0.000) 1.298 42.553 ( 3.197 0.419 -0.000) 3.224 42.653 ( -2.868 -3.454 0.000) 4.490 65.892 ( 4.958 -2.055 -0.000) 5.367 66.948 ( -3.275 -18.520 0.000) 18.807 67.282 ( -4.078 14.939 -0.000) 15.486 69.239 ( 0.365 8.110 -0.000) 8.118 ======================= Grid point 36 (25/216) ======================= q-point: ( 0.27 0.27 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 216 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.296 ( -0.000 0.000 27.084) 27.084 1.378 ( -0.000 0.000 24.598) 24.598 2.147 ( -0.000 0.000 4.574) 4.574 2.486 ( -0.000 0.000 48.074) 48.074 2.779 ( -0.000 0.000 26.264) 26.264 3.339 ( 0.000 -0.000 -19.115) 19.115 4.435 ( 0.000 -0.000 -10.033) 10.033 4.807 ( 0.000 -0.000 -1.935) 1.935 5.068 ( -0.000 0.000 6.297) 6.297 5.109 ( -0.000 0.000 3.644) 3.644 5.318 ( 0.000 -0.000 -5.741) 5.741 5.401 ( -0.000 0.000 6.239) 6.239 5.612 ( 0.000 -0.000 -26.471) 26.471 5.849 ( -0.000 0.000 1.065) 1.065 5.972 ( 0.000 -0.000 -12.554) 12.554 6.007 ( -0.000 0.000 1.992) 1.992 6.244 ( 0.000 -0.000 -4.338) 4.338 6.341 ( 0.000 -0.000 -8.375) 8.375 6.803 ( 0.000 -0.000 -0.297) 0.297 6.941 ( -0.000 0.000 2.590) 2.590 6.990 ( -0.000 0.000 3.088) 3.088 7.045 ( 0.000 -0.000 -8.875) 8.875 7.980 ( -0.000 0.000 7.742) 7.742 8.111 ( -0.000 0.000 6.190) 6.190 8.885 ( 0.000 -0.000 -0.175) 0.175 8.969 ( 0.000 -0.000 -1.910) 1.910 18.886 ( -0.000 0.000 0.448) 0.448 18.925 ( 0.000 -0.000 -0.344) 0.344 18.967 ( -0.000 0.000 1.622) 1.622 19.143 ( 0.000 -0.000 -2.041) 2.041 19.409 ( -0.000 0.000 0.869) 0.869 19.476 ( 0.000 -0.000 -0.628) 0.628 19.534 ( -0.000 0.000 0.294) 0.294 19.572 ( 0.000 -0.000 -0.471) 0.471 42.400 ( -0.000 0.000 0.093) 0.093 42.413 ( 0.000 -0.000 -0.176) 0.176 42.641 ( -0.000 0.000 0.284) 0.284 42.661 ( 0.000 -0.000 -0.127) 0.127 65.669 ( -0.000 0.000 6.699) 6.699 66.512 ( 0.000 -0.000 -12.267) 12.267 67.634 ( -0.000 0.000 4.156) 4.156 67.692 ( -0.000 0.000 1.109) 1.109 ======================= Grid point 37 (26/216) ======================= q-point: ( 0.36 0.27 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.775 ( -19.967 4.916 22.355) 30.375 1.817 ( -21.897 8.920 21.043) 31.652 2.318 ( -14.520 8.385 4.019) 17.242 2.965 ( -4.648 1.785 30.993) 31.390 3.015 ( -8.282 7.172 31.219) 33.086 3.376 ( -20.603 4.114 -13.749) 25.109 4.348 ( 1.409 4.040 -11.551) 12.318 4.727 ( 6.235 -5.222 -2.964) 8.656 4.931 ( 11.876 1.661 -1.003) 12.034 5.251 ( 1.283 0.483 -9.391) 9.490 5.294 ( -8.415 -2.209 3.151) 9.254 5.484 ( -9.218 -1.627 -10.522) 14.083 5.510 ( -4.501 2.902 3.467) 6.379 5.720 ( 10.898 3.498 -2.236) 11.662 5.895 ( 0.846 -0.244 -4.955) 5.033 6.028 ( 4.815 2.719 -1.328) 5.687 6.102 ( 9.544 -0.834 -2.826) 9.989 6.251 ( 1.195 1.320 -5.640) 5.914 6.637 ( 6.637 -2.932 -0.474) 7.272 6.834 ( 9.609 -1.126 -3.987) 10.465 7.133 ( -9.991 -2.383 -0.478) 10.282 7.282 ( -24.245 -3.150 -4.576) 24.873 8.010 ( 3.272 -0.938 6.677) 7.495 8.108 ( 2.846 -3.522 5.243) 6.928 8.839 ( 6.325 -3.170 -2.905) 7.648 8.930 ( 1.917 1.463 -2.470) 3.452 18.898 ( -0.493 0.451 0.335) 0.747 18.933 ( -0.606 1.818 -0.399) 1.957 18.983 ( -0.155 0.113 1.760) 1.770 19.116 ( 0.855 -0.435 -1.733) 1.981 19.409 ( 0.706 -0.178 0.929) 1.180 19.467 ( 0.391 -0.244 -0.735) 0.867 19.532 ( 0.275 -0.903 0.274) 0.983 19.564 ( 0.188 -0.225 -0.439) 0.528 42.421 ( -2.290 -0.047 0.127) 2.294 42.432 ( -2.323 0.628 -0.084) 2.408 42.616 ( 3.291 -0.790 0.163) 3.388 42.634 ( 2.797 0.332 -0.158) 2.821 65.753 ( -2.016 2.053 7.346) 7.890 66.444 ( -2.297 1.868 -12.857) 13.194 67.684 ( -3.104 -7.355 1.880) 8.201 67.905 ( -20.033 11.859 -3.184) 23.497 ======================= Grid point 38 (27/216) ======================= q-point: ( 0.45 0.27 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.162 ( -7.217 5.469 12.361) 15.322 2.343 ( -15.984 7.243 17.883) 25.055 2.788 ( -22.161 12.975 9.018) 27.217 3.144 ( -2.888 5.472 8.289) 10.344 3.529 ( -16.098 -3.142 17.306) 23.843 3.786 ( -22.385 9.747 5.888) 25.115 4.303 ( -3.905 6.977 -8.226) 11.471 4.491 ( 14.043 -4.177 -3.569) 15.080 4.768 ( 10.282 4.516 -2.063) 11.418 5.069 ( 1.377 -5.606 -14.508) 15.614 5.404 ( -5.274 -2.470 -1.658) 6.055 5.511 ( 3.245 -2.600 -4.727) 6.295 5.605 ( 3.210 -2.308 3.724) 5.431 5.719 ( 2.884 11.971 7.767) 14.558 5.790 ( 4.057 -0.412 -4.011) 5.721 5.888 ( -2.530 5.804 -2.290) 6.732 6.072 ( -1.990 0.638 -0.684) 2.199 6.263 ( -2.797 6.292 -3.756) 7.844 6.528 ( 2.207 -3.972 -3.164) 5.536 6.651 ( 8.284 -0.231 -4.011) 9.207 7.260 ( -9.461 -4.669 1.776) 10.699 7.491 ( -14.900 -9.608 -4.404) 18.268 7.970 ( 3.900 -3.606 3.655) 6.448 8.106 ( 1.567 0.563 5.571) 5.815 8.594 ( 12.312 -11.355 -5.285) 17.562 8.871 ( 5.112 2.566 -3.954) 6.954 18.907 ( -0.140 0.215 0.101) 0.276 18.969 ( -1.368 3.155 -0.153) 3.442 19.002 ( -0.261 0.435 1.594) 1.673 19.088 ( 0.685 -0.117 -1.355) 1.523 19.403 ( 0.644 -0.231 0.860) 1.099 19.450 ( 0.570 -0.389 -0.841) 1.088 19.508 ( 1.160 -2.568 0.037) 2.818 19.561 ( -0.141 0.284 -0.172) 0.361 42.466 ( -3.350 -0.332 0.243) 3.375 42.484 ( -3.174 0.911 0.022) 3.302 42.539 ( 4.760 -1.375 0.096) 4.956 42.594 ( 3.093 1.917 -0.571) 3.683 65.870 ( -2.746 2.067 6.983) 7.783 66.403 ( -1.917 5.632 -11.512) 12.959 67.673 ( -4.138 -13.198 2.158) 13.999 68.292 ( -20.194 13.137 -6.372) 24.919 ======================= Grid point 39 (28/216) ======================= q-point: ( 0.55 0.27 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.358 ( -2.773 7.390 6.008) 9.919 2.742 ( -13.135 4.519 13.829) 19.601 3.131 ( -1.097 5.304 6.687) 8.605 3.334 ( -7.988 5.257 2.200) 9.812 3.736 ( -5.677 -6.600 4.089) 9.618 3.908 ( 8.978 4.780 -0.951) 10.216 4.185 ( 19.105 2.791 -2.300) 19.444 4.581 ( -3.295 5.286 -3.132) 6.972 4.683 ( -3.135 7.902 6.459) 10.677 4.985 ( -11.287 -7.083 -10.340) 16.866 5.271 ( 14.581 -2.807 0.472) 14.856 5.315 ( 7.769 -0.269 -3.152) 8.389 5.595 ( -6.483 1.071 -0.123) 6.572 5.807 ( -2.357 7.110 -2.058) 7.768 5.908 ( -7.062 -6.166 3.503) 10.008 5.992 ( -3.571 2.955 -0.026) 4.635 6.185 ( -6.750 10.510 3.028) 12.852 6.362 ( -3.463 10.741 -2.848) 11.639 6.499 ( -5.752 3.326 -2.188) 6.995 6.541 ( 0.942 -1.009 -2.878) 3.192 7.362 ( -7.287 -8.154 3.630) 11.522 7.539 ( -7.739 -11.367 -3.482) 14.186 7.920 ( 3.157 -3.197 3.637) 5.780 8.126 ( 2.525 0.117 4.002) 4.733 8.216 ( 13.681 -16.169 -6.986) 22.303 8.759 ( 6.953 1.733 -3.941) 8.178 18.910 ( -0.076 0.234 0.016) 0.247 19.005 ( -0.262 0.848 0.955) 1.304 19.026 ( -0.463 1.546 0.010) 1.613 19.083 ( -0.762 2.369 -0.775) 2.607 19.399 ( 0.426 -0.404 0.600) 0.840 19.432 ( 0.393 -0.293 -0.689) 0.845 19.459 ( 1.725 -3.710 -0.052) 4.092 19.567 ( -0.224 0.371 -0.057) 0.437 42.454 ( 3.337 -1.078 0.049) 3.507 42.527 ( -2.418 0.143 0.359) 2.448 42.532 ( -2.404 0.135 0.077) 2.409 42.568 ( 1.829 2.853 -0.830) 3.490 65.959 ( -1.364 -0.194 3.989) 4.220 66.440 ( -4.200 11.441 -6.932) 14.021 67.618 ( -3.472 -18.983 1.898) 19.391 68.623 ( -14.550 12.460 -4.241) 19.620 ======================= Grid point 40 (29/216) ======================= q-point: ( 0.64 0.27 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.484 ( -0.250 9.687 2.253) 9.949 2.990 ( -1.333 -4.830 9.082) 10.372 3.138 ( 4.012 -1.757 -3.233) 5.444 3.344 ( 5.360 5.671 1.646) 7.975 3.609 ( 8.729 -12.025 -0.723) 14.877 3.893 ( 6.835 6.908 3.969) 10.497 4.080 ( -3.851 13.567 -3.200) 14.461 4.270 ( 24.738 -0.622 -4.018) 25.070 4.962 ( -7.511 -4.509 4.399) 9.803 5.078 ( -15.444 -7.786 -3.397) 17.626 5.154 ( 5.702 6.706 -1.064) 8.866 5.287 ( -3.713 8.851 1.929) 9.790 5.704 ( -3.908 0.916 2.956) 4.985 5.824 ( -0.591 -11.767 -3.638) 12.331 5.884 ( -2.198 -0.415 -1.756) 2.844 6.081 ( -1.947 3.583 -0.258) 4.086 6.364 ( 2.816 13.681 1.405) 14.038 6.467 ( 1.027 11.651 -1.017) 11.740 6.575 ( -8.945 3.460 0.894) 9.632 6.810 ( -22.467 8.009 -0.001) 23.851 7.415 ( -5.174 -6.142 4.107) 9.020 7.512 ( -4.144 -9.244 -3.107) 10.596 7.720 ( 13.100 -21.772 -1.222) 25.439 7.964 ( 1.871 0.047 -2.585) 3.191 8.076 ( 5.701 -5.145 2.645) 8.122 8.647 ( 5.916 2.704 -1.979) 6.799 18.914 ( -0.076 0.217 0.002) 0.230 19.010 ( 0.569 -0.314 0.560) 0.858 19.031 ( 0.144 0.610 -0.335) 0.711 19.141 ( -2.366 5.232 -0.134) 5.743 19.387 ( 1.279 -2.869 0.021) 3.141 19.398 ( 1.038 -2.461 0.161) 2.675 19.426 ( -0.090 0.104 -0.273) 0.306 19.572 ( -0.194 0.304 -0.016) 0.361 42.419 ( 0.377 -0.102 0.024) 0.391 42.533 ( 1.073 -0.479 0.003) 1.175 42.567 ( 0.004 2.587 -0.052) 2.588 42.581 ( -2.178 0.116 -0.152) 2.186 65.979 ( -0.054 -0.992 0.784) 1.266 66.603 ( -6.608 15.177 -2.057) 16.681 67.492 ( -1.312 -23.023 0.984) 23.082 68.876 ( -8.794 10.861 -1.368) 14.042 ======================= Grid point 41 (30/216) ======================= q-point: (-0.27 0.27 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.563 ( 2.180 10.398 -0.000) 10.625 2.790 ( 17.448 -13.050 -0.000) 21.789 2.929 ( 13.608 -3.911 -0.000) 14.158 3.392 ( 8.154 -6.631 -0.000) 10.510 3.484 ( -8.023 7.462 0.000) 10.957 3.921 ( 9.423 -4.964 -0.000) 10.650 3.941 ( -7.596 1.578 0.000) 7.758 4.294 ( -7.254 12.105 0.000) 14.112 4.847 ( 10.355 -10.216 -0.000) 14.546 5.215 ( -14.052 -14.647 0.000) 20.298 5.219 ( 2.042 18.043 -0.000) 18.159 5.526 ( -10.644 13.272 0.000) 17.013 5.642 ( 1.268 -19.181 0.000) 19.223 5.787 ( -0.254 2.298 -0.000) 2.312 5.921 ( -0.800 4.048 -0.000) 4.127 6.098 ( 1.509 1.228 -0.000) 1.945 6.372 ( 5.971 7.717 -0.000) 9.757 6.546 ( 2.656 15.946 -0.000) 16.166 6.786 ( -10.176 5.778 0.000) 11.702 6.980 ( 3.902 -13.447 0.000) 14.002 7.371 ( 6.994 -16.847 -0.000) 18.242 7.468 ( -1.629 -5.408 0.000) 5.648 7.679 ( -23.066 13.559 0.000) 26.756 7.916 ( 7.274 -9.195 -0.000) 11.724 7.933 ( 1.878 -0.644 -0.000) 1.985 8.601 ( 3.191 4.827 -0.000) 5.786 18.916 ( -0.030 0.143 -0.000) 0.146 18.997 ( 0.801 -0.430 -0.000) 0.910 19.032 ( 0.203 0.523 -0.000) 0.561 19.226 ( -2.635 5.679 0.000) 6.260 19.316 ( 2.215 -5.334 -0.000) 5.775 19.387 ( -0.038 -0.699 0.000) 0.701 19.432 ( -0.436 0.292 0.000) 0.525 19.577 ( -0.111 0.157 0.000) 0.193 42.439 ( -2.427 0.640 0.000) 2.510 42.493 ( 3.062 -0.835 -0.000) 3.174 42.596 ( -1.540 1.314 0.000) 2.025 42.601 ( -0.353 -0.067 0.000) 0.360 65.973 ( 0.413 -0.420 -0.000) 0.589 66.836 ( -7.000 16.487 0.000) 17.911 67.302 ( 0.408 -24.589 0.000) 24.592 69.053 ( -4.277 9.144 0.000) 10.095 ======================= Grid point 48 (31/216) ======================= q-point: ( 0.36 0.36 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 216 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.733 ( -0.000 0.000 26.046) 26.046 1.741 ( -0.000 0.000 19.525) 19.525 2.209 ( -0.000 0.000 2.717) 2.717 3.003 ( 0.000 -0.000 -22.025) 22.025 3.210 ( -0.000 0.000 26.155) 26.155 3.245 ( -0.000 0.000 44.929) 44.929 4.237 ( 0.000 -0.000 -14.365) 14.365 4.780 ( 0.000 -0.000 -0.839) 0.839 5.035 ( 0.000 -0.000 -9.470) 9.470 5.127 ( 0.000 -0.000 -26.576) 26.576 5.200 ( -0.000 0.000 3.480) 3.480 5.355 ( -0.000 0.000 7.036) 7.036 5.486 ( -0.000 0.000 3.834) 3.834 5.758 ( 0.000 -0.000 -13.482) 13.482 5.895 ( -0.000 0.000 4.491) 4.491 6.030 ( -0.000 0.000 0.948) 0.948 6.168 ( 0.000 -0.000 -4.939) 4.939 6.209 ( 0.000 -0.000 -7.631) 7.631 6.798 ( 0.000 -0.000 -0.171) 0.171 6.920 ( 0.000 -0.000 -6.370) 6.370 6.981 ( -0.000 0.000 2.277) 2.277 7.024 ( -0.000 0.000 1.146) 1.146 8.096 ( -0.000 0.000 6.184) 6.184 8.187 ( -0.000 0.000 3.021) 3.021 8.885 ( -0.000 0.000 0.212) 0.212 8.938 ( 0.000 -0.000 -1.823) 1.823 18.894 ( -0.000 0.000 0.515) 0.515 18.919 ( 0.000 -0.000 -0.436) 0.436 18.997 ( -0.000 0.000 2.001) 2.001 19.107 ( 0.000 -0.000 -2.277) 2.277 19.423 ( -0.000 0.000 0.897) 0.897 19.465 ( 0.000 -0.000 -0.757) 0.757 19.539 ( -0.000 0.000 0.391) 0.391 19.563 ( 0.000 -0.000 -0.526) 0.526 42.402 ( -0.000 0.000 0.125) 0.125 42.410 ( 0.000 -0.000 -0.187) 0.187 42.646 ( -0.000 0.000 0.306) 0.306 42.659 ( 0.000 -0.000 -0.187) 0.187 65.793 ( -0.000 0.000 8.529) 8.529 66.312 ( 0.000 -0.000 -12.126) 12.126 67.688 ( -0.000 0.000 2.440) 2.440 67.709 ( -0.000 0.000 0.925) 0.925 ======================= Grid point 49 (32/216) ======================= q-point: ( 0.45 0.36 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.075 ( -14.315 5.186 14.243) 20.849 2.188 ( -18.258 5.108 23.745) 30.386 2.357 ( -17.960 10.340 0.373) 20.727 2.945 ( -12.840 3.668 -19.169) 23.362 3.483 ( -5.898 5.254 21.404) 22.815 3.670 ( -9.711 -0.984 39.311) 40.505 4.127 ( -0.142 4.771 -15.505) 16.223 4.651 ( 2.553 -15.211 -9.236) 17.977 4.880 ( 9.344 4.811 -4.567) 11.459 4.958 ( 3.493 9.695 -20.487) 22.933 5.287 ( -5.615 -0.097 2.259) 6.053 5.482 ( 1.679 0.006 -5.957) 6.189 5.540 ( -12.336 -0.028 8.742) 15.119 5.718 ( -5.693 2.864 -0.568) 6.398 5.869 ( 8.176 0.885 2.338) 8.550 5.988 ( 12.324 -0.492 -3.216) 12.746 6.070 ( 2.151 0.658 -1.551) 2.732 6.154 ( -1.008 2.755 -5.405) 6.150 6.643 ( 9.841 -2.723 1.205) 10.282 6.758 ( 9.806 -0.031 -4.696) 10.873 7.144 ( -11.560 -3.167 1.505) 12.080 7.219 ( -20.440 -4.278 -3.171) 21.122 8.100 ( 4.608 -1.921 4.095) 6.457 8.170 ( 2.897 0.215 2.353) 3.738 8.810 ( 8.051 -6.063 -0.889) 10.118 8.896 ( 3.027 1.260 -1.612) 3.654 18.904 ( -0.204 0.331 0.336) 0.514 18.926 ( -0.780 1.832 -0.341) 2.020 19.014 ( -0.023 0.043 2.051) 2.051 19.084 ( 0.390 -0.188 -2.102) 2.146 19.424 ( 0.619 -0.284 0.945) 1.165 19.454 ( 0.438 -0.283 -0.846) 0.994 19.537 ( 0.458 -1.095 0.285) 1.220 19.557 ( 0.010 -0.027 -0.384) 0.385 42.422 ( -2.310 -0.052 0.096) 2.312 42.430 ( -2.486 0.656 -0.067) 2.572 42.619 ( 3.489 -0.866 0.119) 3.596 42.632 ( 2.867 0.352 -0.100) 2.890 65.887 ( -1.577 1.578 9.078) 9.348 66.241 ( -2.085 2.095 -11.999) 12.357 67.710 ( -3.568 -7.408 1.157) 8.303 67.875 ( -14.489 10.307 -0.881) 17.803 ======================= Grid point 50 (33/216) ======================= q-point: ( 0.55 0.36 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.304 ( -4.170 3.860 4.653) 7.345 2.590 ( -10.386 10.851 10.336) 18.233 2.917 ( -26.816 10.059 7.236) 29.541 3.093 ( -14.908 2.403 -9.735) 17.966 3.763 ( -3.454 2.991 13.458) 14.213 3.952 ( 2.492 2.489 -0.045) 3.522 4.256 ( -19.034 3.712 7.897) 20.939 4.442 ( 1.419 -9.094 -2.410) 9.514 4.711 ( 6.768 0.458 -6.810) 9.612 4.831 ( 6.310 9.136 -9.532) 14.633 5.392 ( -3.447 -0.064 0.588) 3.497 5.441 ( -0.866 0.291 -3.392) 3.513 5.639 ( 15.521 -2.669 0.338) 15.752 5.709 ( 7.882 1.843 -2.702) 8.534 5.835 ( -7.607 2.563 4.627) 9.265 5.927 ( -8.573 7.744 3.514) 12.075 6.039 ( -1.736 -1.400 -2.845) 3.615 6.219 ( -2.202 10.177 -1.430) 10.510 6.492 ( 5.592 -4.127 -1.096) 7.036 6.593 ( 7.206 0.523 -2.318) 7.588 7.314 ( -12.297 -7.829 4.501) 15.256 7.404 ( -15.491 -9.488 -5.637) 19.020 8.016 ( 5.118 -2.052 1.591) 5.739 8.166 ( 2.965 4.204 1.792) 5.447 8.541 ( 13.651 -14.463 -1.414) 19.938 8.825 ( 6.278 1.876 -1.540) 6.731 18.908 ( -0.019 0.209 0.046) 0.215 18.967 ( -1.533 3.351 -0.072) 3.686 19.029 ( 0.161 -0.040 1.645) 1.653 19.063 ( 0.194 0.256 -1.575) 1.607 19.418 ( 0.703 -0.506 0.829) 1.199 19.436 ( 0.546 -0.307 -0.815) 1.028 19.508 ( 1.253 -2.631 0.016) 2.914 19.559 ( -0.234 0.353 -0.067) 0.429 42.469 ( -3.436 -0.265 0.099) 3.448 42.485 ( -3.276 0.826 0.009) 3.378 42.541 ( 4.801 -1.219 0.036) 4.953 42.587 ( 3.434 1.639 -0.192) 3.810 65.986 ( -0.905 -0.349 6.172) 6.248 66.236 ( -4.091 7.573 -7.828) 11.635 67.699 ( -5.138 -14.236 0.843) 15.159 68.227 ( -17.692 14.331 -1.883) 22.846 ======================= Grid point 51 (34/216) ======================= q-point: ( 0.64 0.36 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.410 ( -1.821 6.908 -0.000) 7.144 2.877 ( -11.870 6.821 0.000) 13.690 3.162 ( -1.824 -1.165 0.000) 2.164 3.346 ( -8.229 7.733 0.000) 11.292 3.776 ( 0.993 -11.764 0.000) 11.805 3.916 ( 4.403 10.489 -0.000) 11.376 4.156 ( 24.851 6.963 -0.000) 25.808 4.556 ( 3.851 -2.060 -0.000) 4.367 4.811 ( -17.640 0.189 0.000) 17.641 4.823 ( -9.793 1.370 0.000) 9.889 5.278 ( 12.151 1.510 -0.000) 12.244 5.291 ( 10.859 -0.771 -0.000) 10.886 5.601 ( -6.371 2.976 0.000) 7.032 5.757 ( -7.300 1.835 0.000) 7.527 5.943 ( -4.864 -6.948 0.000) 8.481 6.008 ( 0.118 2.199 -0.000) 2.203 6.213 ( -9.852 11.303 0.000) 14.994 6.339 ( -0.531 14.603 -0.000) 14.613 6.475 ( -8.803 3.074 0.000) 9.324 6.517 ( 1.780 0.324 -0.000) 1.809 7.420 ( -8.083 -11.490 0.000) 14.048 7.479 ( -9.890 -11.422 0.000) 15.109 7.964 ( 2.102 0.995 -0.000) 2.326 8.112 ( 14.614 -5.345 -0.000) 15.560 8.196 ( 5.069 -13.026 -0.000) 13.978 8.724 ( 7.323 1.830 -0.000) 7.549 18.911 ( -0.053 0.244 -0.000) 0.250 19.014 ( -0.867 2.332 0.000) 2.487 19.027 ( 0.597 -0.471 -0.000) 0.760 19.075 ( -1.239 2.944 0.000) 3.194 19.405 ( 0.582 -0.767 -0.000) 0.963 19.425 ( 0.215 0.007 -0.000) 0.215 19.458 ( 1.757 -3.753 -0.000) 4.144 19.566 ( -0.240 0.378 0.000) 0.447 42.454 ( 3.379 -1.015 -0.000) 3.528 42.530 ( -1.607 0.220 0.000) 1.622 42.533 ( -3.488 -0.073 0.000) 3.489 42.561 ( 2.109 2.851 -0.000) 3.547 65.998 ( 0.218 -1.749 0.000) 1.763 66.376 ( -6.224 12.581 0.000) 14.036 67.634 ( -3.954 -19.723 0.000) 20.116 68.589 ( -14.298 13.769 0.000) 19.850 ======================= Grid point 61 (35/216) ======================= q-point: ( 0.45 0.45 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 216 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.001 ( -0.000 0.000 11.817) 11.817 2.074 ( -0.000 0.000 8.317) 8.317 2.281 ( -0.000 0.000 13.181) 13.181 2.628 ( 0.000 -0.000 -23.657) 23.657 3.617 ( -0.000 0.000 23.410) 23.410 3.945 ( -0.000 0.000 39.284) 39.284 3.965 ( 0.000 -0.000 -17.338) 17.338 4.579 ( 0.000 -0.000 -36.546) 36.546 4.796 ( -0.000 0.000 3.132) 3.132 4.886 ( 0.000 -0.000 -7.821) 7.821 5.350 ( -0.000 0.000 10.806) 10.806 5.464 ( -0.000 0.000 5.424) 5.424 5.515 ( 0.000 -0.000 -0.578) 0.578 5.542 ( 0.000 -0.000 -12.713) 12.713 5.985 ( -0.000 0.000 6.103) 6.103 6.048 ( -0.000 0.000 1.725) 1.725 6.082 ( 0.000 -0.000 -5.580) 5.580 6.102 ( 0.000 -0.000 -5.087) 5.087 6.803 ( -0.000 0.000 1.089) 1.089 6.839 ( 0.000 -0.000 -3.497) 3.497 7.013 ( -0.000 0.000 1.550) 1.550 7.029 ( 0.000 -0.000 -0.408) 0.408 8.176 ( -0.000 0.000 3.554) 3.554 8.208 ( 0.000 -0.000 -0.350) 0.350 8.893 ( -0.000 0.000 0.788) 0.788 8.911 ( 0.000 -0.000 -1.393) 1.393 18.902 ( -0.000 0.000 0.532) 0.532 18.911 ( 0.000 -0.000 -0.502) 0.502 19.032 ( -0.000 0.000 2.247) 2.247 19.069 ( 0.000 -0.000 -2.341) 2.341 19.438 ( -0.000 0.000 0.883) 0.883 19.452 ( 0.000 -0.000 -0.839) 0.839 19.547 ( -0.000 0.000 0.473) 0.473 19.555 ( 0.000 -0.000 -0.523) 0.523 42.404 ( -0.000 0.000 0.155) 0.155 42.407 ( 0.000 -0.000 -0.177) 0.177 42.651 ( -0.000 0.000 0.289) 0.289 42.655 ( 0.000 -0.000 -0.245) 0.245 65.946 ( -0.000 0.000 10.093) 10.093 66.121 ( 0.000 -0.000 -11.331) 11.331 67.715 ( -0.000 0.000 0.880) 0.880 67.719 ( -0.000 0.000 0.271) 0.271 ======================= Grid point 62 (36/216) ======================= q-point: ( 0.55 0.45 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.214 ( -9.157 1.386 0.000) 9.262 2.338 ( -18.667 15.462 0.000) 24.239 2.529 ( -15.517 -2.424 0.000) 15.705 2.637 ( -21.238 9.798 0.000) 23.389 3.810 ( -0.424 2.594 -0.000) 2.628 3.848 ( -1.834 7.182 -0.000) 7.413 4.252 ( -5.142 -11.180 0.000) 12.305 4.304 ( -7.793 -6.005 0.000) 9.838 4.812 ( 8.545 6.660 -0.000) 10.833 4.830 ( 5.780 9.067 -0.000) 10.752 5.353 ( 0.207 -2.114 0.000) 2.124 5.384 ( 1.831 1.212 -0.000) 2.196 5.659 ( -13.627 0.902 0.000) 13.657 5.672 ( -11.857 1.635 0.000) 11.969 5.926 ( 13.027 -0.799 -0.000) 13.052 5.936 ( 12.696 0.063 -0.000) 12.697 6.052 ( 1.051 -0.838 -0.000) 1.345 6.105 ( -2.224 5.821 0.000) 6.232 6.665 ( 11.040 -3.647 -0.000) 11.626 6.706 ( 9.685 1.189 -0.000) 9.758 7.175 ( -15.797 -4.015 0.000) 16.299 7.176 ( -15.102 -4.059 0.000) 15.638 8.135 ( 5.436 -3.255 -0.000) 6.336 8.188 ( 2.548 2.654 -0.000) 3.679 8.803 ( 8.271 -7.659 -0.000) 11.273 8.882 ( 3.502 1.680 -0.000) 3.884 18.907 ( 0.021 0.117 -0.000) 0.119 18.923 ( -0.972 2.012 0.000) 2.235 19.047 ( 0.257 -0.261 -0.000) 0.366 19.051 ( 0.023 0.178 -0.000) 0.179 19.438 ( 0.592 -0.445 -0.000) 0.740 19.440 ( 0.445 -0.172 -0.000) 0.477 19.540 ( 0.656 -1.361 -0.000) 1.511 19.553 ( -0.186 0.242 0.000) 0.305 42.423 ( -2.294 -0.082 0.000) 2.295 42.430 ( -2.573 0.694 0.000) 2.665 42.620 ( 3.600 -0.933 -0.000) 3.719 42.631 ( 2.843 0.407 -0.000) 2.872 66.027 ( -0.168 -1.210 0.000) 1.222 66.077 ( -3.210 4.782 0.000) 5.760 67.719 ( -3.880 -7.612 0.000) 8.544 67.869 ( -12.795 10.027 0.000) 16.256 ======================= Grid point 126 (37/216) ======================= q-point: ( 0.09 0.00 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 216 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.465 ( 0.000 28.322 -0.000) 28.322 0.694 ( 0.000 41.706 -0.000) 41.706 1.112 ( 0.000 66.365 -0.000) 66.365 2.009 ( 0.000 10.003 -0.000) 10.003 2.208 ( 0.000 19.255 -0.000) 19.255 3.950 ( 0.000 6.128 -0.000) 6.128 4.737 ( 0.000 8.154 -0.000) 8.154 4.806 ( -0.000 -2.843 0.000) 2.843 4.922 ( 0.000 10.219 -0.000) 10.219 4.965 ( 0.000 6.154 -0.000) 6.154 5.194 ( -0.000 -0.481 0.000) 0.481 5.368 ( -0.000 -11.615 0.000) 11.615 5.690 ( 0.000 2.665 -0.000) 2.665 5.830 ( -0.000 -8.444 0.000) 8.444 6.323 ( -0.000 -3.594 0.000) 3.594 6.332 ( 0.000 0.084 -0.000) 0.084 6.347 ( -0.000 -6.814 0.000) 6.814 6.434 ( 0.000 2.449 -0.000) 2.449 6.689 ( -0.000 -5.513 0.000) 5.513 6.746 ( -0.000 -1.412 0.000) 1.412 6.767 ( 0.000 8.113 -0.000) 8.113 7.578 ( -0.000 -6.814 0.000) 6.814 7.680 ( -0.000 -3.050 0.000) 3.050 7.712 ( -0.000 -1.785 0.000) 1.785 8.977 ( -0.000 -5.769 0.000) 5.769 9.639 ( -0.000 -6.286 0.000) 6.286 18.889 ( 0.000 1.772 -0.000) 1.772 18.929 ( 0.000 0.454 -0.000) 0.454 19.038 ( -0.000 -0.382 0.000) 0.382 19.104 ( 0.000 1.018 -0.000) 1.018 19.386 ( 0.000 0.573 -0.000) 0.573 19.491 ( -0.000 -0.258 0.000) 0.258 19.517 ( -0.000 -1.153 0.000) 1.153 19.575 ( -0.000 -1.094 0.000) 1.094 42.403 ( 0.000 0.613 -0.000) 0.613 42.422 ( 0.000 0.565 -0.000) 0.565 42.628 ( -0.000 -0.587 0.000) 0.587 42.660 ( -0.000 -0.551 0.000) 0.551 65.541 ( 0.000 4.962 -0.000) 4.962 66.995 ( 0.000 6.271 -0.000) 6.271 67.383 ( -0.000 -4.101 0.000) 4.101 69.027 ( -0.000 -4.015 0.000) 4.015 ======================= Grid point 127 (38/216) ======================= q-point: ( 0.18 0.00 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.879 ( -12.975 22.796 15.070) 30.251 1.250 ( -20.946 30.818 5.190) 37.622 1.993 ( -30.436 43.274 5.758) 53.218 2.190 ( -8.921 21.878 4.706) 24.091 2.496 ( -13.981 21.824 2.949) 26.086 4.105 ( -14.409 7.678 -5.136) 17.116 4.753 ( 6.249 8.935 -2.394) 11.163 4.816 ( 0.694 -4.881 3.333) 5.951 4.927 ( 6.722 8.304 -0.882) 10.720 4.970 ( 10.818 -1.580 -0.951) 10.974 5.097 ( 0.675 8.882 7.213) 11.462 5.487 ( -14.326 -3.709 0.890) 14.825 5.706 ( 0.754 -1.228 1.741) 2.260 5.752 ( -2.097 -15.792 -1.576) 16.008 5.982 ( 11.848 -3.628 -1.416) 12.472 6.170 ( 14.882 -3.473 -0.448) 15.289 6.383 ( 1.361 4.938 -2.412) 5.661 6.570 ( -1.030 2.394 -4.900) 5.550 6.625 ( 0.546 -4.758 1.250) 4.950 6.742 ( -0.340 -3.025 1.212) 3.277 7.135 ( -27.237 -7.862 -1.259) 28.377 7.490 ( 6.228 -5.970 2.065) 8.871 7.609 ( 0.299 -7.693 2.276) 8.028 7.729 ( -2.671 -2.540 -0.643) 3.742 8.899 ( 2.155 -8.012 -0.999) 8.356 9.473 ( 6.285 -8.395 -8.693) 13.621 18.907 ( -0.028 1.716 0.100) 1.719 18.936 ( -0.116 0.783 0.231) 0.824 19.029 ( -0.182 0.541 -1.162) 1.295 19.101 ( 1.579 2.615 1.169) 3.270 19.390 ( 0.226 0.752 0.002) 0.785 19.485 ( 0.338 -0.448 -0.148) 0.580 19.500 ( 0.719 -2.122 0.031) 2.241 19.566 ( -0.216 -1.181 -0.072) 1.203 42.415 ( -1.190 0.066 0.052) 1.193 42.453 ( -2.568 1.466 -0.030) 2.957 42.586 ( 3.914 -2.029 0.070) 4.409 42.680 ( -1.828 1.157 -0.705) 2.275 65.619 ( -2.780 6.991 1.162) 7.613 67.019 ( 1.979 8.639 -4.337) 9.867 67.413 ( -4.015 -10.355 2.433) 11.370 69.027 ( -13.531 -7.421 -18.051) 23.749 ======================= Grid point 128 (39/216) ======================= q-point: ( 0.27 0.00 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.414 ( -16.021 18.851 17.369) 30.228 1.814 ( -16.491 22.314 7.420) 28.721 2.362 ( -4.279 12.884 6.775) 15.173 2.806 ( -11.645 28.497 6.664) 31.498 3.155 ( -36.842 28.179 3.536) 46.518 4.358 ( -13.918 5.614 -9.319) 17.666 4.550 ( 20.573 -4.948 1.487) 21.212 4.648 ( 13.158 5.024 -6.623) 15.564 4.894 ( -1.928 3.678 4.025) 5.784 5.037 ( -11.499 -2.058 5.704) 12.999 5.278 ( -2.206 16.998 3.312) 17.457 5.537 ( 3.710 -21.081 -5.500) 22.101 5.621 ( 10.484 -9.455 0.259) 14.121 5.696 ( -7.170 9.217 0.076) 11.678 5.852 ( 7.748 -2.387 -1.280) 8.207 5.932 ( 3.004 -1.508 3.864) 5.122 6.342 ( 4.141 1.545 -6.135) 7.561 6.507 ( 1.507 -2.879 1.637) 3.638 6.657 ( -2.854 5.676 -3.892) 7.451 6.710 ( 0.052 -5.057 -1.187) 5.195 7.340 ( 7.952 -6.039 3.165) 10.475 7.386 ( -14.824 -3.257 -3.670) 15.615 7.592 ( -2.654 -9.526 4.471) 10.853 7.747 ( -2.845 -3.361 1.675) 4.711 8.759 ( 4.180 -9.686 -3.797) 11.212 9.194 ( 10.493 -11.858 -6.177) 16.996 18.919 ( 0.384 1.805 0.145) 1.851 18.948 ( -0.279 0.718 0.392) 0.864 19.032 ( -0.185 -0.084 0.117) 0.234 19.124 ( -0.403 4.164 -0.120) 4.185 19.392 ( 0.312 0.790 -0.073) 0.852 19.455 ( 1.706 -3.486 -0.026) 3.881 19.474 ( 0.549 -0.576 -0.289) 0.846 19.563 ( -0.632 -0.917 -0.079) 1.116 42.444 ( -2.754 -0.553 0.181) 2.815 42.500 ( 4.436 -2.046 0.215) 4.889 42.509 ( -2.467 1.838 -0.061) 3.077 42.703 ( -0.044 2.493 -1.453) 2.885 65.748 ( -4.057 7.717 1.528) 8.852 67.023 ( 2.030 11.296 -5.983) 12.943 67.360 ( 1.063 -11.731 2.233) 11.989 69.022 ( -10.580 -8.179 -12.340) 18.196 ======================= Grid point 129 (40/216) ======================= q-point: ( 0.36 0.00 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.947 ( -15.948 16.395 15.948) 27.883 2.258 ( -11.980 18.417 7.614) 23.253 2.557 ( -1.088 9.771 6.965) 12.049 3.159 ( -3.752 14.677 6.608) 16.528 3.839 ( -20.219 19.556 -2.163) 28.213 4.198 ( 17.592 -0.525 1.098) 17.634 4.353 ( 14.422 5.378 -4.464) 16.026 4.489 ( 1.306 -0.239 -2.882) 3.173 5.050 ( -6.757 -2.916 -2.648) 7.821 5.156 ( 19.596 -9.003 -2.947) 21.766 5.238 ( -8.821 -12.207 -6.791) 16.521 5.416 ( -5.794 -1.961 8.249) 10.270 5.479 ( -0.053 16.496 -0.085) 16.497 5.776 ( -2.056 -2.981 -1.316) 3.853 5.878 ( -2.578 15.709 4.287) 16.486 6.000 ( -3.766 -3.309 4.541) 6.764 6.222 ( -0.276 -5.660 -4.699) 7.361 6.540 ( -1.053 5.654 2.237) 6.171 6.647 ( 0.193 -4.999 -1.183) 5.141 6.735 ( -6.530 5.779 -5.412) 10.263 7.212 ( 5.705 -5.943 3.721) 9.039 7.486 ( -5.386 -4.176 -2.102) 7.132 7.612 ( -4.518 -4.776 2.601) 7.070 7.789 ( -3.928 -4.010 1.971) 5.950 8.531 ( 7.600 -12.152 -9.276) 17.073 8.890 ( 10.991 -11.818 -0.618) 16.151 18.927 ( 0.728 1.897 0.080) 2.033 18.963 ( -0.513 0.538 0.511) 0.902 19.033 ( -0.025 -0.513 0.405) 0.654 19.177 ( -1.566 5.208 -0.440) 5.456 19.388 ( 2.107 -4.105 -0.081) 4.615 19.393 ( 0.580 0.189 -0.076) 0.615 19.458 ( 0.568 -0.505 -0.411) 0.864 19.566 ( -0.721 -0.911 -0.070) 1.164 42.431 ( 2.327 -0.976 0.163) 2.529 42.495 ( -3.670 -0.844 0.487) 3.797 42.545 ( -0.277 1.418 -0.099) 1.448 42.697 ( 1.762 2.439 -1.775) 3.494 65.878 ( -3.089 6.741 1.113) 7.498 67.064 ( 0.205 15.621 -6.466) 16.907 67.230 ( 3.626 -14.313 1.705) 14.863 69.022 ( -7.992 -7.911 -6.322) 12.900 ======================= Grid point 130 (41/216) ======================= q-point: ( 0.45 0.00 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.402 ( -10.744 14.498 10.366) 20.810 2.629 ( -7.010 8.495 11.077) 15.621 2.668 ( -1.367 13.944 2.842) 14.296 3.266 ( 3.486 4.597 1.989) 6.103 3.791 ( 15.780 -4.512 -4.344) 16.978 4.066 ( 10.969 1.598 -8.116) 13.739 4.253 ( 8.003 11.894 0.312) 14.340 4.578 ( -8.850 7.475 8.399) 14.308 4.678 ( 18.264 -8.438 -2.990) 20.340 5.033 ( -4.857 -15.532 -4.021) 16.763 5.265 ( -5.828 -3.318 -4.756) 8.222 5.510 ( -0.517 -3.279 -2.930) 4.428 5.564 ( 2.799 13.760 -3.177) 14.397 5.846 ( -6.481 0.707 2.027) 6.827 6.007 ( 2.013 -0.158 3.359) 3.919 6.106 ( -3.068 9.803 6.498) 12.155 6.246 ( -8.197 -5.258 1.143) 9.805 6.525 ( -0.921 -9.085 -1.186) 9.208 6.772 ( -4.711 18.749 2.624) 19.510 6.846 ( -5.280 -0.082 -2.985) 6.065 7.164 ( -5.000 -2.059 3.633) 6.514 7.508 ( -3.216 -1.804 1.151) 3.863 7.669 ( -4.494 -0.062 -2.566) 5.175 7.800 ( -1.115 -7.869 -0.428) 7.959 8.187 ( 11.245 -12.362 -9.073) 19.015 8.685 ( 5.779 -7.974 2.432) 10.144 18.930 ( 0.896 1.836 0.036) 2.043 18.979 ( -0.457 0.401 0.419) 0.738 19.032 ( -0.008 -0.464 0.326) 0.568 19.247 ( -2.063 5.474 -0.345) 5.860 19.308 ( 2.609 -5.301 0.011) 5.908 19.391 ( 0.305 0.546 -0.194) 0.655 19.443 ( 0.396 -0.389 -0.329) 0.646 19.568 ( -0.652 -1.052 -0.042) 1.238 42.418 ( -0.685 0.563 0.174) 0.903 42.536 ( 2.434 0.745 -0.107) 2.547 42.548 ( -3.413 -1.006 0.450) 3.587 42.663 ( 2.663 1.111 -1.423) 3.218 65.964 ( -0.790 5.295 0.502) 5.377 67.043 ( 5.989 -13.938 0.868) 15.195 67.178 ( -3.746 15.996 -5.963) 17.477 69.035 ( -5.571 -6.883 -1.295) 8.949 ======================= Grid point 131 (42/216) ======================= q-point: ( 0.55 0.00 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.592 ( 8.217 3.936 3.843) 9.888 2.692 ( -0.166 11.268 1.583) 11.380 3.005 ( -6.683 11.901 3.298) 14.042 3.215 ( 3.187 -1.086 -2.495) 4.191 3.485 ( 8.949 -3.077 -2.682) 9.836 3.880 ( 4.787 -3.403 -2.280) 6.300 4.144 ( 11.916 8.869 -1.924) 14.978 4.436 ( 4.198 -10.539 2.075) 11.532 4.821 ( -5.304 0.375 1.739) 5.594 4.973 ( -3.852 -12.367 -1.161) 13.005 5.228 ( -1.915 -2.001 -2.475) 3.715 5.455 ( 2.252 0.402 -1.606) 2.795 5.618 ( -0.289 13.580 -3.103) 13.932 5.943 ( -3.063 -0.799 -0.142) 3.169 5.990 ( 4.068 -1.022 3.780) 5.646 6.197 ( 4.437 4.935 4.207) 7.857 6.336 ( -5.919 -4.350 2.297) 7.696 6.508 ( -3.646 -3.216 2.493) 5.463 6.739 ( 8.008 -8.726 -1.608) 11.952 6.998 ( -4.210 16.618 -2.150) 17.277 7.396 ( -11.268 -0.018 2.504) 11.543 7.532 ( 11.494 -11.961 -7.109) 18.048 7.663 ( -8.857 6.941 1.308) 11.329 7.754 ( -6.858 2.758 0.030) 7.392 7.981 ( 0.426 -4.949 -1.236) 5.119 8.616 ( -0.332 -3.884 2.822) 4.812 18.931 ( 0.985 1.747 0.045) 2.006 18.988 ( -0.065 0.142 0.027) 0.158 19.032 ( -0.128 -0.164 0.278) 0.348 19.222 ( 2.583 -5.580 0.084) 6.149 19.324 ( -2.217 5.240 -0.167) 5.692 19.388 ( 0.239 0.217 -0.329) 0.461 19.437 ( 0.009 -0.065 0.003) 0.065 19.568 ( -0.548 -1.237 0.009) 1.353 42.455 ( -2.275 1.575 0.051) 2.767 42.490 ( 3.378 0.478 -0.007) 3.411 42.585 ( -1.904 -1.027 0.191) 2.172 42.616 ( 2.280 -0.913 -0.494) 2.505 66.003 ( 1.464 4.882 0.116) 5.098 66.836 ( 4.605 -17.434 1.726) 18.114 67.337 ( -4.383 18.251 -6.703) 19.931 69.057 ( -2.882 -5.244 2.981) 6.685 ======================= Grid point 132 (43/216) ======================= q-point: (-0.36 0.00 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.419 ( 15.148 0.138 -3.980) 15.663 2.689 ( 9.927 2.780 -6.643) 12.264 2.922 ( 11.592 7.441 -8.732) 16.310 3.130 ( 1.619 -6.531 -3.302) 7.495 3.647 ( -13.987 7.160 9.982) 18.615 3.813 ( -2.654 -11.232 -2.959) 11.915 4.078 ( -1.373 5.196 0.022) 5.375 4.420 ( -3.094 1.439 4.280) 5.474 4.719 ( 7.461 -4.927 -8.335) 12.223 4.895 ( -6.474 -19.097 1.495) 20.220 5.358 ( -2.749 3.801 7.270) 8.652 5.429 ( -0.125 4.528 -1.372) 4.733 5.712 ( 1.915 8.391 -0.225) 8.609 5.875 ( 5.454 -10.261 0.511) 11.631 5.951 ( 0.246 -2.317 -0.883) 2.492 6.125 ( 11.148 5.039 -0.571) 12.248 6.412 ( -3.218 0.868 3.055) 4.521 6.521 ( 6.838 -5.405 -3.468) 9.381 6.578 ( -1.049 -1.581 5.415) 5.738 7.059 ( 14.054 0.816 0.430) 14.084 7.246 ( -1.048 1.387 -4.795) 5.101 7.500 ( -4.133 -1.052 -0.644) 4.313 7.754 ( -3.957 3.820 -5.873) 8.046 7.892 ( -0.698 -1.606 -1.765) 2.487 8.199 ( -18.082 12.165 10.294) 24.102 8.672 ( -6.334 -1.273 2.941) 7.098 18.930 ( 1.048 1.726 0.084) 2.021 18.984 ( 0.388 -0.091 -0.397) 0.562 19.036 ( -0.128 -0.073 0.195) 0.244 19.141 ( 2.137 -5.251 0.136) 5.670 19.382 ( -0.014 0.014 -0.294) 0.295 19.398 ( -1.950 4.354 -0.091) 4.772 19.443 ( -0.408 0.414 0.310) 0.659 19.565 ( -0.459 -1.423 0.055) 1.497 42.442 ( 2.478 1.001 0.113) 2.675 42.513 ( -2.174 1.544 -0.084) 2.668 42.573 ( 1.064 -2.581 0.449) 2.827 42.592 ( -0.046 -1.184 -0.033) 1.185 65.995 ( 4.687 4.137 -0.577) 6.279 66.668 ( 0.476 -16.573 3.061) 16.860 67.488 ( -3.500 16.081 -6.767) 17.794 69.084 ( 0.192 -3.165 7.010) 7.694 ======================= Grid point 133 (44/216) ======================= q-point: (-0.27 0.00 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.056 ( 18.300 -4.748 -15.624) 24.526 2.412 ( 19.249 5.289 -6.643) 21.038 2.736 ( 11.287 4.752 -10.862) 16.370 2.923 ( 10.672 -16.920 -5.612) 20.777 3.819 ( -16.985 -6.827 -3.054) 18.559 3.981 ( -0.630 7.799 4.687) 9.121 4.143 ( 5.578 3.269 8.435) 10.628 4.466 ( -8.924 1.000 -7.421) 11.649 4.733 ( -7.880 1.324 8.189) 11.441 4.886 ( -14.533 -13.753 -0.738) 20.023 5.359 ( 13.130 -12.209 -5.844) 18.858 5.387 ( -1.630 -4.103 -2.325) 4.989 5.680 ( 6.935 0.560 6.301) 9.387 5.690 ( 5.835 1.759 0.323) 6.103 5.950 ( -0.403 4.907 -2.853) 5.690 6.049 ( 3.431 4.833 2.334) 6.370 6.371 ( 8.441 -0.967 0.305) 8.502 6.494 ( -1.372 3.187 3.171) 4.700 6.608 ( -0.186 -3.334 5.088) 6.085 6.822 ( 12.037 -2.561 3.322) 12.747 7.322 ( -3.716 7.309 -4.437) 9.323 7.514 ( 0.585 -1.787 0.512) 1.949 7.792 ( -3.821 4.018 -7.537) 9.357 7.870 ( -1.147 -1.115 -3.259) 3.630 8.617 ( -9.736 10.936 9.666) 17.545 8.846 ( -13.403 0.451 5.690) 14.568 18.929 ( 1.094 1.870 0.149) 2.172 18.970 ( 0.635 -0.134 -0.599) 0.883 19.028 ( 0.933 -1.986 0.369) 2.225 19.082 ( 0.480 -2.766 -0.333) 2.827 19.378 ( -0.053 -0.217 -0.208) 0.305 19.448 ( -1.023 0.810 0.295) 1.337 19.470 ( -1.297 3.279 0.148) 3.529 19.560 ( -0.446 -1.571 0.074) 1.635 42.439 ( -0.457 2.013 0.238) 2.078 42.538 ( 0.234 0.549 -0.185) 0.625 42.546 ( 0.458 -2.388 0.655) 2.518 42.574 ( 0.368 -2.043 0.185) 2.084 65.906 ( 8.137 0.860 -1.619) 8.341 66.619 ( -4.756 -10.614 4.509) 12.474 67.594 ( -1.973 11.594 -5.725) 13.080 69.112 ( 3.736 -1.070 11.503) 12.142 ======================= Grid point 134 (45/216) ======================= q-point: (-0.18 0.00 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.566 ( 19.496 -4.465 -21.744) 29.544 2.069 ( 26.017 7.385 -8.115) 28.236 2.464 ( 17.327 -12.616 -8.217) 22.955 2.487 ( 12.918 -5.579 -11.762) 18.340 3.535 ( 45.327 -0.927 -2.690) 45.416 4.153 ( -28.469 -1.219 -1.128) 28.518 4.369 ( -3.245 5.252 9.437) 11.277 4.575 ( -1.409 2.964 2.947) 4.411 4.758 ( 1.521 -5.427 3.856) 6.829 4.946 ( 5.738 -15.028 -11.983) 20.059 5.261 ( -31.458 -1.714 -0.202) 31.506 5.339 ( 8.035 0.502 -8.461) 11.679 5.518 ( -0.409 0.406 2.398) 2.466 5.831 ( -0.692 4.784 11.085) 12.093 6.008 ( -3.159 4.592 0.029) 5.574 6.061 ( 3.030 3.713 2.527) 5.418 6.233 ( 7.883 -2.848 1.909) 8.596 6.510 ( 5.190 -2.245 5.855) 8.140 6.647 ( -0.304 4.992 1.678) 5.275 6.725 ( 0.479 -3.465 2.332) 4.204 7.392 ( -4.012 4.365 -4.079) 7.196 7.476 ( 3.354 -2.280 3.143) 5.131 7.810 ( -2.311 2.872 -7.091) 7.992 7.851 ( -0.894 0.407 -5.103) 5.196 8.830 ( -5.746 3.778 3.195) 7.583 9.155 ( -11.540 3.049 13.170) 17.774 18.931 ( 1.144 2.332 0.298) 2.614 18.954 ( 0.690 -0.084 -0.604) 0.921 18.985 ( 1.487 -3.799 0.758) 4.150 19.071 ( -0.880 -0.305 -1.325) 1.619 19.377 ( -0.137 -0.159 -0.055) 0.217 19.467 ( -0.768 0.128 0.347) 0.852 19.514 ( -0.777 2.525 0.036) 2.642 19.556 ( -0.747 -1.360 0.095) 1.554 42.490 ( -2.882 2.495 0.298) 3.824 42.510 ( 2.769 0.168 -0.122) 2.776 42.521 ( 2.138 -0.368 -0.165) 2.176 42.567 ( -2.225 -3.748 0.930) 4.457 65.756 ( 8.374 -1.028 -2.083) 8.691 66.691 ( -6.676 -4.297 4.883) 9.320 67.649 ( -0.825 6.149 -3.751) 7.250 69.137 ( 8.185 0.308 17.818) 19.611 ======================= Grid point 135 (46/216) ======================= q-point: (-0.09 0.00 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.050 ( 19.769 -0.000 -25.126) 31.971 1.549 ( 36.469 -0.000 -9.349) 37.648 1.971 ( 28.464 -0.000 -10.103) 30.204 2.219 ( 9.388 -0.000 -11.217) 14.627 2.708 ( 51.830 0.000 -1.829) 51.862 4.266 ( 22.422 0.000 8.673) 24.041 4.560 ( -22.628 -0.000 -0.143) 22.628 4.640 ( 0.602 0.000 4.090) 4.134 4.783 ( -6.078 0.000 0.753) 6.125 4.860 ( -13.450 -0.000 -12.445) 18.325 5.093 ( 11.731 -0.000 -7.420) 13.881 5.520 ( -5.975 0.000 2.861) 6.624 5.839 ( -26.711 0.000 3.088) 26.889 5.842 ( 10.252 0.000 2.801) 10.628 6.016 ( 2.293 -0.000 -0.837) 2.441 6.158 ( 1.146 0.000 5.225) 5.349 6.183 ( -7.735 0.000 5.392) 9.428 6.432 ( 7.131 0.000 3.692) 8.030 6.691 ( -2.037 0.000 0.294) 2.058 6.755 ( -2.545 -0.000 0.028) 2.545 7.450 ( 3.667 0.000 7.510) 8.357 7.462 ( -6.572 -0.000 -3.732) 7.558 7.790 ( 0.430 -0.000 -4.394) 4.415 7.814 ( -0.514 -0.000 -7.422) 7.440 8.942 ( -4.648 0.000 1.249) 4.813 9.413 ( -3.479 0.000 17.545) 17.887 18.939 ( 0.545 -0.000 -0.281) 0.613 18.939 ( 1.770 0.000 1.591) 2.380 18.942 ( 0.585 -0.000 -0.157) 0.606 19.073 ( -1.538 -0.000 -2.618) 3.036 19.378 ( -0.136 0.000 0.039) 0.142 19.481 ( -0.610 0.000 0.245) 0.657 19.529 ( 0.010 -0.000 -0.046) 0.048 19.567 ( -1.008 0.000 0.128) 1.016 42.465 ( 3.547 0.000 -0.067) 3.547 42.468 ( 2.738 0.000 -0.063) 2.738 42.563 ( -3.733 -0.000 0.017) 3.733 42.599 ( -3.151 0.000 0.824) 3.256 65.619 ( 6.328 -0.000 -1.884) 6.603 66.810 ( -5.732 0.000 4.093) 7.043 67.662 ( -0.391 -0.000 -1.672) 1.717 69.152 ( 15.078 0.000 29.253) 32.910 ======================= Grid point 136 (47/216) ======================= q-point: ( 0.00 0.09 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 216 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.805 ( 26.368 0.000 -0.000) 26.368 1.469 ( 38.710 0.000 -0.000) 38.710 1.890 ( 32.796 0.000 -0.000) 32.796 2.125 ( 10.575 0.000 -0.000) 10.575 2.699 ( 51.923 0.000 -0.000) 51.923 4.342 ( 22.706 0.000 -0.000) 22.706 4.558 ( -22.684 -0.000 0.000) 22.684 4.676 ( 1.384 0.000 -0.000) 1.384 4.748 ( -14.509 -0.000 0.000) 14.509 4.790 ( -5.453 -0.000 0.000) 5.453 5.027 ( 11.317 0.000 -0.000) 11.317 5.542 ( -7.283 -0.000 0.000) 7.283 5.864 ( 14.263 0.000 -0.000) 14.263 5.866 ( -28.464 -0.000 0.000) 28.464 6.008 ( 4.392 0.000 -0.000) 4.392 6.203 ( -0.566 -0.000 0.000) 0.566 6.228 ( -10.922 -0.000 0.000) 10.922 6.466 ( 8.746 0.000 -0.000) 8.746 6.691 ( -3.206 -0.000 0.000) 3.206 6.754 ( -0.050 -0.000 0.000) 0.050 7.429 ( -7.537 -0.000 0.000) 7.537 7.535 ( 1.879 0.000 -0.000) 1.879 7.731 ( 1.068 0.000 -0.000) 1.068 7.751 ( -0.683 -0.000 0.000) 0.683 8.953 ( -4.446 -0.000 0.000) 4.446 9.575 ( -10.650 -0.000 0.000) 10.650 18.935 ( 0.591 0.000 -0.000) 0.591 18.942 ( 0.555 0.000 -0.000) 0.555 18.960 ( 0.957 0.000 -0.000) 0.957 19.041 ( -0.000 -0.000 0.000) 0.000 19.379 ( -0.138 -0.000 0.000) 0.138 19.483 ( -0.611 -0.000 0.000) 0.611 19.528 ( 0.035 0.000 -0.000) 0.035 19.568 ( -1.026 -0.000 0.000) 1.026 42.464 ( 3.560 0.000 -0.000) 3.560 42.467 ( 2.688 0.000 -0.000) 2.688 42.564 ( -3.685 -0.000 0.000) 3.685 42.606 ( -3.141 -0.000 0.000) 3.141 65.603 ( 6.571 0.000 -0.000) 6.571 66.843 ( -6.117 -0.000 0.000) 6.117 67.649 ( -0.936 -0.000 0.000) 0.936 69.434 ( -1.165 -0.000 0.000) 1.165 ======================= Grid point 138 (48/216) ======================= q-point: ( 0.18 0.09 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.773 ( -0.000 19.339 26.888) 33.121 0.813 ( 0.000 35.502 13.562) 38.004 1.331 ( 0.000 52.388 26.381) 58.655 2.076 ( 0.000 10.027 6.820) 12.127 2.270 ( 0.000 18.941 8.643) 20.820 3.873 ( 0.000 6.064 -9.043) 10.889 4.710 ( 0.000 8.039 -3.121) 8.624 4.859 ( -0.000 -2.411 6.009) 6.475 4.898 ( 0.000 7.008 -2.199) 7.345 4.984 ( 0.000 5.892 1.549) 6.092 5.232 ( -0.000 1.448 4.552) 4.777 5.455 ( -0.000 -14.831 1.271) 14.886 5.800 ( -0.000 -4.896 11.096) 12.128 5.803 ( -0.000 -9.433 -3.177) 9.954 6.265 ( 0.000 -2.201 -9.066) 9.329 6.296 ( 0.000 0.622 -4.723) 4.764 6.311 ( -0.000 -3.688 -1.595) 4.018 6.505 ( -0.000 -7.807 8.044) 11.210 6.606 ( 0.000 -1.198 -7.581) 7.675 6.766 ( -0.000 -2.019 1.565) 2.554 6.826 ( -0.000 1.515 4.817) 5.050 7.574 ( 0.000 3.230 -8.748) 9.325 7.690 ( -0.000 -9.327 6.050) 11.117 7.726 ( -0.000 -2.595 5.346) 5.942 8.968 ( -0.000 -5.992 -1.120) 6.096 9.349 ( 0.000 15.571 -22.479) 27.345 18.891 ( 0.000 1.813 0.202) 1.824 18.934 ( -0.000 0.411 0.559) 0.693 18.990 ( 0.000 3.740 -2.579) 4.543 19.144 ( -0.000 -2.922 1.635) 3.349 19.388 ( 0.000 0.439 0.271) 0.516 19.489 ( 0.000 -0.285 -0.265) 0.389 19.518 ( -0.000 -1.149 0.106) 1.154 19.574 ( -0.000 -1.095 -0.192) 1.111 42.403 ( 0.000 0.619 0.044) 0.620 42.422 ( 0.000 0.574 -0.068) 0.578 42.629 ( -0.000 -0.587 0.120) 0.599 42.656 ( -0.000 -0.690 -0.263) 0.738 65.563 ( 0.000 4.988 2.548) 5.601 66.912 ( 0.000 4.901 -8.913) 10.172 67.441 ( -0.000 -2.687 5.909) 6.491 68.448 ( 0.000 36.999 -41.437) 55.551 ======================= Grid point 139 (49/216) ======================= q-point: ( 0.27 0.09 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.248 ( -11.441 15.036 26.347) 32.421 1.406 ( -20.141 26.963 13.365) 36.211 2.177 ( -20.956 30.802 15.937) 40.521 2.328 ( -12.691 26.664 11.869) 31.826 2.605 ( -11.407 21.708 11.093) 26.914 3.959 ( -14.295 7.186 -12.039) 20.023 4.694 ( 7.751 7.514 -4.550) 11.715 4.842 ( 7.995 3.184 -2.847) 9.064 4.958 ( -2.264 -2.448 6.406) 7.222 4.964 ( 4.450 1.605 0.149) 4.733 5.241 ( 3.390 3.259 8.429) 9.652 5.493 ( -11.283 -0.990 -0.391) 11.333 5.670 ( -0.113 -12.488 -5.592) 13.684 5.796 ( 7.987 -3.504 5.963) 10.565 5.945 ( 7.593 -2.859 -2.772) 8.574 6.151 ( 13.523 -3.406 -1.961) 14.083 6.310 ( 1.534 5.622 -6.297) 8.580 6.476 ( -0.918 4.680 -6.040) 7.696 6.614 ( -1.393 -5.954 -2.097) 6.464 6.773 ( 2.475 -4.635 2.059) 5.644 7.104 ( -24.251 -7.150 -2.095) 25.370 7.490 ( 3.543 -2.135 -4.563) 6.159 7.676 ( -2.369 -11.101 6.518) 13.089 7.762 ( -1.125 -2.667 5.877) 6.551 8.867 ( 3.271 -8.663 -2.991) 9.731 9.266 ( 2.372 0.625 -13.820) 14.036 18.910 ( 0.132 1.980 0.256) 2.001 18.944 ( -0.109 0.596 0.729) 0.948 19.008 ( -0.742 2.932 -1.144) 3.233 19.119 ( 1.394 -0.370 0.664) 1.587 19.391 ( 0.344 0.596 0.159) 0.707 19.480 ( 0.327 -0.495 -0.429) 0.732 19.501 ( 0.801 -2.156 0.088) 2.301 19.563 ( -0.294 -1.168 -0.211) 1.223 42.416 ( -1.269 0.121 0.145) 1.283 42.452 ( -2.579 1.440 -0.082) 2.955 42.588 ( 3.894 -1.941 0.189) 4.356 42.664 ( -1.060 1.159 -1.082) 1.907 65.655 ( -2.268 6.839 3.236) 7.898 66.896 ( -1.453 5.707 -10.030) 11.631 67.472 ( 0.035 -6.924 4.236) 8.117 68.619 ( -21.872 10.083 -25.852) 35.332 ======================= Grid point 140 (50/216) ======================= q-point: ( 0.36 0.09 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.762 ( -13.196 13.228 23.558) 30.068 1.975 ( -13.885 21.071 11.700) 27.815 2.519 ( -4.495 9.701 12.189) 16.214 2.958 ( -9.789 25.678 11.545) 29.807 3.253 ( -29.830 26.171 8.556) 40.595 4.176 ( -15.912 5.808 -12.032) 20.777 4.510 ( 12.297 0.281 -5.562) 13.500 4.621 ( 20.037 1.119 1.711) 20.141 4.914 ( -2.212 4.619 -1.272) 5.277 5.104 ( -10.944 -9.180 1.126) 14.329 5.333 ( 1.179 9.610 2.125) 9.912 5.466 ( 1.025 -14.765 -1.628) 14.890 5.610 ( 8.349 -6.766 -2.105) 10.951 5.720 ( -0.441 13.899 4.016) 14.474 5.829 ( 8.128 -2.609 -1.683) 8.701 5.995 ( -2.207 -0.383 3.582) 4.225 6.239 ( 4.318 0.851 -6.526) 7.871 6.496 ( -2.522 3.446 -3.028) 5.235 6.589 ( -2.155 0.428 -3.893) 4.471 6.688 ( 3.085 -4.102 -1.423) 5.326 7.309 ( -9.169 -1.711 -4.931) 10.550 7.390 ( -0.578 -7.754 1.515) 7.921 7.674 ( -2.908 -11.545 5.105) 12.954 7.808 ( -1.468 -3.233 6.248) 7.186 8.667 ( 6.807 -11.001 -7.361) 14.884 9.076 ( 6.881 -6.084 -7.498) 11.856 18.922 ( 0.622 2.049 0.175) 2.148 18.958 ( -0.300 0.501 0.863) 1.042 19.033 ( -0.463 1.117 0.067) 1.211 19.120 ( -0.407 2.749 -0.394) 2.806 19.391 ( 0.352 0.593 0.015) 0.689 19.454 ( 1.647 -3.277 -0.092) 3.669 19.468 ( 0.624 -0.853 -0.492) 1.166 19.562 ( -0.698 -0.916 -0.141) 1.160 42.449 ( -2.670 -0.491 0.320) 2.734 42.504 ( 3.661 -1.652 0.326) 4.030 42.508 ( -1.866 1.556 -0.063) 2.430 42.674 ( 0.256 2.424 -1.877) 3.076 65.785 ( -3.173 7.115 2.985) 8.342 66.892 ( -1.043 9.175 -9.854) 13.504 67.401 ( 3.012 -10.326 2.577) 11.060 68.792 ( -16.573 0.245 -14.191) 21.820 ======================= Grid point 141 (51/216) ======================= q-point: ( 0.45 0.09 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.237 ( -10.748 13.326 18.358) 25.102 2.391 ( -9.827 18.407 8.609) 22.572 2.724 ( -0.007 5.345 13.632) 14.643 3.277 ( -1.376 9.715 6.911) 12.002 3.805 ( -11.656 15.954 -1.918) 19.852 4.116 ( 13.970 1.436 -7.804) 16.066 4.342 ( 14.683 7.783 -1.941) 16.731 4.497 ( -6.014 0.843 6.174) 8.660 4.986 ( 5.349 0.523 -6.067) 8.105 5.087 ( -2.195 -17.376 -6.487) 18.676 5.137 ( 5.196 -4.731 -3.275) 7.754 5.461 ( 0.877 6.595 -2.034) 6.957 5.530 ( -1.424 0.255 5.210) 5.407 5.758 ( -5.559 -1.986 -0.613) 5.935 5.954 ( -3.628 15.568 4.251) 16.541 6.084 ( 1.665 1.804 4.664) 5.271 6.159 ( -6.902 -3.602 -1.840) 8.000 6.545 ( -2.116 -2.178 -1.621) 3.442 6.632 ( -0.332 5.758 -0.432) 5.784 6.653 ( -8.359 5.133 -4.350) 10.731 7.257 ( 3.568 -5.359 1.491) 6.609 7.449 ( -7.665 -4.484 -1.979) 9.098 7.652 ( -2.577 -10.566 1.639) 10.998 7.848 ( -0.825 -3.898 5.683) 6.940 8.362 ( 9.655 -12.213 -10.992) 19.057 8.863 ( 7.452 -7.343 -2.555) 10.770 18.928 ( 0.860 2.010 0.067) 2.188 18.975 ( -0.367 0.390 0.875) 1.025 19.039 ( 0.136 -0.264 0.356) 0.463 19.168 ( -1.838 5.017 -0.615) 5.379 19.386 ( 1.645 -3.133 -0.130) 3.541 19.392 ( 0.989 -1.019 0.018) 1.421 19.450 ( 0.443 -0.519 -0.610) 0.916 19.565 ( -0.766 -0.912 -0.092) 1.195 42.434 ( 2.362 -0.782 0.242) 2.500 42.504 ( -3.470 -0.690 0.659) 3.599 42.543 ( -0.394 1.213 -0.138) 1.283 42.664 ( 1.483 2.446 -2.034) 3.510 65.903 ( -2.160 5.801 1.937) 6.486 66.934 ( -2.114 14.331 -9.100) 17.107 67.262 ( 3.516 -15.105 2.110) 15.652 68.915 ( -11.478 -1.978 -6.290) 13.237 ======================= Grid point 142 (52/216) ======================= q-point: ( 0.55 0.09 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.560 ( -1.428 15.876 8.376) 18.007 2.733 ( -2.511 10.656 5.324) 12.174 2.854 ( -3.295 4.588 16.012) 16.979 3.290 ( 5.737 -0.427 0.287) 5.760 3.685 ( 16.190 -3.793 -7.462) 18.226 3.968 ( 8.278 5.323 -3.755) 10.534 4.258 ( 11.009 10.743 -0.371) 15.387 4.571 ( 9.412 -8.202 -8.917) 15.342 4.738 ( -4.504 5.015 9.131) 11.349 5.008 ( -6.317 -13.530 0.614) 14.944 5.174 ( -4.652 -2.744 -4.396) 6.964 5.469 ( 0.591 6.867 -2.503) 7.333 5.530 ( 4.103 0.439 -0.897) 4.222 5.851 ( -5.523 2.480 -0.843) 6.113 6.054 ( -1.932 0.202 -0.055) 1.943 6.185 ( -0.005 10.780 3.251) 11.259 6.295 ( -6.769 -2.320 5.790) 9.204 6.505 ( -2.832 -6.705 -0.892) 7.333 6.767 ( -4.412 13.635 -1.709) 14.432 6.852 ( -6.360 2.755 2.118) 7.248 7.227 ( -6.609 -2.567 4.224) 8.253 7.500 ( -6.388 -2.047 -1.850) 6.958 7.596 ( -1.243 -6.861 -6.923) 9.826 7.829 ( 3.787 -7.776 3.959) 9.513 8.055 ( 6.071 -8.232 -6.752) 12.256 8.704 ( 4.686 -4.930 -0.047) 6.802 18.931 ( 0.937 1.898 0.034) 2.117 18.988 ( -0.106 0.210 0.599) 0.643 19.036 ( 0.165 -0.241 0.236) 0.376 19.241 ( -2.295 5.491 -0.369) 5.963 19.308 ( 2.552 -5.269 0.003) 5.855 19.388 ( 0.242 0.172 -0.200) 0.358 19.437 ( 0.128 -0.256 -0.389) 0.483 19.568 ( -0.696 -1.034 -0.042) 1.247 42.421 ( -0.487 0.726 0.209) 0.899 42.534 ( 2.249 0.557 -0.124) 2.320 42.556 ( -3.083 -0.911 0.533) 3.259 42.639 ( 1.843 1.223 -1.440) 2.640 65.974 ( -0.248 4.639 0.792) 4.712 67.021 ( 2.173 9.235 -4.922) 10.688 67.108 ( -2.771 -10.629 -0.870) 11.019 69.016 ( -7.554 -1.803 -0.940) 7.823 ======================= Grid point 143 (53/216) ======================= q-point: (-0.36 0.09 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.645 ( 15.298 2.583 1.547) 15.592 2.716 ( 4.449 10.240 2.064) 11.354 3.021 ( 11.594 5.086 -1.748) 12.781 3.196 ( 2.000 -2.869 1.524) 3.815 3.504 ( -3.863 4.090 4.565) 7.245 3.853 ( 2.762 -4.531 -1.178) 5.436 4.064 ( 10.561 3.455 -7.450) 13.378 4.436 ( -2.235 -5.231 -1.616) 5.913 4.813 ( 6.597 -3.499 -4.422) 8.678 4.973 ( -7.006 -16.337 3.322) 18.084 5.292 ( -6.627 8.579 8.379) 13.701 5.417 ( 2.233 -4.540 -2.491) 5.639 5.591 ( -2.651 14.006 0.004) 14.255 5.913 ( 0.285 3.135 -2.202) 3.842 6.056 ( 2.310 -1.856 1.763) 3.448 6.224 ( 5.531 6.143 -0.629) 8.290 6.366 ( -4.318 -4.795 1.874) 6.719 6.552 ( -3.592 -3.225 2.967) 5.666 6.737 ( 8.885 -9.240 1.029) 12.860 6.964 ( -3.461 16.073 -1.662) 16.525 7.371 ( -1.815 -9.544 -7.402) 12.213 7.449 ( 2.021 -1.212 -0.725) 2.465 7.669 ( -5.297 -1.736 0.560) 5.602 7.801 ( -11.337 7.265 4.033) 14.056 7.958 ( -4.219 -3.960 -1.592) 6.002 8.649 ( -0.080 -0.894 1.318) 1.595 18.932 ( 0.988 1.803 0.048) 2.057 18.989 ( 0.374 -0.065 0.106) 0.395 19.036 ( 0.013 0.079 0.198) 0.214 19.223 ( 2.506 -5.573 0.076) 6.111 19.321 ( -2.375 5.287 -0.157) 5.798 19.383 ( 0.130 -0.149 -0.303) 0.362 19.437 ( -0.287 0.109 -0.022) 0.308 19.568 ( -0.585 -1.206 0.013) 1.341 42.457 ( -2.121 1.631 0.106) 2.678 42.490 ( 3.262 0.427 -0.053) 3.291 42.588 ( -1.508 -1.014 0.200) 1.829 42.609 ( 1.206 -0.796 -0.399) 1.499 66.004 ( 1.867 4.729 0.118) 5.086 66.867 ( 3.340 -18.186 2.024) 18.601 67.227 ( -6.171 14.847 -6.424) 17.314 69.105 ( -4.414 -0.662 2.738) 5.237 ======================= Grid point 144 (54/216) ======================= q-point: (-0.27 0.09 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.303 ( 20.953 -5.768 -9.081) 23.553 2.633 ( 16.107 2.930 -0.566) 16.381 2.805 ( 14.753 10.022 -5.389) 18.631 3.117 ( 5.776 -5.527 1.570) 8.147 3.709 ( -2.425 -3.993 -5.269) 7.042 3.843 ( -12.222 0.411 9.196) 15.301 4.060 ( -14.979 1.165 -1.686) 15.119 4.454 ( 7.014 1.745 1.216) 7.330 4.584 ( -3.412 -7.528 -8.314) 11.723 4.977 ( -3.219 -16.223 7.321) 18.087 5.345 ( -1.223 -1.493 -5.120) 5.472 5.506 ( 2.398 8.809 6.085) 10.971 5.743 ( 0.266 8.076 3.905) 8.974 5.845 ( 3.520 -2.751 -2.287) 5.019 5.974 ( 6.998 -8.818 1.788) 11.399 6.108 ( 9.206 4.174 -0.646) 10.129 6.400 ( -2.453 -4.868 -4.437) 7.029 6.487 ( 1.768 1.422 -0.260) 2.283 6.677 ( 1.841 0.631 6.163) 6.463 7.064 ( 10.523 4.763 0.200) 11.552 7.179 ( -0.399 1.493 -3.760) 4.065 7.499 ( -4.319 -0.762 0.525) 4.417 7.666 ( -2.718 -0.749 -4.517) 5.325 7.861 ( -0.071 -3.663 -1.994) 4.171 8.351 ( -22.920 12.488 7.980) 27.294 8.703 ( -5.150 1.492 0.854) 5.429 18.931 ( 1.039 1.800 0.075) 2.079 18.979 ( 0.704 -0.179 -0.217) 0.758 19.039 ( 0.031 0.133 0.099) 0.169 19.142 ( 2.129 -5.401 0.049) 5.806 19.378 ( -0.077 -0.277 -0.190) 0.345 19.397 ( -2.144 4.496 -0.045) 4.981 19.447 ( -0.593 0.467 0.183) 0.777 19.566 ( -0.477 -1.398 0.045) 1.478 42.444 ( 2.426 1.091 0.133) 2.663 42.511 ( -2.084 1.509 -0.107) 2.575 42.580 ( 0.683 -1.915 0.353) 2.064 42.592 ( -0.280 -1.896 0.048) 1.917 65.987 ( 5.474 3.913 -0.341) 6.737 66.714 ( -1.385 -17.601 2.468) 17.827 67.388 ( -5.063 13.736 -5.156) 15.521 69.188 ( -1.998 0.894 5.404) 5.831 ======================= Grid point 145 (55/216) ======================= q-point: (-0.18 0.09 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.809 ( 23.210 -7.703 -12.607) 27.513 2.344 ( 23.325 6.157 -2.495) 24.253 2.594 ( 14.392 3.388 -6.018) 15.963 2.866 ( 16.103 -15.987 -1.704) 22.755 3.771 ( -19.545 -4.686 -2.496) 20.253 4.027 ( 15.004 5.301 1.552) 15.988 4.291 ( -0.755 1.852 7.496) 7.758 4.379 ( -18.230 3.633 -2.023) 18.699 4.770 ( -25.504 -2.899 -3.586) 25.918 4.915 ( 0.367 -14.138 4.028) 14.705 5.288 ( 18.518 -18.410 -2.248) 26.209 5.335 ( -1.325 -0.162 -3.555) 3.798 5.615 ( 11.060 0.476 -3.095) 11.494 5.844 ( 4.334 9.114 3.530) 10.692 5.955 ( -3.372 3.055 7.009) 8.356 6.088 ( 1.703 3.030 2.125) 4.074 6.318 ( 2.239 -1.541 -6.067) 6.648 6.542 ( 0.664 7.541 2.130) 7.864 6.698 ( 0.394 -2.794 5.434) 6.123 6.857 ( 11.991 -2.633 0.805) 12.303 7.254 ( -3.218 7.093 -3.409) 8.502 7.548 ( -0.626 -1.437 3.044) 3.424 7.682 ( -3.767 2.619 -5.549) 7.200 7.816 ( -0.087 -2.350 -3.143) 3.926 8.736 ( -5.746 6.097 4.878) 9.695 8.925 ( -20.198 6.691 3.735) 21.603 18.931 ( 1.068 1.994 0.105) 2.265 18.963 ( 0.825 -0.161 -0.294) 0.891 19.035 ( 0.564 -0.979 0.469) 1.223 19.074 ( 1.095 -3.920 -0.584) 4.112 19.376 ( -0.171 -0.280 -0.049) 0.331 19.452 ( -1.231 1.115 0.133) 1.666 19.472 ( -1.214 2.985 0.095) 3.223 19.561 ( -0.454 -1.563 0.044) 1.628 42.442 ( -0.437 2.209 0.163) 2.258 42.535 ( 0.203 0.473 -0.140) 0.533 42.553 ( 1.796 -0.709 0.207) 1.942 42.579 ( -1.309 -3.968 0.405) 4.198 65.887 ( 8.958 0.510 -0.727) 9.002 66.677 ( -6.336 -10.978 2.447) 12.909 67.519 ( -3.486 10.049 -3.262) 11.125 69.272 ( -0.435 2.341 7.415) 7.788 ======================= Grid point 146 (56/216) ======================= q-point: (-0.09 0.09 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.282 ( 25.014 -5.774 -10.498) 27.736 1.975 ( 29.329 6.911 -3.117) 30.293 2.340 ( 13.830 -0.364 -4.433) 14.528 2.392 ( 22.290 -18.353 -2.326) 28.967 3.524 ( 47.951 0.087 0.380) 47.953 4.138 ( -29.413 -0.982 -0.528) 29.434 4.486 ( -3.926 5.545 4.711) 8.268 4.568 ( -9.865 1.279 -3.176) 10.442 4.781 ( 6.121 -10.622 0.194) 12.261 4.864 ( 13.116 -10.451 0.227) 16.772 5.196 ( -7.902 -1.409 -4.817) 9.361 5.279 ( -15.948 -0.573 -0.309) 15.961 5.551 ( -5.203 0.464 1.194) 5.358 5.961 ( -3.434 9.707 2.782) 10.666 6.026 ( 4.485 1.263 3.318) 5.720 6.093 ( 2.800 4.662 1.079) 5.544 6.227 ( 0.616 -3.693 -1.723) 4.121 6.599 ( 3.537 1.169 4.399) 5.764 6.651 ( 5.436 2.001 -1.146) 5.905 6.750 ( -1.220 -2.963 0.749) 3.291 7.331 ( -4.735 3.220 -2.190) 6.131 7.548 ( 2.346 -0.717 3.770) 4.498 7.723 ( -2.583 2.633 -3.017) 4.765 7.771 ( 0.454 -0.831 -3.804) 3.921 8.864 ( -5.012 2.424 1.034) 5.663 9.314 ( -16.241 5.619 5.401) 18.014 18.934 ( 1.022 2.532 0.128) 2.734 18.947 ( 0.780 -0.096 -0.203) 0.811 19.000 ( 1.260 -4.273 0.940) 4.553 19.047 ( -0.154 -0.147 -1.280) 1.298 19.377 ( -0.189 -0.163 0.035) 0.252 19.471 ( -0.803 0.122 0.116) 0.821 19.515 ( -0.725 2.492 0.014) 2.596 19.557 ( -0.787 -1.327 0.033) 1.544 42.493 ( -3.021 2.700 0.142) 4.054 42.508 ( 2.813 0.222 -0.061) 2.822 42.519 ( 2.606 -0.272 -0.085) 2.622 42.579 ( -2.712 -4.269 0.444) 5.077 65.734 ( 8.942 -1.148 -0.665) 9.040 66.744 ( -7.636 -4.428 1.642) 8.978 67.607 ( -1.992 5.532 -1.332) 6.029 69.361 ( -0.151 2.911 7.978) 8.494 ======================= Grid point 150 (57/216) ======================= q-point: ( 0.27 0.18 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.099 ( 0.000 25.884 20.600) 33.080 1.194 ( -0.000 20.733 24.586) 32.161 1.901 ( -0.000 27.972 40.538) 49.252 2.183 ( 0.000 13.012 6.104) 14.372 2.511 ( -0.000 15.433 20.193) 25.415 3.674 ( 0.000 6.204 -14.908) 16.147 4.634 ( 0.000 8.029 -6.232) 10.164 4.851 ( 0.000 2.066 -3.860) 4.378 4.982 ( -0.000 -1.704 8.492) 8.661 5.013 ( 0.000 2.841 2.405) 3.722 5.332 ( -0.000 4.495 7.273) 8.550 5.399 ( -0.000 -7.511 -6.371) 9.849 5.725 ( -0.000 -10.961 -6.817) 12.908 5.925 ( -0.000 -4.059 3.497) 5.358 6.089 ( 0.000 6.707 -11.370) 13.201 6.191 ( 0.000 2.653 -7.359) 7.823 6.271 ( -0.000 -3.897 -3.170) 5.024 6.469 ( 0.000 -1.281 -8.879) 8.971 6.643 ( -0.000 -15.028 7.811) 16.936 6.781 ( -0.000 -2.662 0.318) 2.681 6.900 ( -0.000 -2.127 4.025) 4.552 7.371 ( 0.000 8.292 -13.361) 15.725 7.840 ( -0.000 -1.613 8.120) 8.279 7.845 ( -0.000 -12.664 10.533) 16.471 8.942 ( -0.000 -6.577 -1.939) 6.857 9.085 ( 0.000 13.782 -10.601) 17.387 18.896 ( 0.000 1.893 0.361) 1.927 18.947 ( -0.000 0.322 1.104) 1.150 18.963 ( 0.000 3.340 -1.036) 3.497 19.149 ( -0.000 -2.208 -0.642) 2.300 19.395 ( -0.000 0.069 0.565) 0.569 19.482 ( 0.000 -0.359 -0.502) 0.617 19.521 ( -0.000 -1.136 0.198) 1.153 19.569 ( -0.000 -1.095 -0.355) 1.151 42.404 ( 0.000 0.646 0.080) 0.650 42.420 ( 0.000 0.599 -0.123) 0.612 42.632 ( -0.000 -0.593 0.215) 0.631 42.653 ( -0.000 -0.985 -0.111) 0.991 65.621 ( -0.000 5.072 4.527) 6.798 66.738 ( 0.000 3.661 -11.771) 12.327 67.543 ( -0.000 -1.274 6.078) 6.210 68.003 ( 0.000 28.281 -15.761) 32.376 ======================= Grid point 151 (58/216) ======================= q-point: ( 0.36 0.18 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.653 ( -15.094 18.981 20.515) 31.764 1.677 ( -15.477 16.876 21.421) 31.356 2.411 ( -8.246 13.829 10.583) 19.268 2.631 ( -17.920 31.437 26.213) 44.682 2.862 ( -6.701 19.179 19.682) 28.286 3.733 ( -15.626 7.765 -15.163) 23.117 4.605 ( 6.879 7.948 -6.569) 12.395 4.752 ( 5.270 -0.963 -7.738) 9.411 4.957 ( 6.740 0.689 -0.685) 6.810 5.098 ( -3.979 -5.309 9.287) 11.413 5.316 ( -1.202 -1.351 -0.139) 1.814 5.493 ( -5.911 -2.737 -0.291) 6.520 5.582 ( 0.310 -0.643 -3.348) 3.423 5.848 ( 16.840 3.587 -1.453) 17.279 5.926 ( -2.360 -4.092 1.491) 4.954 6.106 ( 12.396 -3.532 -3.479) 13.351 6.189 ( 0.804 6.758 -7.842) 10.383 6.386 ( -0.681 4.519 -5.079) 6.832 6.574 ( 0.134 -6.220 -2.193) 6.596 6.796 ( 4.240 -5.929 0.523) 7.308 7.076 ( -19.415 -6.225 -1.267) 20.428 7.361 ( -6.036 -1.253 -9.624) 11.429 7.809 ( 1.173 -11.226 8.767) 14.292 7.893 ( 0.248 -2.860 9.135) 9.576 8.804 ( 6.017 -9.331 -4.510) 11.984 9.075 ( 1.065 3.040 -9.275) 9.818 18.915 ( 0.369 2.199 0.327) 2.254 18.960 ( -0.061 0.450 1.186) 1.270 18.993 ( -1.110 3.532 -0.694) 3.767 19.120 ( 0.855 -1.078 -0.504) 1.465 19.396 ( 0.457 0.183 0.420) 0.647 19.471 ( 0.317 -0.588 -0.662) 0.940 19.503 ( 0.946 -2.206 0.138) 2.404 19.559 ( -0.437 -1.130 -0.307) 1.250 42.419 ( -1.409 0.215 0.199) 1.439 42.450 ( -2.597 1.400 -0.109) 2.953 42.591 ( 3.863 -1.795 0.249) 4.267 42.649 ( 0.005 0.772 -0.711) 1.050 65.723 ( -1.621 6.454 5.013) 8.331 66.709 ( -3.309 4.712 -12.468) 13.734 67.537 ( 3.348 -4.957 3.556) 6.959 68.284 ( -22.647 14.200 -14.851) 30.579 ======================= Grid point 152 (59/216) ======================= q-point: ( 0.45 0.18 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.137 ( -11.019 11.557 21.450) 26.741 2.179 ( -9.801 18.191 13.126) 24.480 2.747 ( -8.267 7.402 15.374) 18.961 3.158 ( -5.748 18.692 11.726) 22.801 3.421 ( -18.124 21.244 11.216) 30.093 3.999 ( -18.459 8.261 -8.407) 21.901 4.423 ( 12.560 0.839 -4.810) 13.476 4.617 ( 6.258 1.872 -3.476) 7.399 4.878 ( 1.890 5.168 -2.399) 6.003 5.059 ( 0.671 -13.209 -5.499) 14.324 5.357 ( 1.505 0.720 0.915) 1.903 5.466 ( -1.014 -6.750 0.518) 6.845 5.568 ( 1.917 -1.865 -1.922) 3.294 5.785 ( 9.994 -5.926 -1.687) 11.741 5.840 ( 2.041 17.881 7.664) 19.561 6.034 ( -6.440 2.163 0.153) 6.795 6.131 ( 2.850 1.298 -5.863) 6.647 6.434 ( -3.479 7.200 -3.561) 8.753 6.527 ( -2.891 -3.186 -3.888) 5.798 6.667 ( 5.870 -2.023 -1.082) 6.302 7.234 ( -8.025 -1.597 -3.992) 9.104 7.373 ( -9.370 -10.619 -3.509) 14.590 7.766 ( 0.467 -11.663 6.456) 13.339 7.937 ( 0.574 -2.952 8.768) 9.269 8.532 ( 10.533 -11.544 -8.692) 17.882 8.963 ( 4.468 -2.883 -6.282) 8.230 18.925 ( 0.825 2.164 0.145) 2.320 18.976 ( -0.212 0.380 1.259) 1.332 19.034 ( -0.769 2.139 -0.032) 2.273 19.110 ( -0.514 1.796 -0.777) 2.023 19.393 ( 0.410 0.184 0.234) 0.507 19.450 ( 1.060 -2.046 -0.437) 2.346 19.460 ( 1.230 -2.154 -0.329) 2.502 19.559 ( -0.794 -0.908 -0.162) 1.217 42.455 ( -2.578 -0.404 0.384) 2.638 42.505 ( -2.499 1.397 -0.113) 2.865 42.512 ( 4.064 -1.353 0.402) 4.302 42.646 ( 0.852 2.121 -1.537) 2.754 65.845 ( -1.971 6.057 4.342) 7.709 66.714 ( -3.393 8.555 -11.597) 14.805 67.440 ( 3.668 -10.302 2.205) 11.155 68.594 ( -19.459 5.858 -9.684) 22.511 ======================= Grid point 153 (60/216) ======================= q-point: ( 0.55 0.18 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.478 ( -0.294 19.818 9.668) 22.053 2.572 ( -12.591 8.271 14.545) 20.940 2.988 ( 0.824 3.641 17.997) 18.380 3.346 ( -0.669 1.248 0.569) 1.526 3.774 ( -0.899 10.544 -2.526) 10.880 4.029 ( 11.835 7.889 -1.149) 14.269 4.272 ( 5.133 3.615 -5.672) 8.461 4.640 ( -1.391 2.785 9.342) 9.847 4.851 ( 11.938 4.377 -10.090) 16.232 4.965 ( -13.268 -12.368 -7.345) 19.569 5.140 ( 8.386 -5.535 3.192) 10.543 5.411 ( 3.402 4.246 -3.625) 6.538 5.601 ( -0.555 0.388 3.641) 3.703 5.748 ( -6.119 -3.898 -0.681) 7.287 5.970 ( -1.143 2.629 -4.300) 5.168 6.099 ( -2.397 10.151 1.451) 10.531 6.229 ( -8.477 4.201 6.740) 11.616 6.502 ( -2.944 -5.400 -3.058) 6.869 6.595 ( -12.758 5.418 -2.753) 14.132 6.638 ( 2.123 13.151 1.412) 13.396 7.261 ( -2.431 -3.384 -0.730) 4.231 7.412 ( -9.067 -9.299 -3.222) 13.381 7.678 ( 2.894 -14.994 2.273) 15.439 7.959 ( 1.661 -3.803 6.961) 8.104 8.189 ( 10.145 -10.448 -9.664) 17.478 8.810 ( 5.459 -4.246 -3.735) 7.860 18.929 ( 0.936 2.053 0.046) 2.257 18.991 ( -0.092 0.249 1.096) 1.128 19.043 ( 0.255 0.019 0.062) 0.263 19.158 ( -2.159 4.978 -0.618) 5.461 19.384 ( 1.517 -3.048 -0.092) 3.406 19.393 ( 1.111 -1.499 0.132) 1.871 19.439 ( 0.273 -0.478 -0.684) 0.878 19.563 ( -0.820 -0.911 -0.085) 1.229 42.438 ( 2.445 -0.570 0.259) 2.524 42.515 ( -3.302 -0.530 0.654) 3.408 42.541 ( -0.532 0.981 -0.145) 1.126 42.634 ( 1.350 2.364 -1.665) 3.192 65.940 ( -0.850 4.441 2.573) 5.202 66.781 ( -4.718 13.492 -9.236) 17.017 67.296 ( 3.101 -15.952 1.903) 16.362 68.828 ( -13.778 2.982 -4.296) 14.737 ======================= Grid point 154 (61/216) ======================= q-point: ( 0.64 0.18 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.675 ( 3.746 19.247 5.967) 20.496 2.831 ( 2.393 3.346 6.272) 7.500 3.118 ( 2.738 5.098 13.883) 15.041 3.268 ( 4.025 -4.708 -1.511) 6.376 3.579 ( 11.944 -2.156 -5.523) 13.335 3.947 ( 10.911 5.920 1.254) 12.477 4.231 ( 11.037 5.158 -2.994) 12.546 4.403 ( 8.101 -6.314 -10.607) 14.765 4.849 ( -5.211 1.518 4.135) 6.823 4.982 ( -5.555 -11.800 -4.195) 13.700 5.215 ( -5.140 5.058 9.181) 11.675 5.435 ( -2.033 11.567 -1.326) 11.819 5.529 ( 4.761 -10.047 0.377) 11.124 5.833 ( -3.966 5.414 -1.086) 6.799 5.989 ( -6.581 -0.654 -6.881) 9.544 6.212 ( 2.748 10.749 0.264) 11.098 6.390 ( -1.990 -2.628 2.736) 4.284 6.533 ( -6.578 -0.339 5.822) 8.791 6.757 ( -2.505 12.385 0.826) 12.662 6.875 ( -8.509 3.596 0.566) 9.255 7.299 ( -6.260 -5.078 4.227) 9.102 7.432 ( -6.823 -10.916 -8.864) 15.630 7.484 ( -0.660 -3.501 -3.309) 4.862 7.905 ( 7.056 -7.971 4.558) 11.580 7.970 ( 1.172 -5.516 -3.813) 6.807 8.691 ( 3.426 -1.786 -1.287) 4.072 18.931 ( 0.949 1.929 0.026) 2.149 18.998 ( 0.325 -0.020 0.596) 0.679 19.039 ( 0.231 0.064 0.055) 0.246 19.235 ( -2.518 5.552 -0.278) 6.102 19.308 ( 2.510 -5.259 -0.002) 5.828 19.385 ( 0.220 -0.266 -0.144) 0.374 19.432 ( -0.150 -0.076 -0.321) 0.362 19.567 ( -0.738 -1.018 -0.029) 1.258 42.424 ( -0.306 0.868 0.177) 0.937 42.532 ( 2.102 0.396 -0.098) 2.141 42.565 ( -2.800 -0.845 0.480) 2.964 42.618 ( 1.158 1.303 -1.080) 2.050 65.988 ( 0.564 3.884 0.839) 4.013 66.924 ( -5.253 15.442 -5.630) 17.255 67.118 ( 1.777 -19.482 1.004) 19.589 69.005 ( -9.084 2.217 -0.450) 9.362 ======================= Grid point 155 (62/216) ======================= q-point: (-0.27 0.18 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.631 ( 20.384 -5.345 -2.185) 21.187 2.766 ( 8.413 13.643 3.128) 16.330 2.980 ( 19.425 6.478 -2.085) 20.582 3.261 ( 4.720 -2.755 5.129) 7.495 3.576 ( -9.466 6.463 2.115) 11.656 3.840 ( 5.691 -5.874 -0.719) 8.210 3.957 ( 3.429 -1.600 -3.175) 4.939 4.383 ( -8.704 -5.304 -4.858) 11.291 4.731 ( 11.607 -7.341 -3.768) 14.241 5.053 ( -8.405 -5.585 4.926) 11.229 5.339 ( 1.259 -9.201 -2.584) 9.639 5.471 ( -1.665 10.815 6.977) 12.977 5.626 ( -7.523 10.801 4.909) 14.048 5.880 ( 3.274 4.735 -1.673) 5.995 6.021 ( -4.055 -0.262 -5.657) 6.965 6.200 ( 7.560 7.687 -1.456) 10.879 6.398 ( -2.525 -2.923 1.591) 4.177 6.610 ( 5.331 -13.324 3.941) 14.882 6.761 ( 5.360 -2.604 1.596) 6.170 6.946 ( -2.627 15.865 -0.676) 16.095 7.243 ( -0.619 -7.397 -7.063) 10.246 7.438 ( -3.496 0.435 -0.849) 3.624 7.697 ( -1.198 -9.341 2.426) 9.725 7.856 ( -9.765 4.531 2.515) 11.055 7.929 ( -11.927 0.589 -1.834) 12.082 8.662 ( 0.132 1.779 0.376) 1.823 18.932 ( 0.979 1.834 0.032) 2.080 18.991 ( 0.718 -0.209 0.097) 0.754 19.039 ( 0.125 0.279 0.096) 0.320 19.224 ( 2.463 -5.591 0.044) 6.109 19.319 ( -2.499 5.337 -0.095) 5.894 19.379 ( 0.017 -0.408 -0.182) 0.447 19.436 ( -0.497 0.216 -0.023) 0.542 19.568 ( -0.613 -1.183 0.010) 1.333 42.458 ( -2.173 1.681 0.096) 2.749 42.489 ( 3.350 0.383 -0.058) 3.373 42.591 ( -1.144 -1.030 0.140) 1.546 42.603 ( 0.321 -0.693 -0.223) 0.796 66.006 ( 2.240 4.594 0.076) 5.111 66.899 ( 2.128 -19.854 1.800) 20.048 67.137 ( -7.258 13.750 -4.347) 16.144 69.142 ( -5.687 2.420 1.637) 6.394 ======================= Grid point 156 (63/216) ======================= q-point: (-0.18 0.18 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.182 ( 24.267 -9.297 -4.403) 26.357 2.637 ( 20.086 4.368 0.369) 20.559 2.748 ( 16.541 9.748 -1.678) 19.273 3.160 ( 10.792 -4.081 2.454) 11.796 3.612 ( -2.717 -4.048 -4.503) 6.637 3.959 ( -18.577 3.338 2.775) 19.077 4.062 ( -12.934 -4.346 2.523) 13.876 4.460 ( -8.387 -9.687 -4.860) 13.704 4.474 ( 6.782 1.860 0.250) 7.037 5.095 ( 0.617 -15.106 5.957) 16.250 5.257 ( -4.194 -0.549 -4.850) 6.435 5.564 ( 7.270 5.310 1.423) 9.115 5.761 ( 10.228 1.472 -1.294) 10.414 5.894 ( -5.800 7.193 6.835) 11.493 5.973 ( 7.694 -2.580 -2.103) 8.383 6.107 ( 4.106 2.024 -0.133) 4.580 6.323 ( 3.579 -11.638 -3.376) 12.635 6.485 ( -2.517 4.729 -0.127) 5.359 6.759 ( 3.104 3.069 3.160) 5.389 7.072 ( 8.769 1.832 0.914) 9.005 7.120 ( -0.996 6.204 -3.060) 6.989 7.512 ( -4.760 2.183 0.713) 5.285 7.615 ( -1.484 -6.601 -1.632) 6.960 7.834 ( 0.356 -4.905 -1.032) 5.025 8.446 ( -27.927 11.893 3.271) 30.529 8.705 ( -2.315 3.575 -0.206) 4.264 18.932 ( 1.025 1.837 0.030) 2.103 18.976 ( 0.882 -0.214 -0.064) 0.910 19.040 ( 0.130 0.294 0.030) 0.323 19.142 ( 2.162 -5.550 0.005) 5.956 19.376 ( -0.169 -0.388 -0.062) 0.427 19.397 ( -2.232 4.540 -0.014) 5.059 19.448 ( -0.695 0.486 0.059) 0.850 19.566 ( -0.487 -1.384 0.018) 1.467 42.446 ( 2.417 1.143 0.061) 2.674 42.510 ( -2.051 1.488 -0.051) 2.534 42.584 ( 0.858 -0.959 0.100) 1.291 42.594 ( -0.849 -2.876 0.070) 3.000 65.984 ( 5.824 3.833 -0.107) 6.973 66.743 ( -2.295 -18.525 0.982) 18.692 67.328 ( -5.974 12.871 -1.962) 14.325 69.250 ( -3.596 3.094 2.042) 5.165 ======================= Grid point 157 (64/216) ======================= q-point: (-0.09 0.18 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.699 ( 25.465 -8.860 -0.000) 26.962 2.323 ( 25.229 6.440 -0.000) 26.038 2.546 ( 15.415 2.496 -0.000) 15.616 2.855 ( 18.470 -15.502 -0.000) 24.113 3.748 ( -20.714 -3.234 0.000) 20.965 4.039 ( 19.081 4.203 -0.000) 19.539 4.317 ( -17.090 3.555 0.000) 17.456 4.417 ( -2.259 2.554 0.000) 3.409 4.716 ( -32.106 -7.600 0.000) 32.994 4.954 ( 3.458 -13.330 0.000) 13.771 5.275 ( 18.973 -18.739 -0.000) 26.667 5.301 ( -0.368 1.190 -0.000) 1.245 5.589 ( 8.821 -0.391 -0.000) 8.830 5.852 ( 5.156 12.830 -0.000) 13.828 6.075 ( -1.565 4.827 -0.000) 5.074 6.106 ( 0.920 2.161 -0.000) 2.348 6.228 ( -0.729 -4.137 0.000) 4.201 6.559 ( 0.947 8.853 -0.000) 8.903 6.754 ( -0.462 -1.916 0.000) 1.971 6.856 ( 13.086 -3.370 -0.000) 13.513 7.224 ( -2.678 7.473 0.000) 7.938 7.590 ( -0.714 -2.952 0.000) 3.037 7.623 ( -4.842 3.766 0.000) 6.134 7.785 ( 0.794 -3.211 0.000) 3.307 8.776 ( -3.546 3.655 0.000) 5.092 8.957 ( -23.601 9.693 0.000) 25.514 18.932 ( 1.049 2.036 -0.000) 2.291 18.961 ( 0.895 -0.164 -0.000) 0.910 19.040 ( 0.091 0.255 -0.000) 0.271 19.068 ( 1.697 -5.222 0.000) 5.491 19.376 ( -0.230 -0.293 0.000) 0.373 19.453 ( -1.302 1.232 0.000) 1.792 19.473 ( -1.188 2.870 0.000) 3.106 19.561 ( -0.456 -1.560 0.000) 1.625 42.444 ( -0.430 2.283 -0.000) 2.323 42.534 ( 0.201 0.424 -0.000) 0.469 42.554 ( 2.224 -0.136 -0.000) 2.228 42.583 ( -1.904 -4.615 0.000) 4.993 65.881 ( 9.227 0.413 -0.000) 9.236 66.697 ( -6.835 -11.160 0.000) 13.087 67.492 ( -4.039 9.582 0.000) 10.398 69.335 ( -2.418 3.612 0.000) 4.347 ======================= Grid point 160 (65/216) ======================= q-point: ( 0.18 0.27 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.482 ( 15.542 0.000 25.466) 29.834 1.750 ( 31.196 0.000 14.581) 34.436 2.209 ( 16.352 0.000 17.801) 24.172 2.471 ( 6.589 0.000 18.971) 20.082 2.800 ( 51.705 0.000 11.059) 52.874 4.083 ( 22.793 -0.000 -13.259) 26.369 4.538 ( -6.284 -0.000 -6.042) 8.717 4.571 ( -14.948 -0.000 -1.025) 14.983 4.767 ( -8.472 -0.000 -1.261) 8.566 5.105 ( -11.120 0.000 16.427) 19.836 5.243 ( 12.375 0.000 10.479) 16.216 5.446 ( -2.981 -0.000 -6.125) 6.812 5.772 ( 1.930 -0.000 -5.746) 6.061 5.772 ( -23.702 -0.000 -5.213) 24.268 6.027 ( -0.335 -0.000 -0.855) 0.918 6.049 ( 4.021 -0.000 -7.594) 8.593 6.062 ( -1.385 -0.000 -7.861) 7.982 6.363 ( 4.790 -0.000 -4.407) 6.509 6.673 ( -0.619 -0.000 -2.083) 2.173 6.748 ( -7.165 -0.000 -1.037) 7.240 7.338 ( 6.067 -0.000 -5.610) 8.264 7.535 ( -2.751 0.000 4.596) 5.356 7.876 ( 2.875 0.000 5.563) 6.262 7.931 ( -2.481 0.000 6.572) 7.024 8.913 ( -5.227 -0.000 -2.312) 5.715 9.097 ( 1.972 -0.000 -18.841) 18.944 18.920 ( 1.840 -0.000 -0.714) 1.973 18.938 ( 0.591 -0.000 -0.158) 0.612 18.953 ( 0.491 0.000 1.005) 1.119 19.104 ( -2.141 0.000 1.060) 2.389 19.381 ( -0.315 0.000 0.363) 0.481 19.475 ( -0.610 -0.000 -0.474) 0.773 19.530 ( -0.059 0.000 0.103) 0.119 19.564 ( -0.944 -0.000 -0.257) 0.978 42.466 ( 3.520 0.000 0.130) 3.522 42.469 ( 2.887 0.000 0.119) 2.890 42.563 ( -3.879 -0.000 -0.041) 3.880 42.584 ( -3.478 -0.000 -0.806) 3.570 65.665 ( 5.672 0.000 3.812) 6.834 66.708 ( -4.100 -0.000 -8.336) 9.289 67.702 ( 1.164 0.000 3.095) 3.306 68.668 ( 29.564 -0.000 -26.564) 39.745 ======================= Grid point 162 (66/216) ======================= q-point: ( 0.36 0.27 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.463 ( -0.000 18.865 23.660) 30.260 1.578 ( -0.000 19.935 22.470) 30.038 2.279 ( 0.000 15.281 5.522) 16.248 2.586 ( -0.000 13.168 42.376) 44.375 2.889 ( -0.000 12.803 25.169) 28.238 3.399 ( 0.000 6.901 -18.562) 19.803 4.504 ( 0.000 8.293 -9.819) 12.852 4.765 ( 0.000 -5.355 -6.896) 8.731 5.071 ( -0.000 0.071 4.807) 4.808 5.107 ( -0.000 -0.749 4.562) 4.623 5.293 ( 0.000 -3.220 -4.042) 5.167 5.446 ( -0.000 3.885 4.775) 6.155 5.560 ( 0.000 -1.926 -12.709) 12.854 5.894 ( 0.000 -4.409 -7.827) 8.983 5.945 ( 0.000 9.231 -4.839) 10.422 6.106 ( 0.000 6.179 -2.003) 6.495 6.211 ( 0.000 -3.877 -4.103) 5.645 6.325 ( 0.000 -2.033 -8.621) 8.857 6.751 ( -0.000 -13.232 5.373) 14.282 6.780 ( -0.000 -2.935 -0.318) 2.952 6.952 ( -0.000 -4.138 2.233) 4.702 7.168 ( 0.000 6.538 -11.195) 12.964 7.975 ( -0.000 -0.688 8.150) 8.179 8.004 ( -0.000 -11.028 8.591) 13.979 8.907 ( -0.000 -7.238 -2.192) 7.563 8.963 ( 0.000 6.577 -5.180) 8.372 18.902 ( 0.000 1.959 0.472) 2.015 18.950 ( 0.000 2.775 -0.676) 2.856 18.969 ( -0.000 0.237 1.585) 1.603 19.131 ( 0.000 -1.301 -1.558) 2.029 19.406 ( -0.000 -0.281 0.731) 0.783 19.472 ( 0.000 -0.463 -0.688) 0.829 19.525 ( -0.000 -1.127 0.297) 1.165 19.562 ( -0.000 -1.096 -0.470) 1.192 42.406 ( 0.000 0.680 0.111) 0.689 42.418 ( 0.000 0.635 -0.155) 0.654 42.636 ( -0.000 -0.614 0.266) 0.669 42.652 ( -0.000 -1.045 -0.078) 1.048 65.710 ( -0.000 4.798 6.422) 8.016 66.539 ( 0.000 3.144 -12.433) 12.824 67.631 ( -0.000 -0.335 4.646) 4.658 67.843 ( 0.000 15.313 -5.613) 16.310 ======================= Grid point 163 (67/216) ======================= q-point: ( 0.45 0.27 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.974 ( -14.779 17.910 20.124) 30.727 2.024 ( -12.004 14.740 19.343) 27.120 2.553 ( -11.314 17.920 7.345) 22.429 3.090 ( -5.029 13.875 24.451) 28.560 3.199 ( -5.184 14.879 20.078) 25.522 3.508 ( -20.408 11.542 -7.780) 24.703 4.472 ( 3.890 10.215 -9.981) 14.802 4.595 ( 1.499 -10.291 -11.440) 15.460 4.942 ( 9.323 -0.560 -1.062) 9.400 5.221 ( 5.584 -4.391 2.529) 7.541 5.280 ( -7.255 0.787 -1.748) 7.504 5.449 ( -5.304 -2.189 -1.469) 5.923 5.565 ( 1.591 2.598 -2.411) 3.885 5.817 ( -0.394 6.606 -1.020) 6.696 5.930 ( 3.664 5.309 -1.403) 6.601 6.041 ( 11.229 -2.331 -4.431) 12.295 6.096 ( 3.457 0.715 -2.837) 4.529 6.306 ( -4.043 5.036 -4.511) 7.878 6.557 ( 6.073 -5.629 0.151) 8.282 6.786 ( 5.911 -4.861 -1.691) 7.837 7.063 ( -14.681 -5.541 -0.321) 15.696 7.208 ( -12.250 -4.286 -8.514) 15.521 7.943 ( 3.487 -8.851 7.350) 12.022 8.039 ( -0.137 -2.959 8.270) 8.784 8.729 ( 9.577 -9.749 -4.375) 14.349 8.957 ( 0.451 0.625 -5.509) 5.562 18.920 ( 0.640 2.258 0.325) 2.369 18.977 ( -0.566 2.271 0.227) 2.351 18.990 ( -0.816 1.670 0.902) 2.066 19.104 ( 0.427 -0.815 -1.298) 1.590 19.404 ( 0.485 -0.288 0.635) 0.849 19.459 ( 0.311 -0.694 -0.817) 1.116 19.505 ( 1.149 -2.275 0.161) 2.554 19.554 ( -0.639 -1.064 -0.319) 1.282 42.423 ( -1.570 0.319 0.195) 1.614 42.448 ( -2.623 1.362 -0.103) 2.957 42.595 ( 3.832 -1.639 0.230) 4.174 42.640 ( 0.836 0.387 -0.380) 0.996 65.818 ( -0.934 5.710 6.665) 8.826 66.502 ( -3.586 4.852 -12.630) 13.997 67.585 ( 5.118 -4.324 2.287) 7.080 68.117 ( -20.910 11.917 -6.490) 24.928 ======================= Grid point 164 (68/216) ======================= q-point: ( 0.55 0.27 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.371 ( -2.675 18.673 10.431) 21.556 2.462 ( -11.793 8.149 17.760) 22.823 3.000 ( -14.635 10.468 14.794) 23.294 3.261 ( -2.083 7.423 -1.363) 7.829 3.602 ( -6.971 13.497 11.267) 18.913 3.950 ( -14.324 9.417 2.573) 17.334 4.355 ( 7.128 -1.235 -3.575) 8.070 4.515 ( -9.774 4.794 -7.533) 13.238 4.824 ( 4.833 3.878 -5.195) 8.086 4.977 ( 12.832 -4.116 -3.302) 13.874 5.360 ( 0.625 -3.948 0.232) 4.004 5.461 ( 2.607 -3.136 -1.249) 4.265 5.576 ( 0.144 0.214 2.276) 2.291 5.747 ( 3.326 -5.020 -1.954) 6.332 5.921 ( 2.909 6.888 -5.014) 9.003 6.001 ( -0.426 10.145 3.987) 10.909 6.094 ( -7.388 2.848 -0.560) 7.938 6.395 ( -2.786 7.357 -1.268) 7.968 6.468 ( -1.807 -3.453 -2.996) 4.916 6.652 ( 6.403 2.952 -0.735) 7.089 7.182 ( -8.095 -3.953 -2.389) 9.320 7.295 ( -14.397 -12.717 -5.261) 19.916 7.877 ( 2.965 -9.442 6.729) 11.967 8.069 ( 0.804 -4.294 6.781) 8.067 8.400 ( 14.445 -11.346 -7.002) 19.657 8.872 ( 3.617 -2.417 -4.817) 6.490 18.927 ( 0.962 2.170 0.099) 2.376 18.998 ( -0.082 0.439 1.380) 1.451 19.033 ( -0.853 2.398 -0.062) 2.545 19.095 ( -0.803 1.706 -1.049) 2.158 19.399 ( 0.481 -0.330 0.453) 0.738 19.440 ( 0.444 -0.909 -0.747) 1.257 19.457 ( 1.840 -3.292 -0.067) 3.772 19.557 ( -0.889 -0.896 -0.128) 1.269 42.461 ( -2.534 -0.315 0.331) 2.575 42.503 ( -2.653 1.386 -0.099) 2.995 42.518 ( 4.010 -1.222 0.320) 4.205 42.625 ( 1.469 1.779 -0.959) 2.499 65.924 ( -0.452 4.433 5.207) 6.853 66.529 ( -5.214 9.094 -10.594) 14.904 67.471 ( 3.515 -10.774 1.507) 11.433 68.477 ( -19.909 8.408 -4.948) 22.171 ======================= Grid point 165 (69/216) ======================= q-point: ( 0.64 0.27 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.598 ( 1.745 20.390 5.440) 21.176 2.802 ( -9.082 4.174 12.438) 15.956 3.233 ( 4.477 7.082 2.878) 8.859 3.344 ( -2.773 -3.612 8.325) 9.489 3.704 ( 7.948 2.139 -5.794) 10.065 4.055 ( -1.753 8.894 -0.579) 9.083 4.208 ( 13.724 1.171 2.040) 13.924 4.668 ( 10.026 3.710 -11.751) 15.886 4.765 ( 1.016 2.143 5.296) 5.803 4.868 ( -11.772 -5.116 -4.273) 13.528 5.234 ( 3.989 -0.237 7.453) 8.457 5.357 ( 3.983 4.437 -2.664) 6.531 5.649 ( -2.397 2.426 2.354) 4.144 5.742 ( -2.898 -8.631 -0.004) 9.104 5.847 ( -3.090 -1.554 -8.958) 9.603 6.134 ( -0.799 11.914 1.755) 12.069 6.314 ( -10.319 5.753 3.102) 12.215 6.459 ( -5.298 -4.571 -1.886) 7.247 6.562 ( -14.894 6.134 -1.273) 16.158 6.686 ( 4.410 18.956 4.073) 19.884 7.240 ( -8.076 -6.163 -1.777) 10.313 7.344 ( -10.040 -11.300 -4.149) 15.675 7.733 ( 10.826 -19.081 4.134) 22.324 8.005 ( 2.639 -7.025 -4.203) 8.601 8.106 ( 7.917 -4.556 2.080) 9.368 8.751 ( 4.423 -2.303 -3.130) 5.887 18.930 ( 0.969 2.058 0.024) 2.275 19.009 ( 0.267 0.028 1.032) 1.066 19.041 ( 0.241 0.302 -0.328) 0.507 19.149 ( -2.446 5.094 -0.395) 5.665 19.383 ( 1.605 -3.388 -0.038) 3.749 19.396 ( 1.114 -1.645 0.200) 1.996 19.429 ( 0.059 -0.311 -0.537) 0.623 19.562 ( -0.865 -0.910 -0.050) 1.256 42.442 ( 2.541 -0.405 0.175) 2.579 42.525 ( -3.257 -0.442 0.455) 3.318 42.539 ( -0.632 0.802 -0.117) 1.028 42.612 ( 1.364 2.288 -0.942) 2.826 65.981 ( 0.704 2.880 2.205) 3.695 66.651 ( -7.191 13.508 -6.156) 16.495 67.321 ( 2.754 -16.581 1.122) 16.845 68.776 ( -14.864 5.973 -2.041) 16.149 ======================= Grid point 166 (70/216) ======================= q-point: ( 0.73 0.27 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.750 ( 5.500 21.012 2.751) 21.894 2.918 ( 8.021 -3.126 3.590) 9.328 3.158 ( 9.922 4.555 -2.838) 11.280 3.381 ( 2.200 -2.342 9.559) 10.084 3.497 ( 5.729 0.127 -4.755) 7.447 3.995 ( 13.994 4.550 3.362) 15.095 4.169 ( 7.409 -2.448 -3.590) 8.589 4.261 ( 8.159 -4.155 -5.475) 10.668 4.888 ( -1.838 -1.689 1.269) 2.801 4.921 ( -7.939 -4.449 -2.486) 9.433 5.360 ( -0.762 12.401 4.702) 13.284 5.446 ( -7.730 8.291 3.780) 11.949 5.529 ( 3.647 -14.840 -0.787) 15.302 5.820 ( -2.888 7.474 -0.417) 8.023 5.870 ( -7.552 -1.792 -5.939) 9.773 6.208 ( 4.008 10.365 -0.294) 11.116 6.396 ( -2.094 -3.550 -0.397) 4.140 6.632 ( -10.996 4.254 3.607) 12.329 6.802 ( 4.422 17.562 4.011) 18.549 6.872 ( -10.375 1.299 -0.876) 10.492 7.280 ( -0.755 -21.558 -6.412) 22.504 7.359 ( -7.113 -2.879 1.865) 7.897 7.455 ( -7.046 -2.296 -0.892) 7.464 7.925 ( -0.028 -5.018 -1.256) 5.173 7.963 ( 7.938 -8.522 1.863) 11.794 8.672 ( 2.489 0.459 -0.753) 2.640 18.932 ( 0.948 1.939 0.010) 2.158 19.005 ( 0.692 -0.259 0.277) 0.789 19.039 ( 0.162 0.365 -0.031) 0.401 19.232 ( -2.653 5.605 -0.102) 6.202 19.308 ( 2.489 -5.259 -0.002) 5.818 19.384 ( 0.230 -0.582 -0.051) 0.628 19.428 ( -0.335 0.069 -0.126) 0.365 19.567 ( -0.765 -1.008 -0.010) 1.265 42.426 ( -0.197 0.948 0.070) 0.971 42.531 ( 2.015 0.307 -0.037) 2.038 42.571 ( -2.678 -0.884 0.232) 2.830 42.605 ( 0.820 1.411 -0.437) 1.689 65.999 ( 1.266 3.334 0.382) 3.587 66.858 ( -8.086 15.132 -2.210) 17.299 67.130 ( 2.715 -20.496 0.427) 20.680 69.000 ( -9.897 4.351 -0.117) 10.812 ======================= Grid point 167 (71/216) ======================= q-point: (-0.18 0.27 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.608 ( 22.266 -8.669 -0.000) 23.894 2.795 ( 10.313 14.839 -0.000) 18.071 2.964 ( 20.379 8.210 -0.000) 21.971 3.316 ( 5.940 -1.287 -0.000) 6.078 3.573 ( -6.339 4.036 0.000) 7.515 3.829 ( 8.694 -5.908 -0.000) 10.512 3.958 ( -4.809 -1.023 0.000) 4.917 4.324 ( -10.794 -8.647 0.000) 13.830 4.703 ( 12.349 -6.349 -0.000) 13.885 5.100 ( -9.667 1.755 0.000) 9.825 5.311 ( 3.049 -17.740 0.000) 18.000 5.523 ( 0.486 15.668 -0.000) 15.675 5.707 ( -10.742 8.826 0.000) 13.902 5.865 ( 4.703 5.768 -0.000) 7.442 5.940 ( -5.776 -0.460 0.000) 5.794 6.188 ( 7.777 7.436 -0.000) 10.760 6.410 ( -3.287 -0.776 0.000) 3.377 6.650 ( 13.902 -24.368 -0.000) 28.054 6.777 ( 1.566 6.499 -0.000) 6.685 6.941 ( -2.848 15.701 -0.000) 15.958 7.177 ( -2.352 -6.299 0.000) 6.724 7.430 ( -4.411 0.454 0.000) 4.434 7.722 ( 1.235 -12.398 0.000) 12.459 7.879 ( 0.088 -5.602 0.000) 5.602 7.909 ( -24.863 11.576 0.000) 27.426 8.665 ( 0.247 2.891 -0.000) 2.902 18.933 ( 0.974 1.843 -0.000) 2.085 18.992 ( 0.850 -0.262 -0.000) 0.889 19.039 ( 0.166 0.360 -0.000) 0.397 19.225 ( 2.451 -5.604 -0.000) 6.116 19.318 ( -2.546 5.359 0.000) 5.933 19.377 ( -0.032 -0.501 0.000) 0.502 19.436 ( -0.572 0.251 0.000) 0.625 19.568 ( -0.624 -1.174 0.000) 1.330 42.459 ( -2.247 1.705 0.000) 2.820 42.488 ( 3.440 0.362 -0.000) 3.459 42.592 ( -0.960 -1.057 0.000) 1.428 42.602 ( -0.059 -0.635 0.000) 0.638 66.007 ( 2.395 4.539 -0.000) 5.132 66.917 ( 1.697 -21.786 0.000) 21.852 67.098 ( -7.680 14.726 0.000) 16.609 69.155 ( -6.185 3.494 0.000) 7.103 ======================= Grid point 171 (72/216) ======================= q-point: ( 0.18 0.36 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.915 ( 14.713 -2.845 19.453) 24.556 2.233 ( 21.412 5.975 11.846) 25.189 2.630 ( 13.953 -14.654 12.415) 23.739 2.736 ( 7.637 -1.574 17.566) 19.219 3.632 ( 38.835 0.344 9.378) 39.953 4.155 ( -16.248 2.625 -4.717) 17.122 4.208 ( -11.183 0.173 -6.191) 12.784 4.501 ( 3.760 -0.253 -5.257) 6.468 4.673 ( -2.584 -4.800 -6.025) 8.125 5.184 ( -3.040 -6.366 12.852) 14.661 5.256 ( -22.709 -4.970 1.938) 23.328 5.409 ( -5.709 -1.321 -2.466) 6.357 5.546 ( 14.115 4.150 6.821) 16.217 5.647 ( -3.949 1.923 -10.061) 10.978 5.975 ( 5.481 7.731 -4.224) 10.376 6.040 ( -1.463 -0.609 0.213) 1.599 6.157 ( 10.925 -4.400 -7.169) 13.788 6.424 ( 5.972 -2.515 -4.694) 8.002 6.601 ( -4.239 3.379 -3.685) 6.555 6.676 ( 1.309 -1.971 -3.636) 4.338 7.393 ( 4.854 2.581 -1.513) 5.702 7.524 ( -3.253 0.054 6.522) 7.288 7.920 ( -2.429 2.600 3.735) 5.158 7.938 ( -0.982 1.625 7.413) 7.652 8.751 ( -7.046 8.730 -7.108) 13.281 8.927 ( -7.364 -3.320 -13.101) 15.391 18.926 ( 1.196 1.981 -0.238) 2.326 18.965 ( 0.776 -0.782 0.548) 1.230 18.978 ( 1.266 -2.792 0.080) 3.067 19.085 ( -1.200 -0.158 0.344) 1.258 19.380 ( -0.172 -0.106 0.392) 0.441 19.459 ( -0.710 0.137 -0.564) 0.917 19.514 ( -0.868 2.589 -0.041) 2.731 19.554 ( -0.665 -1.425 -0.136) 1.579 42.485 ( -2.922 2.286 -0.303) 3.723 42.512 ( 2.150 -0.284 0.147) 2.173 42.523 ( 1.756 -0.542 0.114) 1.841 42.552 ( -1.222 -2.668 -0.800) 3.042 65.803 ( 7.344 -0.745 3.696) 8.255 66.587 ( -4.633 -4.131 -7.687) 9.880 67.726 ( 1.312 7.558 5.513) 9.447 68.835 ( 15.063 -3.294 -18.001) 23.702 ======================= Grid point 172 (73/216) ======================= q-point: ( 0.27 0.36 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.857 ( 13.756 0.000 20.850) 24.979 2.001 ( 25.073 0.000 15.466) 29.459 2.479 ( 14.164 0.000 13.791) 19.769 2.806 ( 3.206 0.000 21.053) 21.296 3.113 ( 41.637 0.000 27.232) 49.752 3.850 ( 24.319 -0.000 -14.682) 28.407 4.404 ( -1.129 -0.000 -9.695) 9.760 4.569 ( -17.965 -0.000 0.077) 17.965 4.740 ( -11.853 -0.000 -2.233) 12.062 5.321 ( -0.920 -0.000 -9.055) 9.102 5.367 ( -7.385 0.000 15.048) 16.763 5.418 ( 12.979 0.000 9.736) 16.225 5.659 ( -12.693 -0.000 -8.519) 15.287 5.664 ( -3.420 -0.000 -7.048) 7.834 5.892 ( -4.091 -0.000 -8.883) 9.780 5.924 ( 3.586 -0.000 -7.373) 8.199 6.051 ( 0.021 0.000 0.964) 0.964 6.292 ( 3.591 -0.000 -4.445) 5.714 6.626 ( -0.447 -0.000 -3.393) 3.422 6.713 ( -9.722 -0.000 -3.313) 10.270 7.282 ( 8.046 -0.000 -0.976) 8.105 7.590 ( 5.357 0.000 1.615) 5.595 7.959 ( 3.252 0.000 4.480) 5.536 8.021 ( -4.259 0.000 4.369) 6.101 8.844 ( -2.844 -0.000 -11.529) 11.875 8.869 ( -6.129 -0.000 -3.077) 6.858 18.914 ( 1.537 -0.000 -0.115) 1.541 18.935 ( 0.666 -0.000 -0.253) 0.713 18.973 ( 0.339 0.000 1.448) 1.487 19.108 ( -1.594 -0.000 -0.579) 1.696 19.390 ( -0.595 0.000 0.806) 1.002 19.465 ( -0.621 -0.000 -0.675) 0.917 19.532 ( -0.163 0.000 0.174) 0.238 19.559 ( -0.839 -0.000 -0.353) 0.911 42.469 ( 3.523 0.000 0.172) 3.527 42.471 ( 3.127 0.000 0.145) 3.130 42.562 ( -4.120 -0.000 -0.057) 4.120 42.574 ( -3.981 -0.000 -0.530) 4.016 65.743 ( 4.778 0.000 5.790) 7.507 66.546 ( -1.543 -0.000 -11.225) 11.331 67.761 ( 3.544 0.000 4.113) 5.430 68.326 ( 27.771 -0.000 -15.756) 31.929 ======================= Grid point 174 (74/216) ======================= q-point: ( 0.45 0.36 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.856 ( -0.000 14.322 24.161) 28.087 1.915 ( -0.000 18.652 18.409) 26.206 2.352 ( 0.000 16.517 3.130) 16.811 3.058 ( 0.000 6.359 -18.690) 19.742 3.275 ( -0.000 4.486 37.361) 37.629 3.307 ( -0.000 11.306 25.482) 27.878 4.311 ( 0.000 8.802 -14.037) 16.569 4.622 ( -0.000 -15.132 -11.244) 18.852 5.058 ( 0.000 2.211 -7.062) 7.400 5.167 ( -0.000 -1.374 5.750) 5.912 5.257 ( 0.000 8.962 -16.777) 19.020 5.350 ( -0.000 -0.803 7.967) 8.007 5.552 ( 0.000 7.451 3.131) 8.082 5.716 ( 0.000 -3.729 -12.435) 12.982 5.933 ( 0.000 4.583 2.442) 5.193 6.089 ( 0.000 4.100 -1.466) 4.355 6.149 ( 0.000 -0.893 -3.050) 3.178 6.196 ( 0.000 -1.339 -6.887) 7.016 6.776 ( -0.000 -2.732 0.039) 2.732 6.817 ( -0.000 -8.908 2.525) 9.259 6.973 ( -0.000 -5.587 0.450) 5.605 7.017 ( 0.000 1.745 -6.956) 7.172 8.094 ( -0.000 -0.408 6.102) 6.116 8.119 ( -0.000 -7.819 5.363) 9.481 8.875 ( -0.000 -7.405 -1.673) 7.592 8.899 ( 0.000 1.064 -2.930) 3.117 18.911 ( 0.000 2.012 0.545) 2.085 18.940 ( 0.000 2.427 -0.608) 2.502 18.998 ( -0.000 0.145 1.945) 1.951 19.101 ( 0.000 -0.670 -1.990) 2.100 19.418 ( -0.000 -0.519 0.820) 0.971 19.460 ( 0.000 -0.568 -0.810) 0.989 19.530 ( -0.000 -1.118 0.394) 1.186 19.554 ( -0.000 -1.098 -0.526) 1.217 42.408 ( 0.000 0.707 0.135) 0.720 42.415 ( 0.000 0.674 -0.168) 0.694 42.640 ( -0.000 -0.661 0.270) 0.714 42.650 ( -0.000 -0.969 -0.112) 0.975 65.830 ( -0.000 4.270 8.210) 9.254 66.338 ( 0.000 3.053 -12.106) 12.485 67.694 ( -0.000 0.615 3.045) 3.107 67.784 ( 0.000 8.100 -2.221) 8.399 ======================= Grid point 175 (75/216) ======================= q-point: ( 0.55 0.36 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.267 ( -4.307 17.251 12.757) 21.884 2.324 ( -15.087 11.403 19.375) 27.074 2.648 ( -15.964 21.968 4.072) 27.460 3.058 ( -9.516 9.606 -16.514) 21.343 3.608 ( -2.479 5.451 25.117) 25.822 3.698 ( -12.222 9.646 22.925) 27.712 4.276 ( 0.109 12.645 -14.011) 18.874 4.382 ( -3.025 -16.784 -14.852) 22.615 4.931 ( 11.261 2.688 0.285) 11.581 5.128 ( 11.282 8.044 -9.853) 17.002 5.285 ( -7.437 -0.169 1.709) 7.632 5.479 ( 3.275 -0.571 -6.202) 7.037 5.530 ( -10.551 -0.998 8.677) 13.697 5.785 ( -9.201 3.273 -3.812) 10.483 5.913 ( 7.327 4.013 -0.711) 8.385 5.973 ( 8.962 -0.747 -3.641) 9.702 6.078 ( 4.968 1.708 0.356) 5.266 6.254 ( -5.320 7.787 -1.759) 9.593 6.574 ( 10.429 -4.688 1.678) 11.556 6.744 ( 7.780 -1.709 -3.194) 8.582 7.061 ( -11.819 -5.822 -0.186) 13.177 7.100 ( -15.832 -8.880 -4.351) 18.666 8.040 ( 4.588 -5.957 4.298) 8.661 8.149 ( -1.013 -3.293 4.925) 6.011 8.670 ( 12.394 -10.045 -2.611) 16.166 8.888 ( 0.062 -2.325 -3.004) 3.799 18.925 ( 0.925 2.220 0.223) 2.415 18.973 ( -1.437 3.523 -0.271) 3.815 19.016 ( -0.097 0.244 1.841) 1.860 19.079 ( 0.129 -0.344 -1.729) 1.768 19.416 ( 0.476 -0.643 0.770) 1.110 19.445 ( 0.302 -0.753 -0.871) 1.190 19.507 ( 1.374 -2.357 0.120) 2.731 19.549 ( -0.862 -0.984 -0.214) 1.326 42.425 ( -1.695 0.396 0.122) 1.745 42.447 ( -2.651 1.339 -0.063) 2.971 42.598 ( 3.813 -1.524 0.138) 4.109 42.636 ( 1.323 0.166 -0.165) 1.344 65.938 ( 0.077 4.480 7.849) 9.038 66.306 ( -3.862 5.622 -11.084) 13.014 67.612 ( 5.674 -4.313 1.087) 7.209 68.050 ( -19.529 9.813 -2.282) 21.975 ======================= Grid point 176 (76/216) ======================= q-point: ( 0.64 0.36 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.494 ( 0.386 17.656 4.049) 18.118 2.707 ( -9.840 6.320 10.746) 15.882 3.156 ( -4.755 6.694 -7.064) 10.831 3.191 ( -21.254 17.259 6.481) 28.136 3.754 ( 4.562 -1.352 5.529) 7.295 4.017 ( 0.054 0.842 3.198) 3.308 4.321 ( -9.165 -0.763 0.704) 9.223 4.408 ( -18.536 11.479 -5.533) 22.494 4.730 ( 17.637 3.098 -4.267) 18.409 4.952 ( 8.087 5.063 -0.399) 9.550 5.374 ( -0.695 -2.451 1.010) 2.740 5.442 ( 3.136 -1.680 -0.780) 3.642 5.608 ( 7.504 0.790 1.348) 7.665 5.718 ( -1.829 -1.889 -2.172) 3.410 5.828 ( 0.326 -3.731 -2.778) 4.663 6.072 ( -4.624 9.734 1.636) 10.900 6.080 ( -5.717 6.151 -0.024) 8.397 6.385 ( -4.384 4.033 -0.280) 5.964 6.440 ( 2.272 -1.379 -0.472) 2.699 6.644 ( 5.622 10.547 -0.300) 11.955 7.154 ( -11.203 -11.351 -1.028) 15.981 7.228 ( -13.156 -9.920 -2.323) 16.640 7.969 ( 2.570 -5.013 3.834) 6.815 8.135 ( 1.388 -11.491 1.148) 11.632 8.323 ( 17.064 -7.708 -2.103) 18.842 8.813 ( 3.493 -2.935 -2.063) 5.007 18.928 ( 1.035 2.151 0.036) 2.388 19.017 ( -0.436 1.572 0.782) 1.809 19.032 ( -0.027 0.738 -0.001) 0.738 19.080 ( -1.404 2.437 -0.695) 2.897 19.406 ( 0.616 -0.843 0.406) 1.120 19.429 ( 0.203 -0.522 -0.520) 0.764 19.457 ( 1.981 -3.491 -0.012) 4.013 19.555 ( -0.949 -0.888 -0.049) 1.300 42.465 ( -2.541 -0.254 0.135) 2.557 42.502 ( -2.670 1.320 -0.039) 2.978 42.521 ( 3.908 -1.092 0.121) 4.059 42.615 ( 1.853 1.574 -0.326) 2.453 66.000 ( 1.539 2.212 3.300) 4.261 66.391 ( -7.170 10.718 -5.265) 13.929 67.488 ( 3.244 -11.147 0.541) 11.622 68.426 ( -19.724 9.318 -1.470) 21.864 ======================= Grid point 177 (77/216) ======================= q-point: ( 0.73 0.36 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.645 ( 2.209 20.200 -0.000) 20.320 2.928 ( -7.602 2.324 0.000) 7.950 3.184 ( 1.259 2.963 -0.000) 3.219 3.516 ( 3.464 9.880 -0.000) 10.469 3.610 ( 8.539 -5.703 -0.000) 10.269 4.013 ( -8.978 -2.828 0.000) 9.413 4.292 ( 26.904 7.937 -0.000) 28.050 4.530 ( -0.863 3.204 -0.000) 3.318 4.817 ( 10.747 -1.891 -0.000) 10.912 4.824 ( -16.215 0.845 0.000) 16.237 5.317 ( 0.007 4.072 -0.000) 4.072 5.332 ( 5.086 4.904 -0.000) 7.065 5.691 ( -5.050 7.270 0.000) 8.852 5.715 ( 2.634 -11.825 0.000) 12.115 5.761 ( -6.218 -5.971 0.000) 8.621 6.148 ( 0.425 11.193 -0.000) 11.201 6.335 ( -9.895 4.913 0.000) 11.048 6.444 ( -7.520 -2.794 0.000) 8.022 6.552 ( -15.409 5.795 0.000) 16.463 6.730 ( 5.216 23.722 -0.000) 24.289 7.217 ( -11.546 -13.250 0.000) 17.574 7.309 ( -8.788 -8.310 0.000) 12.095 7.780 ( 17.021 -23.797 -0.000) 29.258 7.947 ( -0.280 -3.601 0.000) 3.612 8.139 ( 6.535 -3.855 -0.000) 7.587 8.723 ( 4.052 -1.559 -0.000) 4.342 18.930 ( 0.979 2.056 -0.000) 2.277 19.020 ( 0.643 -0.350 -0.000) 0.732 19.036 ( 0.008 0.683 -0.000) 0.683 19.146 ( -2.567 5.175 0.000) 5.777 19.383 ( 1.663 -3.552 -0.000) 3.922 19.398 ( 1.171 -1.792 -0.000) 2.140 19.424 ( -0.098 -0.130 0.000) 0.163 19.562 ( -0.882 -0.910 0.000) 1.267 42.443 ( 2.586 -0.342 -0.000) 2.608 42.529 ( -3.358 -0.462 0.000) 3.390 42.538 ( -0.589 0.769 0.000) 0.968 42.604 ( 1.410 2.271 -0.000) 2.673 66.001 ( 1.578 2.038 -0.000) 2.578 66.598 ( -8.390 13.801 0.000) 16.151 67.330 ( 2.625 -16.813 0.000) 17.017 68.760 ( -15.165 6.947 0.000) 16.681 ======================= Grid point 183 (78/216) ======================= q-point: ( 0.18 0.45 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.260 ( 12.626 0.430 9.123) 15.583 2.583 ( 16.162 1.894 13.804) 21.339 2.918 ( 6.479 2.967 10.298) 12.523 3.061 ( 4.731 -14.682 11.541) 19.265 3.860 ( -13.096 -3.947 1.577) 13.769 3.864 ( -15.036 6.126 -8.739) 18.439 4.046 ( 9.144 4.807 -3.965) 11.066 4.539 ( -11.875 -1.338 -8.171) 14.477 4.636 ( 8.701 -1.994 6.950) 11.313 4.899 ( -14.386 -9.786 0.820) 17.418 5.363 ( -1.046 1.285 -4.242) 4.554 5.448 ( 1.003 4.113 -2.061) 4.708 5.555 ( 4.969 -20.998 2.478) 21.720 5.778 ( 12.456 9.453 4.580) 16.294 5.993 ( -4.814 -1.518 1.267) 5.205 6.029 ( 9.510 7.515 0.889) 12.153 6.307 ( 10.786 -2.116 -6.449) 12.744 6.450 ( -0.468 -0.631 -2.765) 2.875 6.543 ( 0.012 -4.278 -2.647) 5.031 6.756 ( 12.940 -3.773 -4.469) 14.200 7.386 ( -1.383 7.113 3.554) 8.071 7.543 ( -1.104 -0.105 3.900) 4.055 7.886 ( -2.355 2.413 2.322) 4.094 7.945 ( -3.348 2.087 7.163) 8.178 8.431 ( -11.131 13.511 -12.688) 21.619 8.747 ( -9.308 -3.760 -6.248) 11.824 18.927 ( 1.088 1.725 -0.116) 2.043 18.982 ( 0.379 -0.122 0.833) 0.924 19.023 ( 1.005 -2.290 -0.207) 2.510 19.083 ( 0.267 -2.322 -0.178) 2.344 19.383 ( 0.006 -0.075 0.446) 0.452 19.442 ( -0.730 0.460 -0.480) 0.987 19.467 ( -1.412 3.592 -0.140) 3.861 19.558 ( -0.431 -1.583 -0.079) 1.643 42.435 ( -0.482 1.760 -0.209) 1.837 42.533 ( -0.047 -3.190 -0.784) 3.286 42.542 ( 0.023 0.598 0.174) 0.623 42.573 ( 1.424 -0.876 0.063) 1.673 65.940 ( 6.697 1.628 2.591) 7.363 66.534 ( -2.063 -10.491 -5.750) 12.140 67.698 ( 0.176 14.519 6.845) 16.053 68.918 ( 7.044 -5.941 -11.673) 14.872 ======================= Grid point 184 (79/216) ======================= q-point: ( 0.27 0.45 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.181 ( 10.650 1.245 13.467) 17.215 2.437 ( 17.619 -1.500 12.241) 21.507 2.854 ( 11.635 -8.122 14.329) 20.165 3.028 ( 3.866 -3.461 17.238) 18.002 3.816 ( 24.236 5.664 11.052) 27.232 3.980 ( 0.604 2.868 -11.569) 11.934 4.194 ( -23.656 -1.950 -0.159) 23.736 4.437 ( 11.467 -3.591 -0.901) 12.050 4.575 ( -8.207 -5.486 -5.712) 11.405 5.188 ( -15.862 1.785 -4.381) 16.553 5.337 ( -6.213 0.193 -4.051) 7.419 5.440 ( -3.693 -5.284 0.670) 6.482 5.504 ( -5.021 -1.371 5.325) 7.446 5.669 ( 13.043 5.323 2.687) 14.341 5.919 ( 11.080 2.633 -0.353) 11.394 6.013 ( 10.494 -4.905 -8.657) 14.461 6.054 ( -0.923 -2.194 0.252) 2.394 6.350 ( 6.921 -2.014 -4.575) 8.538 6.537 ( -5.615 1.596 -3.867) 7.002 6.608 ( 0.896 -1.026 -4.577) 4.776 7.400 ( 6.952 3.067 2.763) 8.085 7.627 ( -1.593 1.618 5.407) 5.864 7.957 ( -2.858 3.834 1.034) 4.892 8.044 ( 0.365 -0.692 4.621) 4.686 8.590 ( -8.989 11.798 -10.681) 18.278 8.773 ( -7.516 -6.778 -6.375) 11.961 18.923 ( 1.132 1.749 -0.099) 2.086 18.966 ( 1.417 -2.838 -0.138) 3.175 18.991 ( 0.402 -0.513 1.280) 1.436 19.082 ( -1.040 -0.134 -0.652) 1.234 19.390 ( -0.308 0.006 0.743) 0.804 19.449 ( -0.646 0.137 -0.751) 1.000 19.513 ( -0.977 2.674 -0.031) 2.847 19.552 ( -0.560 -1.515 -0.134) 1.621 42.480 ( -3.120 2.040 -0.199) 3.733 42.514 ( 0.348 -1.185 0.109) 1.240 42.525 ( 1.906 -0.536 0.067) 1.981 42.542 ( 0.436 -1.308 -0.482) 1.460 65.877 ( 5.951 -0.168 5.416) 8.048 66.447 ( -1.822 -4.197 -9.308) 10.372 67.824 ( 4.134 10.299 6.318) 12.770 68.573 ( 16.438 -7.465 -13.814) 22.733 ======================= Grid point 185 (80/216) ======================= q-point: ( 0.36 0.45 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.166 ( 8.820 0.000 16.630) 18.824 2.233 ( 18.853 0.000 12.391) 22.560 2.670 ( 23.799 0.000 10.716) 26.100 3.099 ( 2.892 0.000 11.455) 11.815 3.623 ( 24.307 0.000 32.749) 40.784 3.647 ( 23.547 -0.000 -7.144) 24.607 4.231 ( 1.850 -0.000 -10.938) 11.093 4.573 ( -15.826 -0.000 0.593) 15.837 4.691 ( -14.267 -0.000 -3.765) 14.756 5.119 ( 2.965 -0.000 -17.218) 17.471 5.443 ( 8.054 -0.000 -6.313) 10.233 5.531 ( -4.251 -0.000 -3.311) 5.389 5.595 ( -4.182 0.000 6.251) 7.521 5.635 ( -0.846 0.000 6.721) 6.774 5.790 ( -5.176 -0.000 -3.133) 6.050 5.830 ( 0.536 -0.000 -3.183) 3.228 6.064 ( 0.010 0.000 0.535) 0.535 6.213 ( 3.709 -0.000 -5.363) 6.521 6.572 ( -2.191 -0.000 -2.841) 3.588 6.645 ( -9.675 -0.000 -4.764) 10.785 7.305 ( 10.157 0.000 3.500) 10.743 7.575 ( 14.227 -0.000 -3.421) 14.632 8.021 ( -0.974 0.000 3.217) 3.361 8.072 ( -5.699 0.000 1.906) 6.009 8.726 ( -8.882 -0.000 -3.326) 9.485 8.815 ( -7.339 -0.000 -3.475) 8.120 18.915 ( 1.256 0.000 0.185) 1.269 18.930 ( 0.764 -0.000 -0.319) 0.827 18.999 ( 0.136 0.000 1.772) 1.777 19.090 ( -0.947 -0.000 -1.504) 1.777 19.405 ( -0.734 0.000 1.002) 1.242 19.453 ( -0.649 -0.000 -0.837) 1.059 19.536 ( -0.290 0.000 0.254) 0.386 19.553 ( -0.712 -0.000 -0.396) 0.814 42.472 ( 3.582 0.000 0.166) 3.586 42.473 ( 3.399 0.000 0.113) 3.401 42.561 ( -4.399 -0.000 -0.035) 4.399 42.567 ( -4.380 -0.000 -0.317) 4.392 65.854 ( 3.825 0.000 7.766) 8.656 66.355 ( 0.567 -0.000 -11.929) 11.943 67.834 ( 6.599 0.000 4.746) 8.128 68.130 ( 21.101 -0.000 -9.125) 22.989 ======================= Grid point 187 (81/216) ======================= q-point: ( 0.55 0.45 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.161 ( 0.000 17.782 11.016) 20.917 2.200 ( -0.000 13.901 12.322) 18.576 2.404 ( -0.000 14.672 8.267) 16.841 2.705 ( -0.000 9.081 -22.399) 24.170 3.704 ( -0.000 10.268 22.897) 25.094 3.877 ( 0.000 -6.931 33.979) 34.679 4.045 ( 0.000 9.509 -18.419) 20.729 4.354 ( -0.000 -17.692 -22.958) 28.984 4.966 ( 0.000 8.210 -2.866) 8.695 5.006 ( -0.000 15.455 -8.830) 17.800 5.320 ( -0.000 -2.561 9.983) 10.307 5.463 ( 0.000 -0.252 1.231) 1.257 5.527 ( 0.000 -1.636 -6.546) 6.747 5.563 ( -0.000 4.638 -1.948) 5.030 5.993 ( 0.000 0.101 4.076) 4.077 6.049 ( -0.000 -2.352 -2.933) 3.760 6.114 ( -0.000 5.854 -1.505) 6.044 6.116 ( -0.000 2.716 -2.524) 3.708 6.787 ( -0.000 -2.013 1.420) 2.463 6.819 ( 0.000 -2.529 -1.971) 3.206 6.959 ( 0.000 -5.614 -0.351) 5.625 6.969 ( -0.000 -6.691 -0.787) 6.737 8.166 ( -0.000 -1.506 2.606) 3.010 8.175 ( 0.000 -4.260 1.504) 4.517 8.857 ( -0.000 -6.240 -0.371) 6.251 8.865 ( 0.000 -3.272 -1.298) 3.520 18.920 ( -0.000 2.086 0.586) 2.166 18.930 ( 0.000 2.213 -0.599) 2.293 19.032 ( -0.000 -0.001 2.147) 2.147 19.067 ( 0.000 -0.256 -2.168) 2.183 19.432 ( 0.000 -0.632 0.864) 1.071 19.446 ( -0.000 -0.637 -0.865) 1.074 19.537 ( 0.000 -1.110 0.475) 1.207 19.546 ( -0.000 -1.103 -0.524) 1.221 42.410 ( 0.000 0.716 0.154) 0.732 42.413 ( -0.000 0.704 -0.166) 0.723 42.645 ( 0.000 -0.741 0.233) 0.777 42.648 ( -0.000 -0.851 -0.173) 0.869 65.977 ( 0.000 3.706 9.820) 10.496 66.148 ( -0.000 3.266 -11.165) 11.633 67.733 ( 0.000 1.965 1.826) 2.682 67.757 ( -0.000 4.188 -1.379) 4.409 ======================= Grid point 188 (82/216) ======================= q-point: ( 0.64 0.45 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.374 ( -0.770 16.506 -0.000) 16.524 2.557 ( -13.284 7.575 0.000) 15.292 2.691 ( -14.864 23.515 0.000) 27.819 2.835 ( -18.063 13.834 0.000) 22.751 3.899 ( 5.562 3.303 -0.000) 6.469 4.025 ( -1.226 10.857 -0.000) 10.926 4.069 ( -9.573 -4.444 0.000) 10.554 4.144 ( -10.330 -8.308 0.000) 13.256 4.966 ( 15.104 10.304 -0.000) 18.284 4.998 ( 6.190 8.110 -0.000) 10.202 5.322 ( -2.970 -1.806 0.000) 3.476 5.401 ( -0.346 1.606 -0.000) 1.642 5.676 ( -9.216 -1.792 0.000) 9.388 5.687 ( -11.033 1.135 0.000) 11.091 5.909 ( 9.895 -1.791 -0.000) 10.056 5.935 ( 7.140 0.635 -0.000) 7.168 6.089 ( 4.281 5.723 -0.000) 7.147 6.241 ( -5.240 9.308 0.000) 10.681 6.595 ( 12.089 -4.310 -0.000) 12.835 6.708 ( 8.019 -0.015 -0.000) 8.019 7.054 ( -12.801 -9.958 0.000) 16.218 7.071 ( -14.863 -7.220 0.000) 16.523 8.076 ( 4.914 -4.441 -0.000) 6.624 8.190 ( -1.551 -3.760 0.000) 4.067 8.649 ( 13.572 -9.967 -0.000) 16.839 8.863 ( -0.088 -3.706 0.000) 3.707 18.927 ( 1.074 2.185 -0.000) 2.435 18.971 ( -1.635 3.597 0.000) 3.951 19.042 ( 0.418 -0.310 -0.000) 0.521 19.054 ( -0.382 0.267 0.000) 0.466 19.426 ( 0.603 -0.914 -0.000) 1.095 19.433 ( 0.162 -0.629 0.000) 0.650 19.509 ( 1.488 -2.399 -0.000) 2.823 19.547 ( -0.975 -0.941 0.000) 1.355 42.426 ( -1.742 0.424 0.000) 1.793 42.446 ( -2.665 1.333 0.000) 2.980 42.600 ( 3.807 -1.483 -0.000) 4.086 42.635 ( 1.483 0.097 -0.000) 1.486 66.036 ( 2.720 2.200 -0.000) 3.498 66.182 ( -6.196 7.713 0.000) 9.893 67.621 ( 5.737 -4.381 -0.000) 7.219 68.032 ( -19.023 9.107 0.000) 21.090 ======================= Grid point 195 (83/216) ======================= q-point: ( 0.18 0.55 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.456 ( 9.561 2.571 1.754) 10.054 2.812 ( 1.069 8.419 7.526) 11.343 3.073 ( 8.288 1.948 9.007) 12.394 3.211 ( -1.229 -3.860 5.313) 6.682 3.496 ( -12.201 4.903 -7.514) 15.145 3.852 ( -2.686 -6.758 2.179) 7.591 4.067 ( 6.073 2.593 -0.887) 6.663 4.289 ( -3.430 -1.578 -11.201) 11.820 4.839 ( -2.102 -9.641 5.547) 11.320 4.944 ( 2.302 -8.045 6.404) 10.537 5.248 ( -2.812 0.356 -4.468) 5.292 5.443 ( 3.188 3.006 -0.271) 4.390 5.736 ( 3.010 6.173 2.316) 7.248 5.853 ( -0.514 -5.483 -0.752) 5.558 5.988 ( 1.696 -2.027 2.275) 3.487 6.106 ( 6.967 7.101 -2.790) 10.331 6.330 ( -0.014 -1.134 -6.438) 6.537 6.496 ( 0.341 -2.575 -3.691) 4.514 6.588 ( 5.189 -6.407 3.683) 9.030 7.054 ( 15.978 -3.445 -0.150) 16.346 7.338 ( 0.117 1.068 6.457) 6.546 7.519 ( -4.818 0.892 1.598) 5.154 7.827 ( -3.835 7.434 1.509) 8.500 7.927 ( -4.175 2.740 3.000) 5.825 8.032 ( -12.291 7.459 -9.088) 17.009 8.610 ( -6.332 -3.846 -4.432) 8.632 18.929 ( 1.041 1.642 -0.059) 1.945 18.991 ( -0.003 0.060 0.541) 0.545 19.032 ( -0.272 -0.247 -0.318) 0.485 19.138 ( 2.232 -5.211 -0.188) 5.672 19.387 ( -0.206 0.697 0.292) 0.783 19.400 ( -1.557 3.927 0.189) 4.229 19.437 ( -0.170 0.283 -0.410) 0.526 19.564 ( -0.438 -1.451 -0.046) 1.517 42.440 ( 2.572 0.900 -0.048) 2.726 42.514 ( -2.307 1.583 0.033) 2.799 42.567 ( 1.768 -2.758 -0.345) 3.294 42.593 ( -0.142 -0.955 0.058) 0.968 66.005 ( 3.483 4.533 0.684) 5.758 66.619 ( 2.967 -15.900 -2.785) 16.412 67.598 ( -1.626 19.884 6.493) 20.981 68.971 ( 1.871 -8.418 -6.545) 10.826 ======================= Grid point 196 (84/216) ======================= q-point: ( 0.27 0.55 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.380 ( 8.315 4.238 6.133) 11.167 2.812 ( 14.402 -3.470 12.833) 19.600 3.061 ( 0.716 0.486 7.641) 7.690 3.265 ( 0.186 -6.565 11.511) 13.253 3.719 ( -15.755 3.476 -7.474) 17.781 3.881 ( -7.668 2.570 0.740) 8.122 3.980 ( 2.036 -1.972 -5.117) 5.849 4.373 ( -14.360 1.032 -9.174) 17.072 4.804 ( 15.121 -6.786 10.799) 19.782 4.921 ( -12.663 -7.233 2.126) 14.738 5.261 ( -3.952 1.600 -6.718) 7.957 5.373 ( 6.066 2.084 -4.486) 7.827 5.676 ( 1.096 -10.718 8.164) 13.518 5.804 ( 13.471 8.806 -1.410) 16.156 6.004 ( -4.319 0.815 1.165) 4.547 6.069 ( 6.556 3.935 2.808) 8.145 6.187 ( 8.851 -4.680 -7.835) 12.713 6.405 ( 3.609 -2.589 -2.175) 4.946 6.518 ( 1.315 -4.889 -0.833) 5.130 6.686 ( 15.075 -6.921 -3.875) 17.035 7.455 ( 1.055 7.452 5.240) 9.171 7.620 ( -2.429 3.459 4.751) 6.359 7.897 ( -2.291 1.103 -0.296) 2.560 8.056 ( -3.496 1.353 4.431) 5.804 8.228 ( -11.361 14.966 -10.460) 21.504 8.648 ( -8.333 -5.444 -5.693) 11.466 18.926 ( 1.060 1.621 -0.058) 1.938 18.996 ( 0.212 -0.359 0.850) 0.947 19.021 ( 0.728 -1.848 -0.062) 1.987 19.077 ( 0.479 -2.464 -0.543) 2.568 19.392 ( -0.050 0.156 0.625) 0.646 19.433 ( -0.433 0.171 -0.620) 0.776 19.465 ( -1.499 3.778 -0.092) 4.065 19.557 ( -0.412 -1.596 -0.060) 1.650 42.432 ( -0.507 1.534 -0.120) 1.620 42.522 ( -0.149 -3.331 -0.556) 3.381 42.544 ( 0.012 0.832 0.132) 0.842 42.575 ( 1.750 -0.605 0.095) 1.854 65.988 ( 4.543 3.086 3.100) 6.306 66.440 ( 1.443 -11.154 -5.525) 12.531 67.807 ( 2.543 18.969 6.086) 20.083 68.747 ( 8.187 -11.809 -8.916) 16.911 ======================= Grid point 197 (85/216) ======================= q-point: ( 0.36 0.55 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.360 ( 7.843 6.283 8.269) 13.014 2.602 ( 13.322 -11.300 7.337) 18.948 3.078 ( 11.830 -0.588 12.664) 17.340 3.255 ( 5.743 -3.066 8.940) 11.059 3.805 ( 1.904 2.253 -6.309) 6.965 3.914 ( -1.674 -0.169 -2.663) 3.150 4.198 ( -19.471 7.175 1.106) 20.780 4.497 ( -13.026 -9.135 -3.331) 16.255 4.537 ( 22.559 -3.922 13.489) 26.575 5.064 ( 2.425 2.264 -11.529) 11.997 5.287 ( -12.081 0.464 -1.556) 12.190 5.349 ( -9.891 1.106 -4.919) 11.102 5.631 ( 10.588 3.680 -2.023) 11.390 5.681 ( 3.192 -4.557 4.887) 7.406 5.895 ( 9.052 -3.952 -2.798) 10.266 5.979 ( 9.323 -3.893 4.130) 10.914 6.068 ( -0.099 0.221 1.843) 1.859 6.271 ( 7.360 -2.002 -5.172) 9.216 6.482 ( -3.369 0.778 -2.592) 4.321 6.535 ( -0.681 -1.325 -3.970) 4.241 7.482 ( 8.554 5.004 6.954) 12.107 7.677 ( 4.440 4.017 -0.014) 5.987 7.958 ( -3.830 3.869 -0.489) 5.466 8.068 ( -1.228 -5.673 -1.356) 5.961 8.477 ( -11.859 12.779 -2.517) 17.615 8.689 ( -8.969 -6.343 -4.153) 11.744 18.923 ( 1.040 1.676 -0.017) 1.972 18.964 ( 1.539 -3.076 -0.098) 3.441 19.015 ( -0.001 -0.109 1.526) 1.530 19.066 ( -0.660 -0.255 -1.267) 1.451 19.404 ( -0.451 0.151 0.918) 1.034 19.435 ( -0.580 0.095 -0.878) 1.057 19.513 ( -1.068 2.753 -0.016) 2.953 19.550 ( -0.467 -1.600 -0.084) 1.669 42.478 ( -3.351 1.870 -0.072) 3.838 42.515 ( -2.031 -2.243 -0.009) 3.026 42.527 ( 2.712 -0.090 0.178) 2.719 42.536 ( 2.059 -0.388 -0.306) 2.117 65.977 ( 4.115 1.302 6.694) 7.965 66.294 ( 1.182 -5.271 -9.069) 10.556 67.923 ( 7.280 15.612 5.415) 18.057 68.389 ( 14.390 -13.483 -8.586) 21.507 ======================= Grid point 198 (86/216) ======================= q-point: ( 0.45 0.55 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.367 ( 6.142 -0.000 6.969) 9.289 2.380 ( 11.938 0.000 4.886) 12.899 2.858 ( 28.314 0.000 12.935) 31.129 3.075 ( 19.743 -0.000 -11.599) 22.898 3.717 ( 6.672 0.000 12.988) 14.601 3.928 ( -2.576 -0.000 -7.800) 8.215 4.256 ( 20.669 -0.000 25.729) 33.003 4.596 ( -13.767 -0.000 2.512) 13.994 4.615 ( -11.627 0.000 -7.003) 13.573 4.758 ( 9.160 0.000 -24.294) 25.964 5.391 ( 5.231 0.000 0.431) 5.249 5.440 ( 1.007 -0.000 -5.023) 5.123 5.667 ( -12.741 0.000 1.240) 12.801 5.682 ( -17.809 -0.000 -0.758) 17.825 5.822 ( 12.060 -0.000 4.651) 12.926 5.839 ( 5.773 -0.000 2.399) 6.251 6.071 ( 0.838 0.000 0.903) 1.232 6.122 ( 3.575 -0.000 -5.242) 6.346 6.546 ( -5.555 -0.000 -0.072) 5.555 6.574 ( -8.374 0.000 -3.390) 9.034 7.386 ( 13.487 0.000 6.104) 14.804 7.491 ( 16.395 -0.000 -6.365) 17.587 8.065 ( -5.118 -0.000 2.035) 5.508 8.085 ( -6.333 0.000 -0.326) 6.342 8.717 ( -10.079 -0.000 1.528) 10.195 8.759 ( -8.825 0.000 -3.248) 9.404 18.919 ( 1.045 0.000 0.316) 1.092 18.925 ( 0.887 -0.000 -0.348) 0.952 19.030 ( -0.125 0.000 1.940) 1.944 19.061 ( -0.469 -0.000 -1.888) 1.945 19.422 ( -0.739 -0.000 1.021) 1.261 19.438 ( -0.695 0.000 -0.955) 1.181 19.540 ( -0.430 -0.000 0.330) 0.542 19.546 ( -0.572 0.000 -0.384) 0.689 42.474 ( 3.643 -0.000 0.095) 3.645 42.475 ( 3.597 0.000 0.018) 3.597 42.561 ( -4.596 -0.000 0.043) 4.596 42.563 ( -4.597 0.000 -0.164) 4.600 65.995 ( 2.898 -0.000 9.619) 10.046 66.165 ( 1.915 0.000 -11.142) 11.305 67.915 ( 10.349 0.000 5.259) 11.609 68.008 ( 15.064 -0.000 -6.296) 16.327 ======================= Grid point 207 (87/216) ======================= q-point: ( 0.18 -0.36 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.542 ( 3.194 3.242 -1.836) 4.908 2.664 ( -7.981 14.097 -1.590) 16.278 2.932 ( -11.070 17.024 -5.101) 20.937 3.267 ( 0.172 2.191 3.966) 4.535 3.543 ( 12.399 -7.769 2.635) 14.867 3.935 ( 8.639 -2.071 4.238) 9.843 4.138 ( 12.007 8.638 -1.894) 14.912 4.374 ( 9.232 -15.384 -4.373) 18.467 4.791 ( -10.694 7.767 -1.872) 13.349 5.004 ( -2.665 -11.465 3.072) 12.165 5.318 ( -0.314 -6.087 5.182) 8.000 5.490 ( 4.471 -0.872 4.227) 6.214 5.681 ( 0.608 13.187 4.321) 13.890 5.870 ( -1.133 -3.502 -5.600) 6.701 6.007 ( -3.118 1.163 2.162) 3.969 6.094 ( 4.432 5.441 -7.426) 10.217 6.280 ( -4.133 -5.323 -4.525) 8.117 6.473 ( -1.484 -5.742 -1.762) 6.187 6.788 ( 6.261 -6.812 4.038) 10.095 7.024 ( -4.784 16.992 0.856) 17.674 7.346 ( -14.206 4.750 -3.200) 15.317 7.553 ( -2.963 4.408 -3.737) 6.494 7.702 ( 6.633 -12.970 6.130) 15.805 7.794 ( -5.934 3.542 3.774) 7.874 7.997 ( 5.333 -4.901 0.608) 7.268 8.560 ( -1.030 -6.367 -3.754) 7.463 18.930 ( 0.964 1.680 -0.029) 1.937 18.988 ( -0.471 0.386 0.059) 0.612 19.028 ( -0.237 -0.410 -0.275) 0.547 19.221 ( 2.669 -5.610 -0.064) 6.213 19.326 ( -2.074 5.213 0.125) 5.612 19.393 ( 0.297 0.596 0.254) 0.713 19.436 ( 0.310 -0.275 -0.025) 0.415 19.568 ( -0.514 -1.266 -0.003) 1.367 42.455 ( -2.601 1.518 0.003) 3.012 42.490 ( 3.670 0.535 -0.028) 3.709 42.582 ( -2.242 -1.047 -0.130) 2.478 42.624 ( 3.251 -1.031 0.425) 3.437 66.001 ( 1.169 5.001 -0.081) 5.137 66.812 ( 5.514 -16.964 -1.170) 17.876 67.436 ( -2.419 22.298 5.129) 23.008 69.013 ( -1.610 -10.171 -2.301) 10.551 ======================= Grid point 208 (88/216) ======================= q-point: ( 0.27 0.64 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.488 ( 6.017 3.662 1.935) 7.304 2.928 ( -6.920 12.526 6.911) 15.892 3.155 ( -4.346 11.083 -2.051) 12.080 3.268 ( 5.932 -10.103 3.316) 12.176 3.448 ( -10.080 0.491 1.989) 10.286 3.899 ( 0.901 -0.612 3.625) 3.785 4.052 ( 6.544 -6.109 -1.092) 9.019 4.093 ( -2.317 -2.057 -11.398) 11.812 4.904 ( -6.760 -12.557 2.622) 14.500 5.027 ( 0.539 6.429 2.613) 6.961 5.234 ( 3.826 -12.314 1.900) 13.034 5.435 ( 7.246 4.144 -0.188) 8.350 5.781 ( 3.143 2.960 3.251) 5.405 5.856 ( -2.726 3.059 0.621) 4.144 5.984 ( 7.260 5.805 -3.657) 9.989 6.073 ( -3.378 -2.137 0.392) 4.016 6.218 ( 1.347 -2.655 -6.614) 7.253 6.450 ( -0.693 -1.576 -1.941) 2.594 6.642 ( 7.736 -7.938 2.772) 11.425 7.054 ( 16.217 -5.728 0.086) 17.199 7.450 ( 2.357 0.386 6.782) 7.191 7.551 ( -6.124 4.711 2.320) 8.067 7.770 ( -8.228 15.235 -7.578) 18.901 7.916 ( -6.162 -2.599 -2.589) 7.171 8.010 ( -4.346 5.330 3.850) 7.882 8.539 ( -6.094 -5.952 -3.825) 9.338 18.928 ( 1.027 1.580 -0.026) 1.884 19.001 ( -0.412 0.308 0.540) 0.746 19.026 ( -0.288 -0.452 -0.392) 0.664 19.135 ( 2.366 -5.258 -0.137) 5.768 19.390 ( -0.688 1.766 0.146) 1.901 19.404 ( -1.035 3.273 0.287) 3.444 19.430 ( 0.096 -0.026 -0.392) 0.404 19.563 ( -0.421 -1.473 -0.025) 1.532 42.440 ( 2.666 0.824 -0.003) 2.790 42.514 ( -2.432 1.616 0.003) 2.919 42.562 ( 2.344 -2.777 -0.175) 3.638 42.594 ( -0.286 -0.902 0.041) 0.947 66.015 ( 2.238 4.975 0.490) 5.477 66.582 ( 5.248 -15.625 -1.684) 16.568 67.688 ( 0.028 24.005 4.113) 24.355 68.882 ( 2.622 -13.473 -4.050) 14.311 ======================= Grid point 209 (89/216) ======================= q-point: ( 0.36 0.64 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.456 ( 6.153 6.272 2.702) 9.193 2.961 ( 13.146 -13.267 4.567) 19.228 3.182 ( -1.429 7.743 6.998) 10.534 3.354 ( -5.978 6.759 -1.630) 9.169 3.691 ( -13.474 -8.151 5.491) 16.677 3.837 ( -6.892 -11.059 -8.684) 15.659 3.913 ( 3.303 11.844 -0.163) 12.297 4.272 ( -19.078 -0.961 -3.053) 19.344 4.918 ( -0.331 -6.950 2.197) 7.297 5.003 ( 3.709 -8.202 7.280) 11.577 5.166 ( -2.481 3.309 -4.802) 6.337 5.311 ( 10.383 3.537 -2.603) 11.274 5.758 ( 12.531 8.826 -0.763) 15.346 5.790 ( 1.546 -5.459 2.870) 6.358 6.025 ( -2.755 -2.431 1.300) 3.898 6.072 ( -0.266 -9.364 -4.834) 10.541 6.105 ( 7.392 9.235 0.888) 11.862 6.386 ( 7.203 -3.579 -0.335) 8.050 6.508 ( 1.838 -4.523 -0.432) 4.901 6.639 ( 17.814 -10.962 -1.574) 20.975 7.547 ( 0.996 9.163 4.843) 10.412 7.675 ( 1.250 8.766 1.427) 8.969 7.895 ( -3.422 -1.999 0.724) 4.029 7.995 ( -8.994 2.578 -7.237) 11.828 8.193 ( -7.303 12.084 2.256) 14.299 8.574 ( -8.557 -6.375 -2.784) 11.028 18.925 ( 1.038 1.573 -0.016) 1.885 19.007 ( 0.621 -1.594 0.375) 1.752 19.021 ( -0.286 0.012 0.063) 0.293 19.069 ( 0.991 -3.081 -0.365) 3.257 19.402 ( -0.224 0.521 0.491) 0.750 19.423 ( -0.154 -0.174 -0.484) 0.537 19.464 ( -1.538 3.847 -0.031) 4.143 19.557 ( -0.400 -1.605 -0.022) 1.654 42.431 ( -0.524 1.407 -0.034) 1.502 42.515 ( -0.111 -3.248 -0.194) 3.256 42.546 ( -0.026 0.925 0.047) 0.926 42.576 ( 1.846 -0.577 0.039) 1.935 66.031 ( 2.119 5.147 1.730) 5.829 66.369 ( 4.740 -12.747 -2.636) 13.853 67.882 ( 4.353 23.525 2.640) 24.069 68.642 ( 7.935 -17.079 -3.528) 19.160 ======================= Grid point 210 (90/216) ======================= q-point: (-0.55 -0.36 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.432 ( 7.181 9.109 -0.000) 11.599 2.663 ( 10.523 -16.482 -0.000) 19.555 3.223 ( 9.005 5.361 -0.000) 10.480 3.291 ( 15.568 -1.886 -0.000) 15.682 3.787 ( -8.837 -2.495 0.000) 9.182 3.839 ( -2.734 -5.171 0.000) 5.849 4.210 ( -18.378 14.647 0.000) 23.501 4.469 ( -15.232 -12.857 0.000) 19.933 4.814 ( 19.513 0.491 -0.000) 19.519 4.816 ( 15.848 0.390 -0.000) 15.853 5.281 ( -12.960 1.526 0.000) 13.050 5.304 ( -11.953 -0.403 0.000) 11.959 5.609 ( 9.509 3.805 -0.000) 10.242 5.693 ( 9.962 -5.217 -0.000) 11.245 5.918 ( 3.216 -0.774 -0.000) 3.308 5.991 ( 0.738 -10.389 0.000) 10.416 6.116 ( 6.236 6.596 -0.000) 9.077 6.205 ( 7.968 -5.072 -0.000) 9.446 6.461 ( -0.295 1.276 -0.000) 1.310 6.498 ( -2.910 -2.252 0.000) 3.679 7.587 ( 8.046 7.944 -0.000) 11.307 7.631 ( 10.984 4.361 -0.000) 11.818 7.954 ( -5.278 1.889 0.000) 5.606 8.046 ( -5.274 -7.112 0.000) 8.854 8.470 ( -11.362 14.386 0.000) 18.332 8.650 ( -9.880 -7.441 0.000) 12.369 18.922 ( 0.999 1.669 -0.000) 1.945 18.963 ( 1.572 -3.121 -0.000) 3.494 19.035 ( -0.486 0.582 0.000) 0.758 19.047 ( -0.154 -0.911 0.000) 0.924 19.416 ( -0.592 0.538 0.000) 0.800 19.423 ( -0.467 -0.252 0.000) 0.531 19.513 ( -1.104 2.787 0.000) 2.997 19.549 ( -0.429 -1.636 0.000) 1.692 42.478 ( -3.453 1.821 0.000) 3.903 42.514 ( -2.808 -2.579 0.000) 3.813 42.529 ( 2.407 0.112 -0.000) 2.410 42.532 ( 3.174 -0.160 -0.000) 3.178 66.061 ( 1.758 5.871 -0.000) 6.129 66.190 ( 3.974 -9.693 -0.000) 10.476 67.975 ( 9.228 21.067 -0.000) 23.000 68.313 ( 12.567 -19.142 -0.000) 22.898 ======================= Grid point 219 (91/216) ======================= q-point: ( 0.18 -0.27 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.255 ( -17.342 17.420 -6.760) 25.493 2.491 ( -7.717 8.618 -5.899) 12.985 2.637 ( -2.504 15.916 -1.201) 16.157 3.240 ( -0.389 8.116 -1.077) 8.196 3.818 ( 16.366 -2.998 -0.375) 16.643 4.195 ( 15.322 -1.110 5.668) 16.374 4.275 ( 4.943 5.703 3.710) 8.410 4.464 ( -8.537 13.604 -5.258) 16.899 4.699 ( 21.604 -10.572 0.089) 24.052 5.113 ( -3.111 -15.243 4.820) 16.287 5.291 ( -7.029 -3.565 -1.468) 8.016 5.585 ( -6.896 3.111 6.033) 9.676 5.623 ( 0.586 11.337 3.778) 11.965 5.795 ( -1.731 1.622 -3.069) 3.879 5.950 ( -0.792 -0.087 -6.876) 6.922 6.014 ( -4.074 4.264 -1.639) 6.121 6.233 ( -4.231 -6.732 -0.668) 7.979 6.541 ( 0.711 -10.626 0.767) 10.677 6.717 ( -7.320 19.729 -3.241) 21.291 6.921 ( -3.749 1.531 5.574) 6.890 7.100 ( -3.455 -1.351 -4.462) 5.803 7.474 ( -1.843 -3.308 -2.290) 4.425 7.705 ( -5.576 2.498 1.961) 6.417 7.816 ( -4.261 -4.452 0.900) 6.228 8.337 ( 15.060 -15.619 8.915) 23.457 8.624 ( 5.624 -10.008 -4.936) 12.496 18.930 ( 0.832 1.758 -0.028) 1.945 18.974 ( -0.663 0.558 -0.191) 0.887 19.027 ( -0.179 -0.603 -0.238) 0.672 19.251 ( -1.895 5.504 0.208) 5.825 19.308 ( 2.662 -5.348 -0.011) 5.974 19.394 ( 0.375 0.773 0.120) 0.867 19.448 ( 0.584 -0.461 0.184) 0.767 19.569 ( -0.621 -1.065 0.026) 1.233 42.415 ( -0.839 0.433 -0.096) 0.949 42.537 ( 2.551 0.851 0.046) 2.689 42.542 ( -3.633 -1.034 -0.242) 3.785 42.682 ( 3.349 0.985 0.905) 3.606 65.958 ( -1.042 5.713 -0.217) 5.812 67.026 ( 4.957 -16.264 -0.854) 17.025 67.261 ( -0.708 21.364 3.777) 21.707 69.055 ( -3.747 -11.328 1.007) 11.974 ======================= Grid point 220 (92/216) ======================= q-point: ( 0.27 -0.27 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.531 ( 1.419 3.408 0.035) 3.692 2.646 ( -16.165 16.904 -0.582) 23.396 2.861 ( -8.054 16.713 -2.865) 18.772 3.328 ( -3.547 5.446 2.619) 7.007 3.560 ( 11.667 -7.325 0.070) 13.776 3.983 ( 10.506 -0.902 0.857) 10.579 4.116 ( 13.233 1.717 -0.092) 13.345 4.323 ( 12.608 -15.081 -1.557) 19.719 4.768 ( -11.910 11.478 -0.778) 16.559 5.051 ( -1.052 -12.125 1.859) 12.312 5.351 ( -3.543 -4.124 0.037) 5.437 5.595 ( 9.398 -6.691 5.990) 12.999 5.754 ( -0.204 13.381 3.560) 13.848 5.805 ( -2.877 -0.801 -0.139) 2.990 5.919 ( -0.411 5.799 -9.764) 11.364 6.088 ( -1.029 2.561 3.716) 4.629 6.199 ( -1.968 -7.740 -4.697) 9.266 6.453 ( -0.404 -7.076 -0.600) 7.113 6.851 ( 6.785 -7.506 2.847) 10.511 7.025 ( -6.634 18.097 -0.456) 19.280 7.302 ( -16.294 9.447 -1.746) 18.915 7.501 ( -3.515 3.848 -1.829) 5.524 7.775 ( 3.715 -10.695 2.145) 11.524 7.858 ( -4.181 -1.758 3.126) 5.508 7.999 ( 12.057 -3.973 -0.241) 12.697 8.508 ( -2.306 -7.882 -2.026) 8.458 18.930 ( 0.942 1.634 -0.009) 1.886 18.989 ( -0.728 0.587 0.047) 0.936 19.024 ( -0.276 -0.600 -0.124) 0.672 19.220 ( 2.726 -5.637 -0.024) 6.262 19.327 ( -1.990 5.203 0.046) 5.571 19.396 ( 0.307 0.853 0.096) 0.912 19.436 ( 0.509 -0.436 -0.015) 0.670 19.568 ( -0.495 -1.284 -0.000) 1.376 42.455 ( -2.891 1.479 0.011) 3.247 42.490 ( 3.937 0.578 -0.019) 3.979 42.580 ( -2.435 -1.060 -0.045) 2.656 42.629 ( 3.831 -1.111 0.169) 3.993 66.000 ( 1.023 5.064 -0.029) 5.166 66.799 ( 5.972 -16.696 -0.416) 17.737 67.495 ( -1.126 25.130 1.934) 25.229 68.986 ( -0.918 -13.527 -0.869) 13.586 ======================= Grid point 221 (93/216) ======================= q-point: ( 0.36 -0.27 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.506 ( 4.827 4.155 -0.000) 6.370 3.026 ( -13.972 14.972 0.000) 20.479 3.075 ( -5.609 13.087 0.000) 14.238 3.304 ( 10.330 -14.600 -0.000) 17.885 3.487 ( -11.124 2.904 0.000) 11.497 3.954 ( 9.277 4.257 -0.000) 10.207 3.966 ( -6.769 -8.072 0.000) 10.534 4.041 ( 4.951 -7.611 -0.000) 9.079 4.925 ( -7.319 -11.868 0.000) 13.943 5.045 ( -1.456 9.164 -0.000) 9.279 5.256 ( 4.793 -16.907 0.000) 17.574 5.438 ( 10.878 5.022 -0.000) 11.982 5.827 ( -2.896 -5.547 0.000) 6.257 5.857 ( 9.409 12.322 -0.000) 15.504 5.932 ( -0.839 14.720 -0.000) 14.744 6.094 ( -5.479 -19.565 0.000) 20.318 6.147 ( 3.246 6.111 -0.000) 6.920 6.434 ( -0.776 -1.124 0.000) 1.366 6.667 ( 8.627 -8.795 -0.000) 12.320 7.055 ( 16.159 -6.439 -0.000) 17.394 7.519 ( 2.650 -1.639 -0.000) 3.116 7.596 ( -2.216 9.091 -0.000) 9.357 7.664 ( -13.411 15.166 0.000) 20.245 7.897 ( -3.330 -4.890 0.000) 5.916 8.047 ( -5.400 7.188 0.000) 8.990 8.504 ( -5.972 -7.017 0.000) 9.215 18.928 ( 1.020 1.558 -0.000) 1.862 19.006 ( -0.719 0.630 0.000) 0.956 19.022 ( -0.144 -0.746 0.000) 0.759 19.134 ( 2.429 -5.292 -0.000) 5.823 19.391 ( -0.913 2.248 0.000) 2.426 19.407 ( -0.895 3.211 -0.000) 3.334 19.426 ( 0.291 -0.404 -0.000) 0.498 19.563 ( -0.414 -1.481 0.000) 1.538 42.440 ( 2.706 0.795 -0.000) 2.820 42.514 ( -2.484 1.629 0.000) 2.970 42.561 ( 2.561 -2.773 -0.000) 3.774 42.594 ( -0.348 -0.895 0.000) 0.960 66.020 ( 1.681 5.179 -0.000) 5.445 66.567 ( 6.201 -15.575 -0.000) 16.764 67.723 ( 0.721 25.947 -0.000) 25.957 68.847 ( 2.766 -15.737 0.000) 15.978 ======================= Grid point 230 (94/216) ======================= q-point: ( 0.18 -0.18 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.756 ( -18.976 20.251 -6.396) 28.480 2.163 ( -13.420 17.232 -3.326) 22.093 2.487 ( -2.619 12.873 -1.934) 13.278 3.081 ( -5.607 16.317 -2.556) 17.442 3.868 ( -26.492 23.352 1.129) 35.333 4.146 ( 22.193 -1.899 -2.516) 22.416 4.460 ( 10.369 3.133 5.956) 12.361 4.519 ( 10.932 -1.893 -0.163) 11.096 5.099 ( -12.023 -2.273 3.458) 12.715 5.189 ( 21.848 -10.262 1.286) 24.172 5.263 ( -18.870 7.400 -6.691) 21.345 5.336 ( -0.014 -19.623 2.165) 19.742 5.481 ( -1.574 20.273 0.186) 20.334 5.764 ( 5.316 8.821 -2.063) 10.504 5.867 ( -5.552 0.751 2.558) 6.159 5.933 ( -6.781 -5.137 -3.736) 9.291 6.297 ( 2.600 -8.907 3.629) 9.963 6.489 ( -0.060 11.207 -2.912) 11.579 6.662 ( 0.731 -9.041 0.492) 9.083 6.812 ( -6.554 6.560 3.161) 9.797 7.154 ( 5.969 -5.621 -2.560) 8.590 7.498 ( -1.092 -8.640 -0.331) 8.715 7.597 ( -8.634 0.298 0.430) 8.650 7.768 ( -4.461 -2.397 -0.688) 5.110 8.646 ( 3.977 -9.882 4.113) 11.419 8.888 ( 15.781 -16.932 -0.480) 23.150 18.926 ( 0.596 1.770 -0.042) 1.868 18.958 ( -0.539 0.671 -0.155) 0.874 19.028 ( -0.149 -0.649 -0.179) 0.690 19.182 ( -1.404 5.381 0.159) 5.564 19.389 ( 2.338 -4.626 0.020) 5.184 19.394 ( 0.394 0.801 0.053) 0.894 19.463 ( 0.636 -0.485 0.144) 0.813 19.567 ( -0.696 -0.909 0.026) 1.145 42.429 ( 2.328 -1.091 -0.056) 2.572 42.489 ( -3.809 -0.937 -0.180) 3.927 42.547 ( -0.210 1.538 0.036) 1.553 42.718 ( 2.024 2.373 0.723) 3.202 65.866 ( -3.588 7.217 -0.355) 8.068 67.138 ( 2.340 17.326 2.453) 17.655 67.209 ( 2.785 -14.603 -0.808) 14.888 69.101 ( -5.011 -12.239 2.775) 13.513 ======================= Grid point 231 (95/216) ======================= q-point: ( 0.27 -0.18 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.198 ( -19.533 19.424 0.000) 27.547 2.442 ( -8.710 8.669 0.000) 12.289 2.627 ( -2.452 15.812 -0.000) 16.001 3.232 ( -2.440 9.389 -0.000) 9.701 3.809 ( 17.136 -1.694 -0.000) 17.220 4.236 ( 16.221 -4.402 -0.000) 16.808 4.325 ( 6.369 1.241 -0.000) 6.489 4.417 ( -10.516 18.859 0.000) 21.593 4.697 ( 23.567 -10.438 -0.000) 25.775 5.161 ( -0.660 -16.066 0.000) 16.080 5.263 ( -10.206 -3.574 0.000) 10.814 5.640 ( -0.874 19.999 -0.000) 20.018 5.686 ( -16.095 -1.623 0.000) 16.177 5.766 ( 1.279 4.105 -0.000) 4.299 5.854 ( 6.578 -1.816 -0.000) 6.824 6.011 ( -7.724 -0.111 0.000) 7.725 6.227 ( -0.821 -7.293 0.000) 7.339 6.548 ( 1.826 -11.714 0.000) 11.855 6.687 ( -9.274 21.812 0.000) 23.702 7.016 ( -11.222 6.341 0.000) 12.889 7.016 ( 5.099 -5.985 -0.000) 7.863 7.453 ( -1.774 -4.005 0.000) 4.381 7.723 ( -5.674 2.516 0.000) 6.207 7.823 ( -5.050 -2.454 0.000) 5.615 8.438 ( 21.047 -18.609 -0.000) 28.094 8.557 ( 0.769 -8.870 0.000) 8.903 18.930 ( 0.797 1.721 -0.000) 1.897 18.973 ( -0.724 0.625 0.000) 0.957 19.025 ( -0.249 -0.652 0.000) 0.698 19.253 ( -1.836 5.527 0.000) 5.824 19.308 ( 2.685 -5.373 -0.000) 6.006 19.395 ( 0.405 0.847 -0.000) 0.938 19.449 ( 0.652 -0.483 -0.000) 0.811 19.569 ( -0.610 -1.069 0.000) 1.231 42.415 ( -0.897 0.383 0.000) 0.976 42.537 ( 2.062 0.666 -0.000) 2.167 42.540 ( -3.180 -0.816 0.000) 3.283 42.690 ( 3.620 0.928 -0.000) 3.737 65.956 ( -1.108 5.855 -0.000) 5.959 67.019 ( 4.673 -16.424 0.000) 17.076 67.293 ( 0.287 22.748 -0.000) 22.750 69.063 ( -2.981 -13.122 0.000) 13.457 ======================= Grid point 241 (96/216) ======================= q-point: ( 0.18 -0.09 0.09) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.260 ( -17.991 22.576 0.000) 28.868 1.751 ( -17.256 22.736 0.000) 28.543 2.306 ( -4.809 14.234 0.000) 15.024 2.750 ( -12.236 29.221 0.000) 31.679 3.128 ( -38.956 28.616 0.000) 48.337 4.443 ( -12.147 6.241 0.000) 13.657 4.531 ( 22.681 -5.096 -0.000) 23.246 4.758 ( 14.116 -0.966 -0.000) 14.149 4.808 ( -6.939 11.466 0.000) 13.402 4.977 ( -9.176 -2.567 0.000) 9.529 5.251 ( -4.000 18.516 -0.000) 18.943 5.591 ( 3.262 -22.274 0.000) 22.512 5.618 ( 9.372 -10.566 -0.000) 14.124 5.696 ( -8.853 7.044 0.000) 11.313 5.876 ( 15.028 1.139 -0.000) 15.071 5.882 ( -1.287 -4.175 0.000) 4.369 6.416 ( 2.213 7.818 -0.000) 8.125 6.470 ( 4.797 -10.386 -0.000) 11.440 6.692 ( -3.240 7.046 0.000) 7.755 6.721 ( -1.003 -5.441 0.000) 5.533 7.309 ( 8.582 -6.217 -0.000) 10.597 7.420 ( -15.961 -3.226 0.000) 16.284 7.551 ( -2.479 -9.481 0.000) 9.800 7.735 ( -1.790 -2.525 0.000) 3.096 8.790 ( 3.320 -8.967 -0.000) 9.562 9.249 ( 12.417 -15.005 -0.000) 19.477 18.918 ( 0.270 1.664 -0.000) 1.686 18.945 ( -0.246 0.838 -0.000) 0.874 19.030 ( -0.079 -0.635 0.000) 0.640 19.125 ( -0.419 4.886 -0.000) 4.904 19.392 ( 0.301 0.830 -0.000) 0.882 19.455 ( 1.704 -3.517 -0.000) 3.908 19.477 ( 0.545 -0.517 -0.000) 0.751 19.564 ( -0.609 -0.916 0.000) 1.100 42.443 ( -2.786 -0.576 0.000) 2.845 42.498 ( 4.513 -2.127 -0.000) 4.989 42.510 ( -2.481 1.877 0.000) 3.111 42.716 ( -0.081 2.442 -0.000) 2.443 65.735 ( -4.398 7.913 0.000) 9.053 67.075 ( 4.053 13.342 -0.000) 13.944 67.339 ( -0.591 -13.451 0.000) 13.464 69.134 ( -6.798 -12.941 0.000) 14.618 ======================= Grid point 252 (97/216) ======================= q-point: ( 0.18 0.00 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 216 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.940 ( 0.000 29.149 -0.000) 29.149 1.373 ( 0.000 40.011 -0.000) 40.011 2.183 ( 0.000 62.706 -0.000) 62.706 2.276 ( 0.000 20.929 -0.000) 20.929 2.586 ( 0.000 25.412 -0.000) 25.412 4.093 ( 0.000 10.755 -0.000) 10.755 4.728 ( -0.000 -6.764 0.000) 6.764 4.930 ( 0.000 14.947 -0.000) 14.947 5.067 ( 0.000 1.837 -0.000) 1.837 5.117 ( 0.000 12.016 -0.000) 12.016 5.143 ( -0.000 -15.167 0.000) 15.167 5.268 ( 0.000 14.066 -0.000) 14.066 5.603 ( -0.000 -18.114 0.000) 18.114 5.683 ( -0.000 -4.296 0.000) 4.296 6.253 ( -0.000 -4.112 0.000) 4.112 6.279 ( -0.000 -1.372 0.000) 1.372 6.337 ( 0.000 0.512 -0.000) 0.512 6.494 ( 0.000 4.852 -0.000) 4.852 6.557 ( -0.000 -10.581 0.000) 10.581 6.702 ( -0.000 -3.933 0.000) 3.933 6.894 ( 0.000 7.092 -0.000) 7.092 7.424 ( -0.000 -11.570 0.000) 11.570 7.605 ( -0.000 -5.994 0.000) 5.994 7.658 ( -0.000 -4.730 0.000) 4.730 8.844 ( -0.000 -9.897 0.000) 9.897 9.487 ( -0.000 -11.910 0.000) 11.910 18.920 ( 0.000 1.305 -0.000) 1.305 18.951 ( 0.000 2.875 -0.000) 2.875 19.029 ( -0.000 -0.710 0.000) 0.710 19.129 ( 0.000 2.031 -0.000) 2.031 19.399 ( 0.000 0.990 -0.000) 0.990 19.484 ( -0.000 -0.643 0.000) 0.643 19.489 ( -0.000 -2.310 0.000) 2.310 19.549 ( -0.000 -1.968 0.000) 1.968 42.417 ( 0.000 1.158 -0.000) 1.158 42.436 ( 0.000 1.112 -0.000) 1.112 42.614 ( -0.000 -1.105 0.000) 1.105 42.646 ( -0.000 -1.088 0.000) 1.088 65.662 ( 0.000 9.501 -0.000) 9.501 67.145 ( 0.000 11.771 -0.000) 11.771 67.282 ( -0.000 -8.074 0.000) 8.074 68.927 ( -0.000 -7.976 0.000) 7.976 ======================= Grid point 253 (98/216) ======================= q-point: ( 0.27 0.00 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.294 ( -9.145 26.776 8.883) 29.656 1.797 ( -9.753 33.581 3.606) 35.154 2.453 ( 1.065 23.717 3.584) 24.010 2.864 ( -7.279 30.706 3.187) 31.717 2.939 ( -24.821 45.803 3.172) 52.193 4.257 ( -11.887 10.120 -6.230) 16.809 4.695 ( 1.562 -9.087 4.571) 10.292 4.845 ( 12.082 -8.367 -1.543) 14.777 4.980 ( 8.333 13.325 0.883) 15.741 5.016 ( 7.878 0.216 -2.010) 8.133 5.274 ( -7.189 5.213 -1.095) 8.948 5.435 ( -2.804 -7.744 -3.255) 8.856 5.519 ( -4.200 -2.461 5.178) 7.107 5.672 ( -3.247 0.419 2.904) 4.376 5.969 ( 15.035 1.092 -0.943) 15.105 6.130 ( 11.332 -0.549 -0.574) 11.360 6.425 ( 3.344 -10.594 -2.680) 11.428 6.498 ( -1.296 5.296 -0.055) 5.453 6.645 ( -5.181 -0.849 -2.765) 5.933 6.676 ( -4.225 -2.217 1.080) 4.892 7.081 ( -18.416 -0.268 -2.178) 18.547 7.342 ( 0.655 -11.968 2.675) 12.281 7.481 ( 4.759 -7.506 2.372) 9.199 7.662 ( -3.541 -5.482 -0.324) 6.535 8.740 ( 1.675 -10.642 -1.411) 10.865 9.287 ( 8.889 -13.704 -3.624) 16.732 18.932 ( -0.186 0.929 0.287) 0.990 18.971 ( 1.105 3.603 0.051) 3.769 19.024 ( -0.065 -0.742 0.243) 0.784 19.151 ( -0.588 3.318 -0.396) 3.393 19.405 ( 0.302 1.077 -0.076) 1.121 19.452 ( 1.579 -3.337 0.013) 3.692 19.477 ( 0.147 -0.820 -0.169) 0.850 19.540 ( -0.872 -1.920 -0.077) 2.110 42.418 ( -0.117 0.371 0.085) 0.398 42.482 ( -3.084 2.082 -0.047) 3.722 42.549 ( 4.405 -2.222 0.112) 4.935 42.689 ( -3.821 -0.099 -0.519) 3.858 65.769 ( -1.980 11.016 0.998) 11.237 67.151 ( -1.354 0.274 -9.702) 9.800 67.297 ( 2.421 2.633 7.890) 8.663 68.880 ( -7.361 -10.537 -7.702) 14.985 ======================= Grid point 254 (99/216) ======================= q-point: ( 0.36 0.00 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.762 ( -13.079 22.792 11.663) 28.750 2.227 ( -8.138 25.600 7.048) 27.772 2.658 ( 1.854 22.220 4.328) 22.714 3.192 ( -4.105 19.937 4.875) 20.931 3.730 ( -23.653 38.273 1.739) 45.025 4.426 ( 2.509 -4.417 -2.654) 5.731 4.476 ( 5.972 2.293 -5.743) 8.596 4.639 ( 10.348 -8.354 -0.588) 13.312 4.961 ( -0.852 2.124 -0.047) 2.289 5.005 ( -6.161 -0.223 -2.011) 6.485 5.193 ( -0.561 -15.540 0.735) 15.567 5.411 ( 9.867 -14.496 2.427) 17.703 5.599 ( -6.192 20.006 -0.516) 20.949 5.780 ( 2.345 0.644 -1.012) 2.634 5.872 ( 0.523 -0.043 5.006) 5.033 6.011 ( 5.082 13.449 0.774) 14.398 6.244 ( 3.838 -10.774 -2.890) 11.796 6.544 ( -0.606 -0.995 -2.602) 2.851 6.619 ( -0.873 1.972 1.265) 2.501 6.769 ( -3.597 6.897 -3.963) 8.730 7.215 ( 5.184 -9.448 3.180) 11.236 7.310 ( -14.242 -6.932 -4.058) 16.351 7.452 ( -5.363 -5.898 4.486) 9.147 7.674 ( -3.783 -5.656 1.224) 6.913 8.586 ( 4.113 -10.698 -4.879) 12.456 8.969 ( 12.636 -14.959 -1.789) 19.663 18.947 ( -0.267 1.009 0.512) 1.163 18.979 ( 1.533 3.348 0.011) 3.682 19.022 ( -0.102 -0.815 0.494) 0.958 19.198 ( -1.632 4.574 -0.561) 4.888 19.388 ( 2.406 -4.440 -0.039) 5.050 19.407 ( 0.466 1.002 -0.177) 1.119 19.464 ( 0.352 -0.780 -0.349) 0.924 19.540 ( -1.191 -1.888 -0.095) 2.234 42.436 ( -1.885 -0.523 0.207) 1.967 42.468 ( 3.578 -1.709 0.382) 3.984 42.545 ( -2.164 2.451 -0.151) 3.273 42.726 ( -1.492 0.398 -1.247) 1.985 65.904 ( -2.032 11.060 0.991) 11.289 67.081 ( -1.759 -9.917 -3.778) 10.757 67.329 ( 5.204 13.148 -0.624) 14.154 68.853 ( -8.673 -12.180 -5.792) 16.035 ======================= Grid point 255 (100/216) ======================= q-point: ( 0.45 0.00 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.239 ( -13.712 18.757 11.185) 25.787 2.580 ( -4.723 18.515 9.602) 21.384 2.825 ( 3.420 22.345 2.283) 22.720 3.355 ( 3.286 9.794 2.391) 10.604 4.050 ( 15.950 -0.557 -2.593) 16.169 4.297 ( 2.107 10.849 -3.549) 11.608 4.402 ( 6.559 1.905 3.801) 7.816 4.474 ( -2.652 -0.802 -2.432) 3.686 4.929 ( -1.225 -6.159 -7.648) 9.896 4.955 ( 19.781 -14.087 -1.268) 24.317 5.098 ( -10.991 -3.636 -0.626) 11.594 5.390 ( -10.796 -1.918 3.016) 11.373 5.719 ( 2.256 3.128 -2.794) 4.762 5.812 ( -0.612 11.976 1.024) 12.036 5.949 ( -8.151 -0.612 5.357) 9.773 6.009 ( 2.494 -5.151 1.096) 5.827 6.219 ( -1.134 7.154 2.361) 7.618 6.473 ( 1.064 -3.535 -3.170) 4.866 6.761 ( -6.649 10.105 1.056) 12.142 6.860 ( -4.487 9.794 -3.323) 11.274 7.092 ( 3.060 -8.290 2.696) 9.239 7.381 ( -7.811 -6.234 0.169) 9.995 7.575 ( -9.404 -1.525 -0.678) 9.551 7.693 ( -3.469 -7.524 1.115) 8.360 8.329 ( 9.832 -11.731 -9.466) 17.997 8.683 ( 8.776 -12.544 3.293) 15.660 18.963 ( 0.206 1.527 0.542) 1.634 18.982 ( 1.099 2.503 -0.018) 2.733 19.022 ( -0.124 -0.670 0.538) 0.869 19.263 ( -2.035 5.047 -0.470) 5.462 19.307 ( 2.791 -5.172 -0.008) 5.877 19.406 ( 0.494 0.908 -0.343) 1.089 19.449 ( 0.377 -0.681 -0.402) 0.876 19.541 ( -1.179 -2.034 -0.078) 2.353 42.421 ( 1.036 -0.239 0.297) 1.104 42.478 ( -3.331 -1.137 0.605) 3.571 42.575 ( 0.633 2.179 -0.291) 2.288 42.717 ( 1.448 0.063 -1.541) 2.116 66.015 ( -0.293 9.787 0.259) 9.794 66.963 ( 2.542 -15.167 0.907) 15.406 67.376 ( 0.666 18.810 -7.850) 20.393 68.855 ( -8.175 -11.978 -0.905) 14.531 ======================= Grid point 256 (101/216) ======================= q-point: ( 0.55 0.00 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.633 ( -6.870 13.259 8.167) 17.021 2.793 ( 3.236 13.523 7.505) 15.801 3.017 ( -3.083 23.296 1.595) 23.553 3.313 ( 6.784 1.330 -2.061) 7.214 3.696 ( 18.548 -7.310 -3.896) 20.314 4.057 ( 13.587 -5.058 -2.822) 14.770 4.378 ( 4.700 1.413 3.946) 6.297 4.483 ( 20.874 -11.083 -2.249) 23.741 4.672 ( -6.747 1.765 -0.128) 6.975 4.919 ( -3.701 4.505 -3.387) 6.742 5.177 ( -5.373 -5.763 -3.853) 8.771 5.467 ( -1.878 -2.845 0.044) 3.409 5.689 ( -0.952 1.309 -3.756) 4.089 5.870 ( 1.926 -3.297 6.929) 7.911 6.042 ( -1.398 7.101 1.366) 7.365 6.123 ( -10.998 -3.803 2.023) 11.811 6.298 ( -0.003 4.090 5.174) 6.595 6.447 ( 1.473 6.977 -1.962) 7.395 6.783 ( 4.073 -7.247 -2.162) 8.589 7.076 ( -4.980 14.301 -1.930) 15.266 7.152 ( -15.778 1.368 1.978) 15.960 7.516 ( -11.774 3.183 2.679) 12.487 7.611 ( 5.073 -13.594 -1.511) 14.588 7.680 ( -7.198 0.171 -3.456) 7.986 8.012 ( 7.749 -8.636 -6.327) 13.216 8.549 ( 2.408 -7.947 4.821) 9.602 18.971 ( 1.407 2.697 0.276) 3.054 18.988 ( 0.081 0.883 0.029) 0.887 19.024 ( -0.154 -0.302 0.527) 0.627 19.218 ( 2.840 -5.483 0.030) 6.175 19.334 ( -2.113 4.857 -0.286) 5.304 19.401 ( 0.485 0.643 -0.563) 0.982 19.437 ( 0.141 -0.317 -0.163) 0.383 19.541 ( -1.075 -2.246 -0.025) 2.490 42.434 ( -1.689 1.374 0.302) 2.198 42.526 ( -3.479 -1.609 0.515) 3.867 42.557 ( 3.358 1.744 -0.312) 3.797 42.663 ( 3.365 -1.018 -1.171) 3.706 66.082 ( 1.441 8.864 -0.083) 8.981 66.770 ( 6.066 -16.258 1.143) 17.390 67.488 ( -4.251 18.159 -10.192) 21.254 68.891 ( -6.469 -9.867 4.050) 12.475 ======================= Grid point 257 (102/216) ======================= q-point: (-0.36 0.00 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.701 ( 13.484 9.056 3.004) 16.519 2.894 ( 4.032 11.843 -3.046) 12.876 3.157 ( 4.529 -3.147 -2.471) 6.043 3.186 ( 8.212 2.453 -5.269) 10.060 3.495 ( -2.237 7.194 7.273) 10.472 3.823 ( 8.163 -3.755 -3.392) 9.605 4.131 ( 9.699 -9.638 -0.732) 13.693 4.380 ( -1.162 -0.212 2.359) 2.638 4.691 ( -0.167 -2.519 1.973) 3.205 4.879 ( 3.888 -4.788 -12.619) 14.045 5.257 ( -5.201 3.485 8.286) 10.386 5.452 ( -0.260 -1.932 -0.132) 1.954 5.732 ( 0.084 -2.301 0.261) 2.317 5.811 ( 0.149 -7.177 3.633) 8.046 6.078 ( 5.633 9.495 -3.267) 11.514 6.276 ( -9.717 -2.143 3.003) 10.394 6.353 ( 7.499 10.986 2.314) 13.501 6.476 ( -2.656 -1.412 -1.635) 3.423 6.618 ( 7.043 -5.395 1.301) 8.967 7.236 ( -2.804 11.153 -1.575) 11.608 7.277 ( 7.608 -14.481 -3.736) 16.779 7.396 ( -5.700 -0.075 -0.071) 5.701 7.748 ( -6.061 1.797 -5.061) 8.098 7.863 ( -5.065 0.422 -0.786) 5.143 7.905 ( -17.314 3.545 3.990) 18.118 8.544 ( -2.476 -4.339 5.547) 7.465 18.972 ( 1.753 3.018 0.178) 3.494 18.990 ( 0.154 0.164 -0.228) 0.320 19.030 ( -0.165 -0.068 0.460) 0.493 19.132 ( 2.466 -5.136 0.106) 5.699 19.387 ( -0.103 0.649 -0.455) 0.799 19.406 ( -1.341 3.185 -0.348) 3.474 19.439 ( -0.373 0.796 0.182) 0.898 19.537 ( -0.971 -2.450 0.045) 2.636 42.487 ( -2.152 2.209 0.100) 3.085 42.509 ( 3.570 1.729 -0.077) 3.967 42.561 ( -2.295 -1.823 0.197) 2.938 42.588 ( 3.405 -2.343 -0.350) 4.148 66.120 ( 3.705 9.288 0.059) 10.000 66.553 ( 4.505 -16.208 0.882) 16.846 67.614 ( -5.289 13.673 -10.672) 18.133 68.954 ( -3.777 -6.259 8.074) 10.892 ======================= Grid point 258 (103/216) ======================= q-point: (-0.27 0.00 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.448 ( 20.038 1.786 -10.569) 22.725 2.781 ( 13.223 9.187 -5.264) 16.940 2.976 ( 7.490 -11.513 -3.800) 14.251 3.031 ( 11.512 3.834 -4.339) 12.886 3.663 ( 0.499 -5.171 -4.890) 7.134 3.767 ( -13.449 5.574 8.667) 16.943 4.123 ( -6.271 1.854 5.950) 8.841 4.462 ( -12.224 -3.228 -2.657) 12.919 4.631 ( 5.277 -6.047 -12.762) 15.076 4.734 ( 1.819 5.540 7.947) 9.857 5.373 ( -0.030 0.486 1.372) 1.456 5.487 ( 8.005 -17.135 2.556) 19.084 5.526 ( 1.185 3.747 4.652) 6.090 5.910 ( -6.174 0.485 1.583) 6.392 5.960 ( 10.429 4.126 -7.415) 13.445 6.258 ( 12.104 8.193 -3.834) 15.111 6.428 ( -5.945 1.408 2.078) 6.453 6.461 ( 0.842 -2.854 -0.008) 2.976 6.533 ( 4.617 -3.586 8.339) 10.184 6.980 ( 15.096 -4.584 4.036) 16.285 7.367 ( -3.881 8.004 -4.298) 9.879 7.472 ( -4.558 -2.902 -1.419) 5.587 7.804 ( -5.376 2.070 -6.679) 8.820 7.840 ( -3.496 -3.120 -3.815) 6.042 8.383 ( -21.626 8.160 9.466) 24.977 8.626 ( -5.838 -3.443 5.542) 8.755 18.971 ( 1.757 3.057 0.219) 3.533 18.983 ( 0.473 0.077 -0.506) 0.697 19.024 ( 1.089 -2.141 0.350) 2.428 19.071 ( 0.666 -2.278 -0.008) 2.373 19.381 ( 0.162 -0.045 -0.483) 0.511 19.437 ( -0.785 0.336 0.237) 0.886 19.476 ( -1.413 3.466 0.075) 3.744 19.531 ( -0.892 -2.606 0.090) 2.756 42.471 ( 2.410 2.434 0.210) 3.432 42.522 ( 1.793 -3.256 0.473) 3.747 42.541 ( -1.300 1.775 -0.115) 2.203 42.570 ( -0.669 -1.539 -0.134) 1.684 66.080 ( 9.822 4.861 -1.077) 11.012 66.442 ( -3.569 -9.185 2.725) 10.224 67.690 ( -3.973 6.990 -9.671) 12.576 69.029 ( -0.346 -2.386 11.099) 11.357 ======================= Grid point 259 (104/216) ======================= q-point: (-0.18 0.00 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.018 ( 20.025 -0.000 -17.950) 26.892 2.547 ( 21.088 -0.000 -5.453) 21.781 2.686 ( 14.271 -0.000 -5.466) 15.282 2.779 ( 13.467 -0.000 -11.206) 17.519 3.765 ( -20.023 -0.000 -2.719) 20.206 4.096 ( 22.320 0.000 1.189) 22.352 4.133 ( -17.938 0.000 10.270) 20.670 4.478 ( -5.082 -0.000 -3.174) 5.992 4.757 ( -20.490 -0.000 -2.660) 20.662 4.825 ( -3.701 0.000 9.341) 10.048 5.103 ( 14.339 -0.000 -11.583) 18.433 5.384 ( -0.441 -0.000 -1.289) 1.363 5.696 ( -4.105 0.000 14.195) 14.776 5.717 ( 13.368 -0.000 -8.061) 15.611 5.992 ( -1.913 -0.000 -0.077) 1.914 6.120 ( 5.767 -0.000 -0.489) 5.787 6.353 ( 8.852 0.000 1.678) 9.010 6.516 ( 3.063 0.000 5.976) 6.715 6.583 ( -5.346 0.000 5.067) 7.366 6.792 ( 11.195 0.000 3.267) 11.662 7.407 ( -3.000 -0.000 -6.302) 6.980 7.482 ( 1.323 0.000 2.148) 2.523 7.829 ( -4.722 -0.000 -8.497) 9.721 7.855 ( -2.993 -0.000 -3.471) 4.584 8.729 ( -5.540 0.000 4.346) 7.041 8.831 ( -18.349 0.000 11.791) 21.811 18.967 ( 1.052 -0.000 -0.162) 1.065 18.973 ( 1.019 -0.000 -0.484) 1.128 18.978 ( 1.925 0.000 0.772) 2.074 19.066 ( -0.583 -0.000 -0.563) 0.811 19.376 ( -0.021 -0.000 -0.257) 0.258 19.452 ( -0.793 0.000 0.369) 0.875 19.523 ( -0.459 0.000 0.091) 0.467 19.524 ( -1.555 -0.000 0.072) 1.556 42.475 ( -0.556 0.000 0.234) 0.604 42.498 ( -0.612 0.000 1.153) 1.305 42.546 ( 1.257 -0.000 -0.324) 1.298 42.561 ( 0.922 -0.000 -0.269) 0.960 65.917 ( 10.512 -0.000 -1.944) 10.690 66.527 ( -6.817 0.000 4.406) 8.116 67.696 ( -2.203 -0.000 -7.057) 7.393 69.098 ( 3.644 0.000 13.930) 14.399 ======================= Grid point 264 (105/216) ======================= q-point: ( 0.27 0.09 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.124 ( 0.000 23.475 19.930) 30.794 1.436 ( 0.000 38.243 7.496) 38.970 2.278 ( 0.000 58.492 11.657) 59.642 2.342 ( 0.000 20.845 7.459) 22.139 2.643 ( 0.000 24.997 7.314) 26.045 4.010 ( 0.000 10.092 -9.398) 13.790 4.791 ( -0.000 -5.867 6.860) 9.027 4.903 ( 0.000 14.708 -3.190) 15.050 5.028 ( 0.000 5.138 -6.582) 8.350 5.067 ( 0.000 4.475 -2.713) 5.233 5.190 ( -0.000 -16.531 3.827) 16.968 5.331 ( 0.000 10.434 5.933) 12.002 5.599 ( -0.000 -11.913 -0.225) 11.915 5.735 ( -0.000 -5.590 6.028) 8.221 6.237 ( -0.000 -4.357 -1.973) 4.783 6.253 ( 0.000 0.630 -3.011) 3.076 6.302 ( 0.000 0.265 -4.233) 4.242 6.498 ( 0.000 3.718 0.765) 3.796 6.522 ( -0.000 -8.825 -4.429) 9.874 6.708 ( -0.000 -4.923 0.391) 4.939 6.882 ( 0.000 4.580 -1.015) 4.691 7.478 ( -0.000 -11.819 5.958) 13.236 7.599 ( 0.000 -3.600 -6.578) 7.499 7.662 ( -0.000 -5.067 6.567) 8.294 8.829 ( -0.000 -10.306 -1.753) 10.454 9.385 ( 0.000 -6.535 -10.856) 12.671 18.925 ( 0.000 1.490 0.488) 1.568 18.953 ( 0.000 2.684 0.264) 2.697 19.026 ( 0.000 0.619 -0.403) 0.739 19.127 ( 0.000 0.857 -0.245) 0.891 19.399 ( 0.000 0.867 -0.008) 0.867 19.481 ( -0.000 -0.680 -0.333) 0.757 19.489 ( -0.000 -2.311 0.111) 2.314 19.548 ( -0.000 -1.977 -0.198) 1.987 42.418 ( 0.000 1.175 0.070) 1.177 42.436 ( 0.000 1.124 -0.046) 1.125 42.615 ( -0.000 -1.103 0.120) 1.110 42.642 ( -0.000 -1.064 -0.435) 1.150 65.682 ( 0.000 9.330 2.446) 9.645 67.011 ( 0.000 5.754 -11.505) 12.863 67.393 ( -0.000 -2.002 8.618) 8.847 68.718 ( 0.000 2.783 -21.829) 22.005 ======================= Grid point 265 (106/216) ======================= q-point: ( 0.36 0.09 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.543 ( -8.334 20.444 19.954) 29.759 1.907 ( -10.699 31.805 9.534) 34.884 2.558 ( 2.177 22.902 8.770) 24.620 2.967 ( -6.218 27.721 9.418) 29.930 3.049 ( -22.124 43.306 10.435) 49.737 4.098 ( -11.566 8.982 -12.118) 19.008 4.785 ( 14.201 -2.966 1.403) 14.575 4.813 ( 5.817 -4.538 0.361) 7.387 4.931 ( -0.583 -4.325 -7.459) 8.642 4.990 ( 5.734 6.527 -0.138) 8.689 5.262 ( -9.828 -8.212 0.221) 12.809 5.409 ( -0.803 2.112 0.028) 2.260 5.613 ( 1.301 -0.793 5.725) 5.925 5.745 ( -1.861 1.093 5.207) 5.636 5.946 ( 13.615 3.237 -1.305) 14.055 6.109 ( 9.313 -1.020 -1.954) 9.570 6.357 ( 4.606 -4.663 -5.244) 8.394 6.479 ( -5.142 -0.041 -2.550) 5.739 6.587 ( -3.709 2.132 -3.980) 5.843 6.687 ( -1.716 -4.654 0.340) 4.972 7.031 ( -17.880 -2.422 -3.226) 18.329 7.405 ( 4.045 -9.573 2.656) 10.726 7.504 ( -1.096 -8.001 0.419) 8.086 7.702 ( -1.745 -4.729 6.545) 8.261 8.696 ( 2.872 -11.430 -3.963) 12.433 9.186 ( 6.695 -9.405 -7.955) 14.020 18.941 ( -0.091 1.092 0.801) 1.357 18.973 ( 1.134 3.410 0.173) 3.598 19.031 ( -0.133 -0.119 0.470) 0.503 19.139 ( -0.807 2.820 -0.956) 3.085 19.403 ( 0.305 0.854 -0.166) 0.922 19.453 ( 1.610 -3.261 0.008) 3.637 19.471 ( 0.183 -0.934 -0.452) 1.054 19.537 ( -0.963 -1.951 -0.214) 2.186 42.421 ( -0.223 0.435 0.232) 0.541 42.481 ( -3.011 2.039 -0.126) 3.639 42.553 ( 4.276 -2.149 0.303) 4.795 42.675 ( -3.106 0.111 -1.080) 3.290 65.800 ( -1.390 10.561 2.784) 11.010 66.979 ( -3.847 2.314 -11.273) 12.134 67.410 ( 6.008 0.663 5.926) 8.465 68.674 ( -11.610 -2.445 -15.514) 19.530 ======================= Grid point 266 (107/216) ======================= q-point: ( 0.45 0.09 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.013 ( -11.618 17.111 18.077) 27.469 2.377 ( -8.068 25.585 10.804) 28.921 2.762 ( 3.608 19.069 8.458) 21.170 3.295 ( -2.351 16.523 7.116) 18.143 3.780 ( -17.360 34.526 4.365) 38.891 4.276 ( -12.631 5.375 -10.449) 17.251 4.473 ( 16.554 -4.726 0.483) 17.222 4.634 ( 11.891 -1.889 -0.665) 12.059 4.875 ( -6.322 -16.693 -7.831) 19.493 4.974 ( 0.610 4.906 -1.422) 5.144 5.259 ( -1.288 -9.879 5.523) 11.391 5.443 ( 9.616 -10.287 0.489) 14.090 5.587 ( -4.412 16.465 -0.764) 17.063 5.742 ( 1.827 -1.373 -3.002) 3.773 5.977 ( 0.440 -0.983 6.201) 6.294 6.037 ( 1.249 14.409 3.053) 14.782 6.189 ( 3.819 -4.490 -3.568) 6.890 6.491 ( -1.847 -6.702 -3.916) 7.979 6.620 ( -3.186 6.123 -1.681) 7.104 6.711 ( -1.811 6.549 -2.128) 7.121 7.237 ( -15.912 -6.884 -4.018) 17.797 7.267 ( 5.342 -8.339 1.408) 10.003 7.499 ( -4.953 -7.809 1.622) 9.389 7.742 ( -1.260 -4.926 7.273) 8.874 8.477 ( 7.067 -11.462 -8.152) 15.741 8.928 ( 8.470 -11.406 -3.232) 14.570 18.958 ( 0.030 1.306 0.891) 1.582 18.980 ( 1.428 2.985 0.100) 3.311 19.032 ( 0.039 -0.685 0.683) 0.968 19.185 ( -1.951 4.612 -0.899) 5.087 19.387 ( 2.290 -4.226 -0.101) 4.807 19.404 ( 0.561 0.553 -0.227) 0.820 19.456 ( 0.301 -0.817 -0.634) 1.077 19.538 ( -1.278 -1.930 -0.163) 2.321 42.440 ( -1.553 -0.506 0.379) 1.677 42.477 ( 3.131 -1.485 0.642) 3.525 42.541 ( -2.114 2.304 -0.263) 3.138 42.700 ( -1.084 0.716 -1.806) 2.225 65.928 ( -1.083 10.065 1.920) 10.304 66.986 ( -6.437 -1.457 -7.728) 10.163 67.320 ( 10.025 3.777 -0.344) 10.719 68.740 ( -13.061 -6.278 -7.339) 16.244 ======================= Grid point 267 (108/216) ======================= q-point: ( 0.55 0.09 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.459 ( -11.283 14.078 15.066) 23.505 2.753 ( -4.444 21.699 10.331) 24.440 2.890 ( 6.613 15.578 6.901) 18.276 3.384 ( 5.402 4.598 0.609) 7.120 3.973 ( 15.156 0.182 -6.864) 16.639 4.235 ( 9.418 10.828 -2.022) 14.492 4.425 ( 1.730 0.052 -3.972) 4.333 4.520 ( -2.265 4.572 8.222) 9.677 4.819 ( -8.121 -8.763 -4.594) 12.801 4.913 ( 18.423 -11.063 -3.497) 21.772 5.072 ( -4.376 -2.193 -1.673) 5.173 5.442 ( -5.292 -3.292 2.703) 6.793 5.656 ( 2.687 4.920 -4.583) 7.241 5.818 ( -4.574 11.596 -0.233) 12.468 5.994 ( -4.923 -6.400 -1.730) 8.257 6.090 ( -2.470 -1.508 10.010) 10.420 6.267 ( -1.430 10.496 3.120) 11.043 6.421 ( -1.320 -5.314 -3.057) 6.272 6.741 ( -6.444 5.385 -2.830) 8.861 6.843 ( -6.360 13.331 0.536) 14.780 7.134 ( 3.425 -9.633 2.676) 10.569 7.348 ( -11.250 -5.894 -3.861) 13.275 7.546 ( -6.486 -2.204 -2.893) 7.436 7.760 ( 0.959 -6.880 6.555) 9.551 8.169 ( 9.796 -10.822 -9.882) 17.627 8.716 ( 5.681 -9.834 0.822) 11.387 18.972 ( 1.217 2.670 0.467) 2.972 18.984 ( 0.375 1.236 0.369) 1.343 19.031 ( 0.052 -0.521 0.574) 0.777 19.254 ( -2.288 5.148 -0.585) 5.664 19.306 ( 2.751 -5.139 -0.022) 5.829 19.399 ( 0.449 0.562 -0.459) 0.853 19.441 ( 0.172 -0.597 -0.555) 0.833 19.540 ( -1.258 -2.052 -0.102) 2.409 42.427 ( 1.053 -0.117 0.426) 1.142 42.490 ( -3.098 -1.017 0.806) 3.359 42.570 ( 0.528 1.921 -0.396) 2.031 42.688 ( 1.267 0.440 -1.851) 2.286 66.022 ( 0.162 8.524 0.613) 8.547 66.975 ( -0.411 -13.120 0.327) 13.130 67.229 ( 2.655 14.304 -9.438) 17.342 68.841 ( -11.069 -6.570 -0.764) 12.894 ======================= Grid point 268 (109/216) ======================= q-point: ( 0.64 0.09 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.792 ( -2.381 12.045 10.179) 15.949 2.906 ( 12.197 10.342 5.723) 16.984 3.068 ( -5.130 18.097 5.955) 19.730 3.276 ( 7.884 -0.895 -2.547) 8.334 3.625 ( 15.376 -3.132 -4.114) 16.222 4.023 ( 16.702 -0.553 -1.493) 16.777 4.378 ( -1.410 -7.074 -5.866) 9.297 4.395 ( 20.590 -1.225 -6.996) 21.781 4.732 ( -3.212 -3.299 7.498) 8.799 4.864 ( -2.326 -5.768 -4.184) 7.496 5.172 ( -7.685 4.724 5.212) 10.418 5.471 ( 2.372 -0.579 -0.922) 2.610 5.626 ( -3.322 4.275 -3.371) 6.378 5.955 ( -0.666 6.301 2.214) 6.712 6.054 ( -1.172 1.464 -0.367) 1.911 6.172 ( -7.662 -10.386 4.803) 13.771 6.367 ( 1.446 8.155 2.914) 8.780 6.430 ( -2.660 0.133 0.615) 2.734 6.764 ( 3.124 -5.333 -0.336) 6.190 7.043 ( -3.909 10.797 -1.552) 11.587 7.164 ( -14.525 -4.312 -0.589) 15.163 7.503 ( -13.698 3.315 -2.700) 14.350 7.568 ( 1.314 0.969 -5.454) 5.693 7.690 ( 1.134 -7.057 4.721) 8.565 7.919 ( 2.465 -8.606 -5.003) 10.255 8.614 ( 1.375 -5.479 3.085) 6.436 18.974 ( 1.812 3.246 0.117) 3.719 18.991 ( 0.098 0.201 0.348) 0.413 19.033 ( -0.025 -0.125 0.489) 0.506 19.218 ( 2.786 -5.449 0.035) 6.120 19.329 ( -2.307 4.941 -0.305) 5.461 19.391 ( 0.399 0.220 -0.636) 0.782 19.434 ( -0.174 -0.112 -0.208) 0.293 19.540 ( -1.144 -2.224 -0.024) 2.502 42.440 ( -1.456 1.474 0.345) 2.100 42.535 ( -3.116 -1.554 0.586) 3.532 42.551 ( 3.063 1.492 -0.330) 3.423 42.643 ( 2.691 -0.682 -1.213) 3.030 66.082 ( 1.131 8.146 0.044) 8.224 66.790 ( 6.751 -16.533 1.209) 17.899 67.318 ( -6.346 14.690 -10.221) 18.988 68.955 ( -8.319 -4.910 3.658) 10.329 ======================= Grid point 269 (110/216) ======================= q-point: (-0.27 0.09 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.692 ( 22.362 2.863 -6.443) 23.447 2.878 ( 9.815 9.232 3.661) 13.963 3.116 ( 9.110 -0.816 -1.512) 9.270 3.181 ( 8.961 4.679 3.765) 10.787 3.616 ( -7.574 9.071 7.478) 13.985 3.776 ( 9.744 -4.697 -2.390) 11.078 4.039 ( 5.972 -2.948 -10.326) 12.287 4.361 ( -7.867 -8.551 -4.019) 12.295 4.691 ( 6.648 -8.208 -8.787) 13.739 4.804 ( 0.572 -0.383 9.986) 10.010 5.380 ( 1.561 -0.083 -0.382) 1.609 5.460 ( -7.164 9.098 7.689) 13.901 5.736 ( -1.939 2.230 0.740) 3.046 5.898 ( 5.144 -11.764 5.979) 14.164 6.018 ( 7.038 5.300 -3.812) 9.600 6.299 ( -9.520 -0.841 -0.854) 9.595 6.339 ( 9.057 6.603 -2.167) 11.416 6.444 ( -3.331 -7.001 -2.470) 8.137 6.693 ( 4.598 0.784 6.798) 8.244 7.182 ( -5.315 5.071 -2.845) 7.878 7.250 ( 3.878 -0.741 -1.641) 4.276 7.407 ( 0.241 -2.899 1.317) 3.193 7.647 ( -5.335 0.602 -6.585) 8.496 7.822 ( -1.616 -6.540 -2.686) 7.252 7.993 ( -26.003 7.699 4.638) 27.512 8.625 ( -2.249 -1.775 4.222) 5.102 18.974 ( 1.793 3.190 0.082) 3.660 18.988 ( 0.512 -0.010 -0.007) 0.512 19.037 ( -0.022 -0.008 0.375) 0.375 19.133 ( 2.446 -5.140 0.051) 5.693 19.379 ( 0.048 0.066 -0.451) 0.459 19.401 ( -1.839 3.645 -0.224) 4.089 19.442 ( -0.612 0.810 0.079) 1.018 19.538 ( -1.008 -2.400 0.046) 2.603 42.489 ( -1.828 2.235 0.141) 2.891 42.508 ( 3.174 1.662 -0.100) 3.584 42.564 ( -1.867 -1.829 0.195) 2.620 42.582 ( 2.512 -2.207 -0.275) 3.355 66.121 ( 3.917 9.338 0.054) 10.126 66.568 ( 3.551 -17.027 0.905) 17.416 67.454 ( -6.902 10.783 -8.668) 15.461 69.073 ( -5.575 -2.463 6.350) 8.801 ======================= Grid point 270 (111/216) ======================= q-point: (-0.18 0.09 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.240 ( 24.037 -1.931 -13.071) 27.429 2.751 ( 17.848 9.806 0.190) 20.366 2.917 ( 14.949 0.961 -3.275) 15.334 3.008 ( 16.904 -6.133 1.370) 18.034 3.592 ( -0.362 -4.928 -3.893) 6.290 3.909 ( -16.376 2.494 8.737) 18.728 4.150 ( -15.517 11.540 -2.817) 19.542 4.420 ( -15.047 -13.445 -3.338) 20.453 4.442 ( 8.787 -4.095 -7.613) 12.327 4.887 ( 2.358 6.715 9.344) 11.746 5.342 ( 0.898 0.554 -3.855) 3.997 5.448 ( 18.838 -14.675 -2.573) 24.018 5.734 ( -5.659 1.029 14.681) 15.767 5.847 ( 11.756 0.874 -5.648) 13.071 5.949 ( -4.282 1.648 2.574) 5.261 6.200 ( 9.477 5.211 -2.741) 11.158 6.369 ( -1.664 -0.378 -6.551) 6.770 6.501 ( -8.546 -0.217 2.248) 8.840 6.679 ( 6.760 -0.153 8.677) 11.001 7.029 ( 13.535 -2.929 1.839) 13.970 7.306 ( -1.493 7.165 -2.918) 7.879 7.473 ( -5.533 -1.923 1.233) 5.986 7.675 ( -5.502 0.898 -7.668) 9.480 7.792 ( -2.869 -3.304 -2.971) 5.289 8.514 ( -26.177 6.240 6.361) 27.652 8.702 ( -4.697 -1.058 3.650) 6.042 18.974 ( 1.526 2.788 -0.027) 3.178 18.977 ( 0.950 0.347 -0.106) 1.016 19.031 ( 0.998 -1.836 0.563) 2.164 19.068 ( 1.009 -2.572 -0.409) 2.793 19.374 ( -0.010 -0.106 -0.284) 0.304 19.440 ( -1.033 0.477 0.117) 1.144 19.477 ( -1.460 3.303 0.053) 3.612 19.532 ( -0.879 -2.547 0.072) 2.695 42.474 ( 2.188 2.429 0.184) 3.275 42.530 ( 1.028 -3.142 0.522) 3.347 42.539 ( -1.043 1.639 -0.114) 1.946 42.568 ( -0.404 -1.528 -0.175) 1.590 66.067 ( 10.974 4.412 -0.536) 11.840 66.480 ( -5.785 -9.147 1.866) 10.983 67.556 ( -5.431 5.610 -6.533) 10.181 69.187 ( -3.142 -0.390 7.924) 8.533 ======================= Grid point 271 (112/216) ======================= q-point: (-0.09 0.09 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.744 ( 24.427 -0.000 -13.764) 28.038 2.476 ( 24.696 -0.000 -3.076) 24.887 2.629 ( 17.730 -0.000 -6.758) 18.974 2.645 ( 19.881 0.000 -0.522) 19.888 3.730 ( -21.249 -0.000 -1.499) 21.302 4.120 ( 27.312 0.000 2.020) 27.386 4.293 ( -17.372 0.000 8.916) 19.527 4.415 ( -12.421 -0.000 -4.667) 13.268 4.688 ( -32.187 -0.000 -4.961) 32.567 4.962 ( 5.204 0.000 6.412) 8.258 4.963 ( 20.024 -0.000 -5.271) 20.706 5.342 ( -0.676 -0.000 -3.028) 3.103 5.619 ( 11.322 -0.000 -3.847) 11.958 5.932 ( -2.987 0.000 14.170) 14.481 5.982 ( 0.945 -0.000 -0.964) 1.350 6.127 ( 1.740 0.000 1.017) 2.015 6.306 ( 2.614 -0.000 -6.523) 7.027 6.633 ( 6.129 0.000 6.799) 9.154 6.647 ( -6.238 0.000 2.710) 6.801 6.824 ( 12.564 0.000 0.695) 12.583 7.325 ( -1.640 -0.000 -3.541) 3.903 7.530 ( -0.406 0.000 3.341) 3.365 7.707 ( -5.110 -0.000 -5.916) 7.817 7.791 ( -1.736 -0.000 -3.926) 4.293 8.786 ( -4.460 0.000 2.463) 5.095 8.984 ( -22.667 0.000 6.694) 23.634 18.962 ( 0.827 -0.000 -0.315) 0.885 18.970 ( 1.365 0.000 -0.018) 1.365 18.993 ( 1.847 0.000 0.933) 2.069 19.053 ( -0.157 -0.000 -0.934) 0.947 19.374 ( -0.149 -0.000 -0.064) 0.162 19.457 ( -0.900 0.000 0.180) 0.918 19.524 ( -0.383 0.000 0.058) 0.388 19.525 ( -1.638 -0.000 0.039) 1.638 42.479 ( -0.637 0.000 0.161) 0.657 42.516 ( -0.947 0.000 0.977) 1.361 42.541 ( 1.336 -0.000 -0.215) 1.353 42.556 ( 1.003 -0.000 -0.349) 1.062 65.895 ( 11.320 -0.000 -0.849) 11.352 66.582 ( -8.401 0.000 2.301) 8.710 67.607 ( -3.675 -0.000 -3.825) 5.305 69.289 ( -1.309 0.000 8.784) 8.882 ======================= Grid point 272 (113/216) ======================= q-point: ( 0.00 0.18 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 216 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.624 ( 26.768 0.000 -0.000) 26.768 2.450 ( 26.463 0.000 -0.000) 26.463 2.572 ( 18.962 0.000 -0.000) 18.962 2.644 ( 22.280 0.000 -0.000) 22.280 3.718 ( -21.725 -0.000 0.000) 21.725 4.146 ( 27.603 0.000 -0.000) 27.603 4.362 ( -12.414 -0.000 0.000) 12.414 4.383 ( -13.991 -0.000 0.000) 13.991 4.631 ( -37.837 -0.000 0.000) 37.837 4.924 ( 20.428 0.000 -0.000) 20.428 5.017 ( 7.363 0.000 -0.000) 7.363 5.313 ( -0.476 -0.000 0.000) 0.476 5.588 ( 9.482 0.000 -0.000) 9.482 5.972 ( 1.828 0.000 -0.000) 1.828 6.117 ( -1.119 -0.000 0.000) 1.119 6.138 ( 0.894 0.000 -0.000) 0.894 6.183 ( -0.619 -0.000 0.000) 0.619 6.669 ( -6.726 -0.000 0.000) 6.726 6.697 ( 6.315 0.000 -0.000) 6.315 6.825 ( 13.543 0.000 -0.000) 13.543 7.296 ( -0.942 -0.000 0.000) 0.942 7.565 ( -1.680 -0.000 0.000) 1.680 7.656 ( -5.326 -0.000 0.000) 5.326 7.751 ( -0.725 -0.000 0.000) 0.725 8.806 ( -4.053 -0.000 0.000) 4.053 9.040 ( -24.476 -0.000 0.000) 24.476 18.959 ( 0.874 0.000 -0.000) 0.874 18.970 ( 1.361 0.000 -0.000) 1.361 19.003 ( 1.790 0.000 -0.000) 1.790 19.042 ( 0.069 0.000 -0.000) 0.069 19.373 ( -0.215 -0.000 0.000) 0.215 19.458 ( -0.938 -0.000 0.000) 0.938 19.524 ( -0.358 -0.000 0.000) 0.358 19.525 ( -1.666 -0.000 0.000) 1.666 42.480 ( -0.677 -0.000 0.000) 0.677 42.526 ( -1.302 -0.000 0.000) 1.302 42.539 ( 1.375 0.000 -0.000) 1.375 42.552 ( 1.233 0.000 -0.000) 1.233 65.888 ( 11.596 0.000 -0.000) 11.596 66.600 ( -8.930 -0.000 0.000) 8.930 67.575 ( -4.195 -0.000 0.000) 4.195 69.364 ( -3.678 -0.000 0.000) 3.678 ======================= Grid point 276 (114/216) ======================= q-point: ( 0.36 0.18 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.501 ( -0.000 17.525 24.582) 30.189 1.609 ( 0.000 33.744 13.488) 36.339 2.483 ( 0.000 22.133 8.794) 23.816 2.555 ( 0.000 46.732 21.657) 51.506 2.839 ( 0.000 22.783 16.857) 28.341 3.812 ( 0.000 10.102 -14.323) 17.527 4.824 ( 0.000 14.238 -5.960) 15.435 4.862 ( 0.000 -2.708 -13.018) 13.297 4.930 ( -0.000 -4.585 9.061) 10.155 5.046 ( 0.000 1.116 -0.081) 1.119 5.219 ( -0.000 -13.675 -0.479) 13.683 5.420 ( -0.000 1.649 4.054) 4.377 5.613 ( 0.000 3.680 2.406) 4.396 5.841 ( -0.000 -6.752 5.078) 8.448 6.186 ( 0.000 -4.857 -4.430) 6.573 6.190 ( 0.000 5.343 -4.461) 6.960 6.217 ( 0.000 -0.216 -4.937) 4.942 6.414 ( 0.000 -5.805 -8.480) 10.276 6.530 ( -0.000 0.297 3.276) 3.290 6.706 ( -0.000 -6.485 -0.563) 6.510 6.876 ( -0.000 -0.230 0.268) 0.353 7.433 ( 0.000 0.094 -11.188) 11.189 7.627 ( -0.000 -13.751 9.538) 16.735 7.798 ( -0.000 -3.428 9.487) 10.087 8.790 ( -0.000 -11.388 -2.956) 11.765 9.193 ( 0.000 -0.718 -11.555) 11.577 18.935 ( 0.000 2.173 0.758) 2.302 18.961 ( 0.000 1.977 0.684) 2.092 19.017 ( 0.000 2.571 -0.637) 2.648 19.121 ( -0.000 -0.684 -0.580) 0.897 19.400 ( 0.000 0.482 0.086) 0.489 19.473 ( -0.000 -0.779 -0.619) 0.995 19.492 ( -0.000 -2.304 0.211) 2.314 19.543 ( -0.000 -2.005 -0.369) 2.038 42.420 ( 0.000 1.219 0.125) 1.225 42.435 ( 0.000 1.160 -0.081) 1.163 42.618 ( -0.000 -1.103 0.205) 1.122 42.635 ( -0.000 -1.180 -0.335) 1.227 65.738 ( 0.000 8.973 4.312) 9.955 66.812 ( 0.000 4.545 -12.598) 13.393 67.523 ( -0.000 -0.560 7.252) 7.274 68.353 ( 0.000 12.322 -20.331) 23.774 ======================= Grid point 277 (115/216) ======================= q-point: ( 0.45 0.18 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.897 ( -7.739 14.765 22.426) 27.943 2.097 ( -11.339 28.490 13.486) 33.498 2.716 ( 2.071 22.120 10.108) 24.408 3.166 ( -3.119 24.809 14.312) 28.810 3.270 ( -16.796 35.166 16.119) 42.173 3.887 ( -13.112 10.561 -12.950) 21.241 4.660 ( 2.342 -7.539 -15.466) 17.364 4.751 ( 13.814 3.159 -4.534) 14.878 4.937 ( -0.620 -4.990 0.829) 5.097 5.002 ( 4.327 -2.145 5.360) 7.215 5.274 ( -11.010 -6.123 0.715) 12.619 5.421 ( 1.564 3.660 1.181) 4.152 5.668 ( 8.014 3.811 -0.555) 8.891 5.803 ( 0.910 -9.657 1.625) 9.835 5.970 ( 6.833 10.948 5.120) 13.884 6.070 ( 6.222 -0.280 -2.591) 6.746 6.253 ( 3.702 -1.032 -7.727) 8.630 6.417 ( -8.611 -2.193 -4.556) 9.986 6.533 ( 1.432 3.704 -2.246) 4.562 6.688 ( -1.252 -6.077 -0.082) 6.205 6.990 ( -15.912 -3.795 -1.681) 16.445 7.335 ( 0.688 -1.943 -8.854) 9.091 7.592 ( -0.768 -14.255 8.565) 16.648 7.845 ( 0.443 -3.579 9.755) 10.400 8.617 ( 5.319 -12.600 -5.384) 14.698 9.051 ( 3.958 -5.828 -8.231) 10.834 18.956 ( 0.255 1.768 1.035) 2.065 18.978 ( 1.031 2.660 0.451) 2.888 19.037 ( -0.362 1.019 0.293) 1.120 19.122 ( -1.007 2.041 -1.153) 2.551 19.401 ( 0.303 0.405 -0.108) 0.518 19.451 ( 1.315 -2.684 -0.241) 2.999 19.463 ( 0.600 -1.575 -0.418) 1.736 19.533 ( -1.134 -1.999 -0.300) 2.318 42.426 ( -0.410 0.542 0.315) 0.749 42.478 ( -2.897 1.978 -0.160) 3.511 42.559 ( 4.078 -2.026 0.404) 4.572 42.657 ( -2.040 0.152 -0.974) 2.266 65.858 ( -0.465 9.716 4.221) 10.603 66.788 ( -5.190 3.808 -12.106) 13.711 67.489 ( 9.477 -0.559 3.842) 10.241 68.432 ( -16.305 3.645 -13.027) 21.186 ======================= Grid point 278 (116/216) ======================= q-point: ( 0.55 0.18 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.320 ( -10.410 11.994 18.762) 24.581 2.563 ( -6.057 24.983 11.600) 28.203 2.931 ( 2.271 14.882 12.168) 19.357 3.393 ( 2.289 10.871 3.666) 11.699 3.855 ( -8.579 26.676 3.889) 28.290 4.140 ( -11.624 8.741 -5.454) 15.533 4.451 ( 10.945 1.823 -5.463) 12.368 4.570 ( -6.512 -6.755 -3.960) 10.184 4.840 ( 10.175 -11.408 3.746) 15.739 4.946 ( -0.806 2.429 -1.859) 3.163 5.323 ( 11.814 -6.763 0.483) 13.622 5.415 ( -2.514 -2.229 -2.140) 3.983 5.588 ( -1.465 6.559 0.868) 6.776 5.693 ( 0.180 -2.601 -2.938) 3.928 6.018 ( 1.937 -3.058 -1.434) 3.894 6.121 ( 0.174 3.886 3.780) 5.424 6.150 ( -1.753 11.856 1.479) 12.075 6.421 ( -3.329 -8.669 -4.454) 10.299 6.571 ( -3.007 8.357 -3.380) 9.503 6.708 ( -2.429 5.798 1.425) 6.446 7.170 ( -14.346 -6.603 -3.643) 16.207 7.247 ( 0.313 -3.784 -4.180) 5.647 7.547 ( -0.923 -13.214 4.877) 14.116 7.880 ( 0.709 -4.445 8.535) 9.649 8.335 ( 9.968 -11.775 -8.691) 17.707 8.866 ( 4.893 -8.474 -4.211) 10.653 18.972 ( 1.234 2.926 0.558) 3.224 18.985 ( 0.488 1.253 0.748) 1.539 19.042 ( 0.174 -0.437 0.492) 0.681 19.170 ( -2.316 4.718 -0.944) 5.340 19.384 ( 2.007 -3.746 -0.168) 4.253 19.401 ( 0.828 -0.330 -0.100) 0.897 19.444 ( 0.220 -0.843 -0.793) 1.178 19.535 ( -1.396 -1.983 -0.182) 2.432 42.447 ( -1.264 -0.452 0.466) 1.421 42.488 ( 2.677 -1.212 0.706) 3.022 42.536 ( -2.041 2.100 -0.308) 2.945 42.671 ( -0.493 0.913 -1.653) 1.952 65.966 ( 0.203 8.475 2.738) 8.909 66.839 ( -8.504 4.888 -9.871) 13.916 67.319 ( 11.808 -3.237 0.159) 12.244 68.632 ( -16.957 -1.028 -5.533) 17.866 ======================= Grid point 279 (117/216) ======================= q-point: ( 0.64 0.18 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.702 ( -8.976 9.944 13.861) 19.277 2.881 ( 0.091 24.232 6.164) 25.004 3.083 ( 5.248 8.119 15.829) 18.548 3.366 ( 6.363 1.848 -2.673) 7.145 3.843 ( 14.567 -1.303 -8.481) 16.906 4.241 ( 7.179 10.721 0.703) 12.922 4.298 ( 5.361 1.265 -9.560) 11.034 4.650 ( 8.809 0.340 5.792) 10.548 4.780 ( -9.271 -6.978 -1.174) 11.663 4.856 ( 8.340 -6.156 -2.798) 10.737 5.095 ( -1.771 0.349 5.929) 6.197 5.467 ( -3.238 0.875 0.091) 3.355 5.581 ( 3.863 0.187 -4.106) 5.641 5.807 ( -7.562 8.300 -1.127) 11.285 5.936 ( -4.188 -2.283 -5.347) 7.166 6.257 ( -4.868 -2.375 8.649) 10.205 6.309 ( -1.515 9.884 1.938) 10.186 6.386 ( -4.852 -3.074 -0.145) 5.745 6.697 ( -7.345 6.239 -2.225) 9.891 6.856 ( -6.351 8.806 1.052) 10.908 7.179 ( 1.296 -9.387 2.489) 9.798 7.272 ( -10.723 -3.768 -5.034) 12.431 7.490 ( -1.597 -4.825 -3.675) 6.272 7.874 ( 2.592 -6.798 6.265) 9.601 8.020 ( 8.567 -9.890 -7.639) 15.151 8.714 ( 3.228 -6.921 -0.938) 7.695 18.976 ( 1.883 3.477 0.071) 3.955 18.995 ( 0.072 0.271 0.879) 0.923 19.039 ( 0.180 -0.287 0.369) 0.501 19.245 ( -2.557 5.299 -0.512) 5.906 19.306 ( 2.720 -5.129 -0.027) 5.805 19.392 ( 0.433 0.076 -0.432) 0.617 19.431 ( -0.088 -0.449 -0.542) 0.709 19.538 ( -1.348 -2.072 -0.094) 2.474 42.434 ( 1.130 0.030 0.436) 1.211 42.503 ( -2.896 -0.899 0.773) 3.129 42.563 ( 0.394 1.628 -0.395) 1.721 42.660 ( 1.154 0.758 -1.569) 2.090 66.035 ( 0.774 6.910 0.966) 7.020 66.951 ( -8.122 -0.743 -4.167) 9.159 67.106 ( 9.028 0.314 -4.309) 10.009 68.831 ( -13.538 -2.108 -0.410) 13.708 ======================= Grid point 280 (118/216) ======================= q-point: ( 0.73 0.18 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.899 ( 7.688 6.382 1.537) 10.109 3.005 ( 13.843 15.524 7.807) 22.216 3.189 ( -3.366 0.077 3.484) 4.845 3.277 ( 8.867 9.223 7.510) 14.835 3.572 ( 7.571 2.227 -2.612) 8.313 4.000 ( 18.986 0.213 -1.456) 19.042 4.222 ( 9.300 -11.663 -9.527) 17.700 4.272 ( 6.769 -1.612 -9.881) 12.085 4.799 ( 1.945 -10.238 -2.509) 10.718 4.881 ( -3.164 0.171 9.333) 9.856 5.316 ( -8.211 9.051 9.013) 15.185 5.426 ( 5.123 -1.686 -2.210) 5.828 5.599 ( -7.065 7.151 -0.045) 10.053 5.959 ( -2.302 8.127 -0.769) 8.482 5.993 ( -6.687 1.572 -6.752) 9.632 6.258 ( -2.726 -11.454 3.951) 12.419 6.383 ( 5.409 9.124 -0.383) 10.613 6.500 ( -1.925 -7.424 7.796) 10.936 6.761 ( -0.089 -2.014 -0.228) 2.029 7.028 ( -6.002 6.817 -0.769) 9.115 7.140 ( -7.521 -4.674 -1.927) 9.062 7.453 ( -7.243 6.338 -4.304) 10.543 7.477 ( -10.703 0.650 -3.757) 11.362 7.769 ( 4.277 -6.950 4.230) 9.192 7.850 ( -0.914 -8.733 -3.403) 9.417 8.651 ( 0.071 -2.673 1.591) 3.112 18.975 ( 1.810 3.252 0.022) 3.722 18.998 ( 0.515 0.075 0.404) 0.659 19.040 ( 0.069 0.063 0.340) 0.353 19.219 ( 2.749 -5.435 0.029) 6.091 19.325 ( -2.483 5.043 -0.226) 5.626 19.381 ( 0.280 -0.150 -0.513) 0.603 19.431 ( -0.439 0.023 -0.175) 0.473 19.540 ( -1.211 -2.207 -0.017) 2.517 42.445 ( -1.223 1.569 0.279) 2.008 42.544 ( -1.943 -1.072 0.374) 2.250 42.547 ( 1.926 0.813 -0.139) 2.096 42.625 ( 2.110 -0.397 -0.905) 2.330 66.083 ( 1.024 7.403 0.152) 7.475 66.808 ( 7.313 -16.807 0.901) 18.351 67.171 ( -8.306 12.652 -7.418) 16.855 69.006 ( -9.988 -1.527 2.457) 10.399 ======================= Grid point 281 (119/216) ======================= q-point: (-0.18 0.18 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.564 ( 25.276 -2.581 -6.932) 26.336 2.957 ( 15.771 9.165 4.108) 18.697 3.117 ( 15.361 6.252 1.185) 16.627 3.280 ( 11.440 5.031 8.017) 14.848 3.705 ( 1.327 4.227 -1.092) 4.562 3.761 ( -1.945 1.536 1.801) 3.064 3.860 ( 1.045 -7.325 -6.790) 10.042 4.239 ( -11.585 -11.285 -10.068) 19.050 4.618 ( 7.578 -7.734 -1.129) 10.887 4.975 ( 1.408 -0.376 10.391) 10.493 5.290 ( 1.364 1.987 -7.616) 7.989 5.639 ( -3.704 8.247 10.178) 13.613 5.764 ( -4.438 4.009 3.150) 6.760 5.954 ( 7.810 3.621 -1.607) 8.757 5.972 ( 1.733 -8.020 -0.334) 8.212 6.259 ( 3.646 -4.214 -2.500) 6.107 6.319 ( 2.526 1.704 -0.345) 3.066 6.399 ( -3.976 -6.954 -2.921) 8.526 6.802 ( 2.339 3.781 5.760) 7.277 7.155 ( -3.305 3.455 -0.780) 4.845 7.214 ( 0.212 7.771 -2.464) 8.155 7.435 ( 0.036 -3.335 1.987) 3.882 7.551 ( -3.873 -4.614 -4.886) 7.757 7.782 ( -1.872 -7.365 -2.047) 7.870 8.048 ( -29.072 7.040 2.194) 29.993 8.679 ( -2.124 0.372 2.312) 3.161 18.974 ( 1.664 2.968 0.003) 3.403 18.989 ( 0.917 0.206 0.079) 0.943 19.042 ( 0.088 0.115 0.226) 0.268 19.134 ( 2.486 -5.216 0.002) 5.778 19.373 ( 0.004 -0.193 -0.274) 0.335 19.398 ( -2.097 3.817 -0.115) 4.357 19.442 ( -0.782 0.813 0.022) 1.129 19.538 ( -1.037 -2.362 0.029) 2.580 42.492 ( -1.918 2.240 0.124) 2.951 42.506 ( 3.228 1.630 -0.093) 3.618 42.567 ( -1.531 -1.836 0.121) 2.393 42.579 ( 1.794 -2.111 -0.140) 2.774 66.122 ( 4.071 9.378 0.032) 10.223 66.580 ( 2.741 -17.798 0.602) 18.017 67.342 ( -7.911 9.459 -4.850) 13.251 69.154 ( -7.164 -0.306 3.484) 7.972 ======================= Grid point 282 (120/216) ======================= q-point: (-0.09 0.18 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.078 ( 26.750 -3.201 -5.606) 27.517 2.757 ( 19.984 6.941 0.213) 21.157 2.878 ( 22.231 7.722 -1.226) 23.566 3.049 ( 20.904 -10.085 2.268) 23.320 3.541 ( -2.153 -2.890 -1.985) 4.114 4.041 ( -20.742 1.580 5.561) 21.533 4.090 ( -17.120 11.741 -1.428) 20.808 4.277 ( -15.863 -10.645 -7.704) 20.598 4.446 ( 7.607 -7.391 1.097) 10.663 5.009 ( 5.032 6.733 4.728) 9.645 5.278 ( -2.663 1.360 -2.997) 4.234 5.417 ( 22.110 -16.728 -1.050) 27.745 5.780 ( 12.555 0.659 -2.078) 12.742 5.966 ( -6.162 2.260 12.276) 13.921 5.981 ( -1.394 2.030 1.029) 2.668 6.164 ( 4.883 5.012 -2.988) 7.609 6.244 ( 0.507 -2.462 -6.807) 7.256 6.523 ( -10.360 0.387 0.569) 10.383 6.791 ( 6.855 1.167 4.134) 8.090 7.041 ( 12.861 -1.628 0.007) 12.964 7.276 ( 0.386 6.783 -0.869) 6.849 7.501 ( -6.567 -2.257 1.738) 7.158 7.575 ( -5.957 0.587 -4.008) 7.204 7.751 ( -2.082 -3.839 -1.639) 4.664 8.585 ( -29.862 4.521 2.260) 30.287 8.742 ( -3.151 0.985 1.243) 3.527 18.971 ( 1.042 1.045 -0.098) 1.479 18.978 ( 1.558 2.017 0.062) 2.550 19.041 ( 0.462 -0.631 0.530) 0.944 19.059 ( 1.752 -3.704 -0.492) 4.126 19.371 ( -0.147 -0.133 -0.090) 0.218 19.441 ( -1.167 0.551 0.034) 1.291 19.478 ( -1.494 3.208 0.018) 3.539 19.533 ( -0.871 -2.510 0.028) 2.657 42.476 ( 2.064 2.381 0.074) 3.152 42.536 ( -0.383 -0.255 0.152) 0.485 42.538 ( -0.067 -1.251 0.058) 1.254 42.565 ( -0.151 -1.487 -0.108) 1.499 66.062 ( 11.480 4.277 -0.148) 12.251 66.501 ( -6.911 -9.293 0.663) 11.600 67.483 ( -6.200 5.074 -2.318) 8.340 69.277 ( -5.197 0.578 2.906) 5.982 ======================= Grid point 288 (121/216) ======================= q-point: ( 0.45 0.27 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.865 ( 0.000 28.181 17.663) 33.259 1.895 ( -0.000 16.437 23.280) 28.498 2.616 ( 0.000 24.183 7.375) 25.282 2.951 ( 0.000 30.155 25.657) 39.593 3.172 ( -0.000 20.170 23.040) 30.621 3.556 ( 0.000 11.877 -16.591) 20.404 4.619 ( 0.000 -12.240 -16.421) 20.481 4.700 ( 0.000 14.891 -9.302) 17.558 5.065 ( -0.000 -4.964 5.436) 7.362 5.066 ( -0.000 -0.615 2.612) 2.683 5.206 ( -0.000 -7.248 1.424) 7.386 5.446 ( 0.000 -0.878 -1.004) 1.334 5.670 ( 0.000 11.840 3.586) 12.371 5.833 ( 0.000 -3.574 -6.814) 7.694 6.114 ( 0.000 10.651 -4.775) 11.672 6.122 ( -0.000 -6.710 -3.464) 7.551 6.166 ( 0.000 0.678 -0.366) 0.771 6.269 ( 0.000 -4.874 -8.207) 9.545 6.601 ( -0.000 -3.334 5.126) 6.115 6.696 ( -0.000 -7.462 -0.514) 7.479 6.882 ( -0.000 -3.284 0.152) 3.287 7.234 ( 0.000 2.003 -12.514) 12.673 7.790 ( -0.000 -14.312 10.012) 17.467 7.952 ( -0.000 -2.304 8.891) 9.184 8.739 ( -0.000 -12.586 -2.939) 12.925 9.025 ( 0.000 -0.105 -8.999) 8.999 18.947 ( 0.000 3.128 0.697) 3.205 18.977 ( -0.000 0.972 1.312) 1.633 19.006 ( 0.000 3.556 -0.746) 3.633 19.108 ( 0.000 -1.098 -0.999) 1.485 19.403 ( -0.000 -0.062 0.273) 0.280 19.461 ( 0.000 -0.906 -0.820) 1.222 19.496 ( -0.000 -2.285 0.313) 2.307 19.536 ( -0.000 -2.049 -0.490) 2.106 42.422 ( 0.000 1.273 0.156) 1.283 42.433 ( 0.000 1.213 -0.104) 1.217 42.622 ( -0.000 -1.117 0.233) 1.141 42.631 ( -0.000 -1.335 -0.131) 1.342 65.821 ( 0.000 8.421 5.868) 10.263 66.606 ( 0.000 4.492 -12.571) 13.349 67.627 ( -0.000 0.092 5.566) 5.567 68.085 ( 0.000 11.619 -12.606) 17.144 ======================= Grid point 289 (122/216) ======================= q-point: ( 0.55 0.27 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.249 ( -6.351 12.908 20.181) 24.784 2.340 ( -10.196 24.108 16.201) 30.783 2.877 ( -1.079 21.322 9.311) 23.292 3.361 ( 1.364 15.449 4.352) 16.108 3.533 ( -8.996 25.789 14.039) 30.710 3.748 ( -17.491 17.174 1.550) 24.562 4.378 ( -3.893 -14.742 -18.040) 23.620 4.668 ( 10.746 11.411 -6.465) 16.956 4.920 ( 4.221 -1.963 -0.321) 4.666 5.130 ( 5.912 -6.512 7.923) 11.838 5.279 ( -10.051 -1.635 0.042) 10.184 5.438 ( 1.994 2.399 0.482) 3.157 5.598 ( 7.500 1.794 -6.101) 9.833 5.813 ( 2.325 -8.392 -0.940) 8.759 6.020 ( 0.950 1.336 -2.223) 2.762 6.085 ( 4.654 11.336 6.108) 13.692 6.107 ( 1.416 -0.065 -9.577) 9.681 6.350 ( -8.235 -1.904 -3.190) 9.034 6.519 ( 5.958 2.900 0.386) 6.637 6.691 ( -1.311 -5.446 0.779) 5.655 6.975 ( -13.514 -3.902 -0.306) 14.069 7.170 ( -2.662 -0.118 -10.712) 11.039 7.739 ( 1.025 -14.829 9.106) 17.432 7.990 ( 0.503 -3.861 7.230) 8.212 8.534 ( 8.725 -13.079 -4.247) 16.286 8.925 ( 1.531 -4.870 -7.159) 8.793 18.970 ( 1.249 3.406 0.527) 3.666 18.991 ( 0.384 0.907 1.234) 1.579 19.040 ( -0.724 2.123 0.005) 2.243 19.102 ( -1.118 1.490 -1.208) 2.220 19.400 ( 0.310 -0.181 0.100) 0.373 19.443 ( 0.421 -1.479 -0.761) 1.716 19.460 ( 1.645 -2.829 -0.007) 3.272 19.528 ( -1.360 -2.046 -0.298) 2.475 42.431 ( -0.630 0.659 0.303) 0.961 42.476 ( -2.783 1.924 -0.142) 3.386 42.565 ( 3.885 -1.892 0.377) 4.338 42.644 ( -1.049 0.019 -0.638) 1.228 65.937 ( 0.678 8.446 5.428) 10.062 66.592 ( -5.676 5.413 -11.692) 14.079 67.537 ( 12.110 -1.628 2.042) 12.388 68.264 ( -19.760 5.471 -7.564) 21.855 ======================= Grid point 290 (123/216) ======================= q-point: ( 0.64 0.27 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.601 ( -8.400 9.287 15.233) 19.720 2.743 ( -1.759 23.309 9.989) 25.420 3.158 ( -4.199 10.432 15.479) 19.133 3.385 ( 4.534 7.521 -4.437) 9.840 3.879 ( 0.305 13.934 -1.219) 13.991 4.066 ( -3.765 4.147 -7.716) 9.534 4.342 ( -9.914 3.549 -0.621) 10.548 4.584 ( -2.573 4.865 2.777) 6.164 4.900 ( 7.356 1.326 -2.113) 7.768 4.934 ( 10.217 -0.993 3.940) 10.996 5.278 ( 10.430 -4.888 -2.238) 11.734 5.412 ( -3.385 -2.352 -0.021) 4.122 5.605 ( -1.902 -2.481 0.930) 3.262 5.653 ( -0.952 -0.221 -1.507) 1.796 5.928 ( 4.933 -2.847 -8.508) 10.239 6.155 ( -8.282 5.063 2.538) 10.033 6.215 ( -1.618 11.984 2.999) 12.459 6.356 ( -3.883 -8.167 -3.210) 9.596 6.524 ( -1.624 8.762 -2.284) 9.199 6.758 ( -4.094 4.489 4.953) 7.839 7.123 ( -10.770 -5.895 -2.517) 12.533 7.149 ( -4.810 0.805 -6.998) 8.530 7.648 ( 3.667 -16.806 7.028) 18.581 7.976 ( 0.638 -7.325 1.430) 7.491 8.227 ( 12.626 -9.551 -2.986) 16.111 8.795 ( 2.422 -6.624 -4.263) 8.241 18.976 ( 1.919 3.684 0.090) 4.155 19.003 ( 0.107 0.299 1.274) 1.313 19.047 ( 0.234 -0.127 0.010) 0.266 19.156 ( -2.639 4.927 -0.717) 5.635 19.382 ( 1.752 -3.416 -0.144) 3.841 19.401 ( 1.120 -1.170 0.090) 1.622 19.431 ( 0.097 -0.802 -0.765) 1.113 19.532 ( -1.511 -2.030 -0.142) 2.534 42.455 ( -1.108 -0.378 0.408) 1.240 42.499 ( 2.367 -0.971 0.555) 2.618 42.532 ( -1.984 1.897 -0.267) 2.758 42.649 ( 0.074 0.962 -1.106) 1.468 66.015 ( 1.691 6.384 3.062) 7.279 66.683 ( -9.232 8.691 -8.731) 15.395 67.323 ( 11.623 -6.850 0.329) 13.495 68.563 ( -19.273 2.135 -3.043) 19.628 ======================= Grid point 291 (124/216) ======================= q-point: ( 0.73 0.27 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.893 ( -6.099 6.739 9.334) 13.028 2.974 ( 2.095 21.865 4.790) 22.482 3.281 ( 7.332 1.480 -1.706) 7.672 3.394 ( 4.675 8.880 15.876) 18.782 3.714 ( 13.605 -2.287 -6.787) 15.375 4.053 ( -8.603 -3.347 -15.684) 18.199 4.329 ( 23.127 8.137 5.530) 25.133 4.637 ( 21.979 -7.158 -5.545) 23.771 4.804 ( -6.830 -0.801 1.811) 7.112 4.840 ( -2.943 4.008 1.725) 5.263 5.255 ( -5.161 2.412 12.034) 13.314 5.442 ( -4.008 4.948 -2.624) 6.887 5.536 ( 5.754 -6.683 -1.635) 8.969 5.768 ( -9.563 1.430 -4.834) 10.810 5.841 ( -3.824 3.668 -4.437) 6.911 6.308 ( -2.704 -6.593 -0.148) 7.127 6.334 ( -1.331 11.065 0.839) 11.176 6.450 ( -12.121 4.979 5.331) 14.147 6.671 ( -9.794 7.059 -1.055) 12.119 6.894 ( -5.699 -1.737 4.140) 7.255 7.166 ( -4.089 -3.497 -5.464) 7.668 7.225 ( -6.003 1.968 0.421) 6.331 7.439 ( 6.574 -12.238 -2.198) 14.065 7.881 ( -0.586 -8.822 -4.066) 9.731 7.998 ( 9.443 -8.072 3.591) 12.931 8.694 ( 1.356 -4.314 -1.245) 4.690 18.976 ( 1.897 3.452 0.010) 3.939 19.009 ( 0.446 0.046 0.713) 0.842 19.043 ( 0.159 0.057 0.073) 0.184 19.238 ( -2.755 5.435 -0.292) 6.101 19.306 ( 2.698 -5.125 -0.018) 5.791 19.386 ( 0.460 -0.401 -0.261) 0.664 19.424 ( -0.324 -0.276 -0.339) 0.544 19.537 ( -1.420 -2.088 -0.056) 2.526 42.440 ( 1.232 0.153 0.286) 1.274 42.514 ( -2.790 -0.827 0.492) 2.952 42.557 ( 0.276 1.392 -0.263) 1.444 42.639 ( 1.127 0.963 -0.890) 1.729 66.051 ( 1.429 5.366 0.860) 5.619 66.863 ( -10.317 10.679 -5.001) 15.668 67.079 ( 9.973 -11.636 -0.181) 15.326 68.827 ( -15.095 0.562 -0.148) 15.106 ======================= Grid point 292 (125/216) ======================= q-point: (-0.18 0.27 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.893 ( 17.215 -0.112 -0.784) 17.233 3.119 ( 13.877 20.437 4.703) 25.146 3.197 ( -2.992 0.127 -0.005) 2.994 3.447 ( 14.172 11.458 8.201) 19.985 3.531 ( -0.663 3.959 -2.122) 4.540 3.990 ( 10.209 -6.108 1.357) 11.974 4.092 ( -2.683 -7.133 -8.759) 11.610 4.120 ( 24.361 -7.969 -4.275) 25.985 4.775 ( 3.571 -9.496 -0.540) 10.160 5.017 ( -4.349 7.937 5.999) 10.858 5.297 ( 6.998 -6.004 -4.498) 10.259 5.551 ( -8.284 8.338 9.904) 15.370 5.606 ( -8.235 8.704 0.530) 11.994 5.859 ( -8.476 1.210 -8.059) 11.758 5.946 ( -2.607 6.521 -0.571) 7.046 6.293 ( -3.988 -7.909 0.806) 8.894 6.374 ( 6.363 8.117 -0.460) 10.324 6.634 ( 7.594 -17.568 6.459) 20.200 6.753 ( -5.567 3.291 -0.866) 6.525 7.006 ( -12.571 -1.363 -1.567) 12.741 7.116 ( 2.435 7.768 -0.854) 8.186 7.382 ( -4.000 5.861 -2.689) 7.588 7.452 ( -19.967 -1.753 -0.444) 20.048 7.808 ( -1.298 -8.432 -0.899) 8.578 7.820 ( 4.970 -7.478 1.092) 9.045 8.668 ( -0.831 -0.771 0.482) 1.231 18.975 ( 1.772 3.185 0.003) 3.645 19.003 ( 0.820 0.046 0.170) 0.839 19.043 ( 0.107 0.217 0.121) 0.270 19.219 ( 2.736 -5.438 0.011) 6.087 19.322 ( -2.588 5.123 -0.082) 5.740 19.375 ( 0.192 -0.379 -0.199) 0.469 19.429 ( -0.589 0.088 -0.068) 0.600 19.540 ( -1.252 -2.197 -0.006) 2.529 42.448 ( -1.071 1.628 0.108) 1.952 42.543 ( 2.521 1.135 -0.086) 2.766 42.550 ( -2.537 -1.533 0.190) 2.970 42.615 ( 1.785 -0.222 -0.341) 1.831 66.086 ( 1.067 6.906 0.089) 6.988 66.818 ( 7.603 -16.986 0.331) 18.613 67.086 ( -9.500 11.802 -2.707) 15.390 69.033 ( -10.971 0.140 0.860) 11.005 ======================= Grid point 293 (126/216) ======================= q-point: (-0.09 0.27 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.504 ( 26.445 -4.028 -0.000) 26.750 2.990 ( 17.189 7.677 -0.000) 18.826 3.132 ( 19.362 10.548 -0.000) 22.049 3.383 ( 15.149 7.084 -0.000) 16.724 3.627 ( 3.220 1.981 -0.000) 3.781 3.751 ( -1.764 -2.077 0.000) 2.725 3.891 ( -6.707 -5.106 0.000) 8.430 4.119 ( -12.717 -12.741 0.000) 18.002 4.614 ( 6.791 -7.053 -0.000) 9.791 5.110 ( 6.693 -2.910 -0.000) 7.298 5.178 ( -4.197 4.888 0.000) 6.443 5.718 ( 4.546 5.241 -0.000) 6.938 5.837 ( -9.130 7.011 0.000) 11.512 5.928 ( -5.584 -1.599 0.000) 5.808 5.942 ( 7.250 2.918 -0.000) 7.815 6.241 ( 11.865 -9.232 -0.000) 15.034 6.326 ( 7.867 -3.111 -0.000) 8.460 6.363 ( -11.071 -4.213 0.000) 11.846 6.855 ( 1.276 4.113 -0.000) 4.307 7.149 ( -1.999 2.683 0.000) 3.346 7.189 ( -0.500 12.128 -0.000) 12.139 7.463 ( -3.765 2.878 0.000) 4.739 7.499 ( -0.669 -13.609 0.000) 13.626 7.763 ( -1.926 -7.606 0.000) 7.846 8.066 ( -30.131 6.734 0.000) 30.874 8.698 ( -2.089 1.196 0.000) 2.407 18.974 ( 1.610 2.828 -0.000) 3.255 18.990 ( 1.069 0.339 -0.000) 1.121 19.044 ( 0.127 0.187 -0.000) 0.226 19.134 ( 2.516 -5.267 -0.000) 5.837 19.371 ( -0.037 -0.266 0.000) 0.268 19.397 ( -2.178 3.859 0.000) 4.431 19.442 ( -0.843 0.814 0.000) 1.172 19.539 ( -1.049 -2.348 0.000) 2.572 42.493 ( -2.144 2.244 0.000) 3.104 42.505 ( 3.449 1.617 -0.000) 3.809 42.568 ( -1.403 -1.840 0.000) 2.314 42.578 ( 1.515 -2.075 -0.000) 2.569 66.122 ( 4.126 9.393 -0.000) 10.259 66.586 ( 2.414 -18.135 0.000) 18.295 67.301 ( -8.240 9.115 0.000) 12.287 69.183 ( -7.800 0.398 0.000) 7.810 ======================= Grid point 300 (127/216) ======================= q-point: ( 0.55 0.36 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.174 ( 0.000 22.933 19.816) 30.308 2.248 ( 0.000 18.462 19.592) 26.920 2.712 ( -0.000 25.505 3.974) 25.813 3.201 ( 0.000 10.773 -11.813) 15.988 3.433 ( 0.000 15.507 17.570) 23.435 3.562 ( -0.000 18.604 24.177) 30.507 4.342 ( -0.000 -17.820 -17.117) 24.709 4.518 ( 0.000 15.691 -13.211) 20.512 5.075 ( 0.000 -1.156 -1.083) 1.584 5.130 ( -0.000 -2.753 4.945) 5.659 5.317 ( 0.000 -3.520 9.923) 10.529 5.388 ( -0.000 6.473 -5.793) 8.687 5.665 ( 0.000 -2.157 -12.239) 12.428 5.696 ( -0.000 8.358 -0.995) 8.417 6.026 ( 0.000 4.223 -5.589) 7.005 6.056 ( -0.000 -5.074 -4.214) 6.595 6.194 ( 0.000 1.832 2.372) 2.997 6.194 ( -0.000 3.460 -0.556) 3.504 6.687 ( 0.000 -4.911 5.132) 7.103 6.697 ( 0.000 -7.006 0.995) 7.076 6.875 ( -0.000 -4.782 -1.073) 4.901 7.038 ( -0.000 1.410 -11.307) 11.394 7.942 ( 0.000 -13.207 8.355) 15.628 8.071 ( -0.000 -2.844 5.137) 5.872 8.705 ( -0.000 -12.513 -0.868) 12.543 8.895 ( 0.000 -2.154 -7.118) 7.437 18.958 ( -0.000 3.562 0.651) 3.622 18.993 ( 0.000 3.823 -0.775) 3.901 19.002 ( -0.000 0.437 1.746) 1.800 19.088 ( 0.000 -0.784 -1.423) 1.625 19.409 ( 0.000 -0.569 0.509) 0.764 19.447 ( -0.000 -1.013 -0.908) 1.360 19.502 ( 0.000 -2.256 0.415) 2.294 19.527 ( -0.000 -2.104 -0.550) 2.175 42.425 ( 0.000 1.318 0.162) 1.328 42.432 ( -0.000 1.270 -0.120) 1.276 42.625 ( -0.000 -1.160 0.201) 1.177 42.630 ( -0.000 -1.377 -0.042) 1.378 65.929 ( 0.000 7.581 7.432) 10.616 66.407 ( -0.000 4.896 -11.830) 12.803 67.707 ( 0.000 0.907 4.255) 4.350 67.928 ( -0.000 7.877 -7.207) 10.677 ======================= Grid point 301 (128/216) ======================= q-point: ( 0.64 0.36 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.542 ( -3.841 13.771 15.318) 20.953 2.600 ( -4.827 21.032 14.290) 25.882 3.007 ( -9.207 20.203 6.209) 23.054 3.247 ( -5.052 12.879 -12.780) 18.834 3.719 ( -5.086 11.146 9.230) 15.339 3.957 ( -4.413 17.897 15.902) 24.345 4.110 ( -8.890 -14.757 -12.208) 21.115 4.522 ( 2.696 16.299 -11.568) 20.168 4.961 ( 8.207 0.528 5.539) 9.916 5.206 ( 11.560 0.488 -0.750) 11.594 5.274 ( -3.722 -0.564 -0.578) 3.808 5.435 ( 1.120 -4.183 -0.144) 4.333 5.542 ( -5.264 1.953 0.983) 5.700 5.766 ( 1.775 -5.725 -4.728) 7.634 5.939 ( 4.393 -0.610 -7.943) 9.098 5.991 ( -4.268 2.821 -2.336) 5.624 6.177 ( 3.362 7.944 4.162) 9.578 6.319 ( -4.824 -1.727 -0.844) 5.193 6.537 ( 9.338 1.326 1.411) 9.537 6.725 ( -1.857 -0.366 3.665) 4.125 6.974 ( -12.268 -3.304 0.061) 12.705 6.998 ( -4.829 -1.036 -9.980) 11.135 7.880 ( 1.740 -13.552 7.877) 15.771 8.056 ( 0.055 -8.117 0.410) 8.128 8.497 ( 12.330 -10.365 -0.141) 16.108 8.821 ( -0.790 -5.757 -5.271) 7.845 18.975 ( 1.812 3.787 0.200) 4.203 19.014 ( 0.123 0.573 1.384) 1.503 19.039 ( -0.804 2.245 -0.105) 2.387 19.083 ( -1.403 1.715 -1.158) 2.500 19.404 ( 0.379 -0.764 0.351) 0.922 19.430 ( 0.096 -1.110 -0.779) 1.359 19.461 ( 2.063 -3.141 0.053) 3.758 19.524 ( -1.578 -2.078 -0.190) 2.616 42.435 ( -0.813 0.751 0.187) 1.123 42.474 ( -2.701 1.890 -0.082) 3.298 42.570 ( 3.750 -1.786 0.226) 4.160 42.637 ( -0.383 -0.123 -0.305) 0.504 66.031 ( 2.493 6.586 5.839) 9.148 66.417 ( -6.655 7.322 -9.319) 13.592 67.559 ( 13.465 -2.409 0.809) 13.702 68.179 ( -21.640 5.497 -3.171) 22.551 ======================= Grid point 302 (129/216) ======================= q-point: ( 0.73 0.36 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.792 ( -3.454 12.983 6.902) 15.104 2.871 ( -1.542 15.335 5.021) 16.210 3.283 ( 3.794 11.043 -4.741) 12.603 3.419 ( -14.663 8.154 13.424) 21.487 3.807 ( 4.302 7.599 -8.832) 12.420 3.904 ( 2.860 -9.543 -5.815) 11.535 4.458 ( -12.703 12.875 10.793) 21.062 4.591 ( -8.092 10.161 -3.502) 13.454 4.819 ( 23.070 6.579 -4.956) 24.496 4.999 ( 7.981 0.235 2.584) 8.393 5.306 ( -0.531 -5.128 4.571) 6.891 5.386 ( 1.499 -3.464 -3.206) 4.952 5.611 ( -4.176 -9.362 0.019) 10.251 5.666 ( -0.339 3.571 3.272) 4.855 5.779 ( 5.181 -1.775 -8.502) 10.113 6.190 ( -12.801 7.012 1.345) 14.658 6.239 ( -0.353 9.244 0.347) 9.258 6.320 ( -3.658 -6.929 -1.198) 7.926 6.499 ( -0.341 8.315 -0.758) 8.356 6.865 ( -6.438 -0.613 7.627) 10.000 7.012 ( -4.402 7.691 -8.272) 12.122 7.107 ( -9.606 -4.968 -0.573) 10.830 7.763 ( 7.410 -20.153 6.469) 22.425 7.920 ( 1.112 -10.514 -5.753) 12.037 8.237 ( 11.947 -5.603 1.828) 13.321 8.739 ( 0.842 -5.675 -2.094) 6.107 18.977 ( 1.988 3.666 0.019) 4.171 19.022 ( 0.399 -0.049 0.923) 1.007 19.043 ( 0.104 0.270 -0.428) 0.516 19.148 ( -2.842 5.133 -0.268) 5.873 19.380 ( 1.683 -3.419 -0.049) 3.811 19.403 ( 1.386 -1.690 0.156) 2.192 19.421 ( -0.150 -0.592 -0.413) 0.738 19.530 ( -1.581 -2.057 -0.053) 2.595 42.460 ( -1.065 -0.324 0.168) 1.126 42.505 ( 2.277 -0.840 0.217) 2.437 42.528 ( -2.005 1.775 -0.115) 2.680 42.636 ( 0.418 0.955 -0.387) 1.112 66.056 ( 3.116 4.361 1.619) 5.599 66.576 ( -9.987 11.103 -3.747) 15.397 67.328 ( 11.182 -8.318 0.155) 13.937 68.531 ( -20.255 3.494 -0.939) 20.575 ======================= Grid point 303 (130/216) ======================= q-point: ( 0.82 0.36 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.994 ( -3.707 16.197 -0.000) 16.615 3.001 ( 0.373 6.528 -0.000) 6.539 3.246 ( 8.110 8.434 -0.000) 11.701 3.621 ( 13.312 1.955 -0.000) 13.455 3.640 ( 14.412 9.220 -0.000) 17.109 3.852 ( -19.607 -11.857 0.000) 22.913 4.394 ( 27.607 3.619 -0.000) 27.844 4.569 ( 21.445 -4.221 -0.000) 21.857 4.809 ( -8.917 -3.829 0.000) 9.705 4.871 ( -0.355 11.598 -0.000) 11.604 5.404 ( -7.714 5.685 0.000) 9.582 5.409 ( -5.716 0.841 0.000) 5.777 5.510 ( 8.189 -6.385 -0.000) 10.384 5.694 ( -7.544 -3.035 0.000) 8.132 5.813 ( -6.228 5.956 0.000) 8.617 6.304 ( -2.840 -5.751 0.000) 6.414 6.341 ( -0.469 10.805 -0.000) 10.815 6.496 ( -14.270 7.780 0.000) 16.253 6.661 ( -11.327 7.578 0.000) 13.628 6.959 ( -11.893 -18.691 0.000) 22.154 7.090 ( 5.053 14.680 -0.000) 15.525 7.229 ( -9.069 2.207 0.000) 9.334 7.422 ( 10.998 -17.511 -0.000) 20.678 7.843 ( -2.036 -8.582 0.000) 8.820 8.033 ( 9.374 -8.489 -0.000) 12.646 8.682 ( 0.562 -3.153 0.000) 3.203 18.976 ( 1.890 3.431 -0.000) 3.917 19.016 ( 0.685 -0.127 -0.000) 0.697 19.043 ( 0.061 0.296 -0.000) 0.302 19.236 ( -2.827 5.490 0.000) 6.175 19.305 ( 2.689 -5.123 -0.000) 5.786 19.384 ( 0.482 -0.609 -0.000) 0.777 19.421 ( -0.424 -0.193 0.000) 0.466 19.537 ( -1.447 -2.095 0.000) 2.546 42.442 ( 1.282 0.203 -0.000) 1.298 42.518 ( -2.773 -0.810 0.000) 2.889 42.555 ( 0.233 1.303 -0.000) 1.324 42.632 ( 1.133 1.037 -0.000) 1.536 66.059 ( 1.753 4.671 -0.000) 4.989 66.819 ( -10.331 12.460 0.000) 16.186 67.079 ( 9.441 -13.431 -0.000) 16.417 68.826 ( -15.620 1.428 0.000) 15.685 ======================= Grid point 309 (131/216) ======================= q-point: ( 0.27 0.45 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.280 ( 15.724 0.000 13.563) 20.765 2.644 ( 17.412 0.000 6.053) 18.434 2.843 ( 8.817 0.000 13.634) 16.237 2.976 ( 7.114 0.000 12.555) 14.431 3.816 ( -17.872 0.000 3.235) 18.162 3.965 ( -16.374 -0.000 -10.408) 19.402 4.058 ( 7.549 -0.000 -3.999) 8.543 4.551 ( 10.277 0.000 6.808) 12.328 4.630 ( 1.919 -0.000 -12.105) 12.256 4.818 ( -23.245 0.000 2.882) 23.423 5.308 ( 4.147 0.000 11.309) 12.045 5.378 ( 1.247 -0.000 -1.789) 2.181 5.493 ( -2.452 -0.000 -8.970) 9.299 5.862 ( 13.005 0.000 8.603) 15.593 5.991 ( -3.702 -0.000 0.106) 3.704 6.135 ( 11.975 0.000 0.717) 11.996 6.250 ( 12.226 -0.000 -9.182) 15.289 6.458 ( 2.715 -0.000 -2.479) 3.676 6.493 ( -5.095 -0.000 -5.351) 7.389 6.721 ( 9.593 -0.000 -5.303) 10.961 7.474 ( 2.454 0.000 1.534) 2.894 7.520 ( -3.973 0.000 7.238) 8.257 7.896 ( -4.155 0.000 1.457) 4.403 7.968 ( -4.004 0.000 7.970) 8.919 8.615 ( -13.978 -0.000 -14.060) 19.826 8.649 ( -6.900 -0.000 -5.402) 8.763 18.967 ( 1.363 0.000 -0.066) 1.364 18.969 ( 1.893 -0.000 -0.438) 1.943 18.986 ( 0.523 0.000 0.979) 1.110 19.069 ( -0.805 -0.000 -0.152) 0.819 19.383 ( 0.038 0.000 0.542) 0.543 19.445 ( -0.641 -0.000 -0.560) 0.851 19.521 ( -0.576 -0.000 -0.086) 0.583 19.523 ( -1.424 -0.000 -0.090) 1.426 42.471 ( -0.477 -0.000 -0.238) 0.533 42.481 ( -0.412 -0.000 -0.899) 0.989 42.551 ( 1.178 0.000 0.339) 1.226 42.564 ( 0.927 0.000 0.139) 0.937 65.960 ( 9.191 0.000 3.320) 9.772 66.441 ( -4.289 -0.000 -6.027) 7.397 67.832 ( 0.004 0.000 9.406) 9.406 68.857 ( 7.534 -0.000 -15.153) 16.923 ======================= Grid point 313 (132/216) ======================= q-point: ( 0.64 0.45 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.485 ( -0.000 19.531 16.090) 25.305 2.510 ( -0.000 21.665 11.222) 24.399 2.740 ( -0.000 24.142 0.861) 24.158 2.913 ( -0.000 15.225 -18.411) 23.891 3.773 ( 0.000 -3.750 19.695) 20.049 3.940 ( -0.000 17.669 21.638) 27.936 4.067 ( -0.000 -16.292 -16.629) 23.280 4.266 ( 0.000 16.617 -17.721) 24.294 5.093 ( 0.000 5.130 3.864) 6.422 5.176 ( -0.000 1.514 -3.032) 3.389 5.327 ( -0.000 6.364 3.110) 7.083 5.462 ( 0.000 0.777 -8.034) 8.071 5.489 ( 0.000 -3.338 6.680) 7.468 5.629 ( -0.000 2.292 -7.060) 7.423 5.971 ( 0.000 -2.195 -0.668) 2.295 5.995 ( -0.000 -3.750 -3.029) 4.820 6.213 ( -0.000 7.775 1.568) 7.932 6.222 ( 0.000 5.075 0.709) 5.124 6.735 ( -0.000 -4.196 3.573) 5.512 6.756 ( 0.000 -4.125 2.734) 4.948 6.849 ( -0.000 -5.728 -1.718) 5.980 6.880 ( 0.000 -2.237 -7.205) 7.545 8.056 ( 0.000 -10.400 5.397) 11.717 8.108 ( -0.000 -6.189 -0.652) 6.223 8.721 ( -0.000 -9.616 2.837) 10.026 8.791 ( 0.000 -5.479 -5.557) 7.804 18.969 ( -0.000 3.712 0.693) 3.776 18.981 ( 0.000 3.805 -0.748) 3.877 19.032 ( -0.000 0.104 1.872) 1.874 19.062 ( 0.000 -0.300 -1.744) 1.770 19.419 ( 0.000 -0.902 0.729) 1.160 19.432 ( -0.000 -1.035 -0.874) 1.354 19.510 ( 0.000 -2.215 0.500) 2.271 19.518 ( -0.000 -2.162 -0.551) 2.232 42.427 ( 0.000 1.334 0.152) 1.342 42.430 ( -0.000 1.316 -0.136) 1.323 42.628 ( -0.000 -1.234 0.131) 1.241 42.629 ( -0.000 -1.322 -0.060) 1.323 66.064 ( 0.000 6.576 9.046) 11.184 66.224 ( -0.000 5.624 -10.582) 11.983 67.770 ( 0.000 2.292 3.748) 4.393 67.836 ( -0.000 4.560 -4.520) 6.421 ======================= Grid point 314 (133/216) ======================= q-point: ( 0.73 0.45 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.686 ( 1.929 18.255 -0.000) 18.357 2.748 ( -1.537 15.224 -0.000) 15.301 3.063 ( -17.175 18.389 0.000) 25.163 3.096 ( -9.854 18.236 0.000) 20.728 3.814 ( 0.735 -5.979 0.000) 6.024 3.938 ( -5.043 -7.251 0.000) 8.833 4.228 ( -4.190 16.374 -0.000) 16.902 4.333 ( -3.967 18.361 -0.000) 18.785 5.062 ( 5.042 0.302 -0.000) 5.051 5.128 ( 20.380 8.902 -0.000) 22.240 5.278 ( -5.344 -3.963 0.000) 6.653 5.431 ( -0.784 0.110 0.000) 0.792 5.603 ( -6.037 -7.082 0.000) 9.306 5.683 ( -3.648 -0.159 0.000) 3.652 5.869 ( 7.400 -2.781 -0.000) 7.905 5.973 ( -4.277 3.462 0.000) 5.502 6.213 ( 3.377 7.316 -0.000) 8.058 6.313 ( -3.456 -2.761 0.000) 4.423 6.550 ( 11.056 0.042 -0.000) 11.056 6.788 ( -0.716 11.097 -0.000) 11.120 6.882 ( -7.375 -9.254 0.000) 11.833 6.975 ( -12.111 -3.183 0.000) 12.522 7.970 ( 2.174 -8.740 0.000) 9.006 8.030 ( -0.034 -15.393 0.000) 15.393 8.505 ( 14.231 -7.374 -0.000) 16.028 8.772 ( -2.521 -6.855 0.000) 7.304 18.977 ( 1.979 3.793 -0.000) 4.278 19.028 ( -0.747 2.275 -0.000) 2.395 19.037 ( 0.540 -0.271 -0.000) 0.604 19.070 ( -2.062 2.680 0.000) 3.381 19.409 ( 0.598 -1.211 -0.000) 1.351 19.421 ( -0.174 -0.810 0.000) 0.828 19.461 ( 2.189 -3.199 -0.000) 3.876 19.522 ( -1.673 -2.088 0.000) 2.675 42.437 ( -0.886 0.787 0.000) 1.185 42.473 ( -2.672 1.879 0.000) 3.267 42.572 ( 3.701 -1.746 -0.000) 4.093 42.634 ( -0.149 -0.179 0.000) 0.233 66.094 ( 5.166 4.624 -0.000) 6.933 66.325 ( -8.977 9.258 0.000) 12.895 67.565 ( 13.816 -2.699 -0.000) 14.077 68.154 ( -22.182 5.364 0.000) 22.821 ======================= Grid point 321 (134/216) ======================= q-point: ( 0.27 0.55 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.566 ( 14.058 7.903 5.139) 16.926 2.920 ( 12.637 1.285 9.627) 15.938 3.035 ( 2.858 -2.315 3.685) 5.206 3.146 ( 2.775 -3.266 9.356) 10.290 3.623 ( -11.530 7.976 -9.040) 16.682 3.756 ( 2.140 -3.561 6.624) 7.819 3.987 ( -4.576 -6.379 -10.036) 12.741 4.415 ( -5.557 7.051 -8.694) 12.497 4.693 ( -2.995 -1.693 3.353) 4.804 4.842 ( 9.421 -5.682 11.477) 15.899 5.274 ( -4.255 1.299 -7.515) 8.733 5.409 ( -0.302 -6.802 -2.216) 7.160 5.585 ( 6.406 -5.527 5.251) 9.958 5.897 ( -6.822 -0.170 -0.158) 6.826 6.069 ( 9.006 7.669 5.015) 12.848 6.280 ( 11.030 11.035 -3.082) 15.904 6.335 ( -0.607 0.785 -6.487) 6.563 6.447 ( 6.472 -3.624 -0.006) 7.417 6.488 ( 0.783 -4.952 1.084) 5.129 6.905 ( 16.826 -8.515 -4.759) 19.449 7.442 ( -4.540 7.277 5.163) 10.011 7.524 ( -5.429 -1.295 4.742) 7.324 7.837 ( -4.633 -2.389 -0.384) 5.227 7.953 ( -4.860 1.180 6.992) 8.597 8.216 ( -17.419 9.568 -10.385) 22.424 8.527 ( -6.379 -5.104 -6.388) 10.371 18.968 ( 1.695 2.872 -0.176) 3.339 18.992 ( 0.249 0.039 0.600) 0.651 19.020 ( 0.915 -1.776 -0.143) 2.004 19.068 ( 0.663 -2.440 -0.354) 2.553 19.390 ( 0.249 0.062 0.629) 0.680 19.432 ( -0.465 0.151 -0.386) 0.623 19.475 ( -1.374 3.641 -0.072) 3.892 19.530 ( -0.904 -2.667 -0.077) 2.817 42.468 ( 2.677 2.355 -0.152) 3.568 42.515 ( 2.436 -3.188 -0.297) 4.023 42.543 ( -1.546 1.821 0.074) 2.390 42.572 ( -0.888 -1.558 0.080) 1.795 66.102 ( 7.864 5.936 1.564) 9.976 66.394 ( -0.425 -9.873 -3.006) 10.329 67.863 ( -2.012 9.923 11.311) 15.181 68.836 ( 1.708 -5.873 -12.255) 13.697 ======================= Grid point 322 (135/216) ======================= q-point: ( 0.36 0.55 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.470 ( 11.774 -0.000 10.361) 15.684 2.723 ( 13.955 -0.000 2.837) 14.241 3.095 ( 5.354 -0.000 16.001) 16.873 3.182 ( 1.990 0.000 12.660) 12.815 3.793 ( -14.331 -0.000 -10.608) 17.830 3.830 ( -10.903 0.000 -4.344) 11.736 4.001 ( -7.826 -0.000 0.289) 7.831 4.429 ( -2.029 0.000 -12.201) 12.369 4.702 ( 14.894 -0.000 10.879) 18.444 4.865 ( -16.602 0.000 2.760) 16.830 5.301 ( -4.055 -0.000 -5.962) 7.211 5.338 ( 3.266 0.000 -2.808) 4.307 5.565 ( 1.573 -0.000 11.571) 11.678 5.939 ( 8.703 0.000 -0.716) 8.732 6.001 ( 3.009 0.000 0.330) 3.027 6.100 ( 12.937 -0.000 -8.426) 15.439 6.151 ( 12.743 -0.000 2.960) 13.082 6.408 ( 4.942 0.000 -3.785) 6.225 6.435 ( -2.919 -0.000 -1.096) 3.118 6.626 ( 7.867 -0.000 -6.155) 9.989 7.540 ( 2.917 -0.000 6.571) 7.189 7.634 ( -3.996 0.000 6.378) 7.527 7.902 ( -5.485 -0.000 -0.645) 5.523 8.060 ( -1.946 0.000 1.579) 2.506 8.408 ( -12.254 -0.000 -9.240) 15.348 8.556 ( -8.117 0.000 -5.851) 10.006 18.964 ( 1.794 0.000 -0.158) 1.801 18.966 ( 1.473 -0.000 -0.106) 1.477 19.004 ( 0.184 0.000 1.213) 1.227 19.061 ( -0.742 -0.000 -0.787) 1.081 19.394 ( -0.016 -0.000 0.772) 0.772 19.434 ( -0.471 0.000 -0.729) 0.868 19.520 ( -0.725 -0.000 -0.047) 0.727 19.521 ( -1.258 0.000 -0.086) 1.261 42.468 ( -0.408 0.000 -0.204) 0.456 42.470 ( -0.327 -0.000 -0.482) 0.582 42.556 ( 1.105 0.000 0.307) 1.146 42.565 ( 0.945 -0.000 -0.002) 0.945 66.026 ( 7.343 -0.000 4.795) 8.770 66.334 ( -1.173 0.000 -6.880) 6.979 67.998 ( 2.661 -0.000 10.957) 11.275 68.615 ( 8.751 0.000 -14.349) 16.807 ======================= Grid point 333 (136/216) ======================= q-point: ( 0.27 -0.36 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.670 ( 7.848 11.350 -0.343) 13.803 2.919 ( -4.984 15.490 0.317) 16.275 3.229 ( 0.959 7.264 3.872) 8.288 3.253 ( 3.079 3.335 2.224) 5.055 3.407 ( 8.201 -5.640 -1.759) 10.108 3.878 ( 4.439 -5.889 2.492) 7.784 4.099 ( 13.251 -14.718 -2.948) 20.022 4.289 ( 4.989 6.728 -6.861) 10.827 4.728 ( -0.841 -3.782 4.055) 5.608 5.053 ( 0.551 5.598 7.181) 9.122 5.169 ( -1.177 -7.658 -2.439) 8.123 5.452 ( -0.100 -5.559 1.488) 5.755 5.715 ( 0.553 -8.100 -1.248) 8.214 5.795 ( -5.580 -0.298 0.804) 5.646 6.098 ( 0.361 6.276 -2.157) 6.646 6.229 ( -0.747 6.457 -1.977) 6.794 6.270 ( 0.370 4.079 -5.581) 6.923 6.497 ( 4.563 11.067 0.675) 11.989 6.643 ( 5.909 -10.047 3.254) 12.101 7.223 ( 7.419 -0.401 -1.682) 7.618 7.382 ( -0.230 -8.114 7.410) 10.990 7.411 ( -10.683 3.217 1.902) 11.318 7.765 ( -15.831 9.248 -7.946) 19.982 7.790 ( -5.691 -4.464 0.124) 7.234 7.961 ( -1.126 1.296 5.904) 6.149 8.449 ( -2.907 -6.552 -5.858) 9.257 18.969 ( 1.565 2.718 -0.154) 3.140 18.995 ( -0.068 0.517 0.396) 0.655 19.022 ( -0.279 -0.105 -0.507) 0.588 19.130 ( 2.542 -5.202 -0.107) 5.791 19.393 ( -0.497 1.527 0.291) 1.631 19.413 ( -0.691 2.469 0.474) 2.608 19.435 ( -0.120 0.736 -0.313) 0.808 19.536 ( -0.939 -2.497 -0.031) 2.667 42.486 ( -2.676 2.158 -0.051) 3.438 42.510 ( 4.166 1.828 0.049) 4.550 42.558 ( -2.670 -1.821 -0.139) 3.235 42.593 ( 4.196 -2.486 0.300) 4.886 66.120 ( 3.500 9.244 -0.045) 9.885 66.540 ( 5.306 -15.571 -0.625) 16.462 67.787 ( -3.431 18.661 9.893) 21.398 68.820 ( -2.517 -11.975 -7.836) 14.531 ======================= Grid point 334 (137/216) ======================= q-point: ( 0.36 0.64 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.645 ( 10.236 13.014 4.427) 17.138 3.006 ( 11.736 -15.813 0.804) 19.709 3.145 ( -2.916 12.523 9.535) 16.008 3.308 ( -1.748 -1.962 9.431) 9.790 3.478 ( -10.112 7.182 -8.171) 14.852 3.790 ( 2.225 -13.542 -10.186) 17.090 3.903 ( -2.619 0.379 7.994) 8.420 4.246 ( -1.232 7.435 -11.044) 13.371 4.765 ( -3.591 -1.133 4.061) 5.538 4.960 ( 5.984 -12.462 2.168) 13.993 5.215 ( -1.268 8.137 0.634) 8.259 5.395 ( 2.022 -6.866 0.429) 7.171 5.676 ( -0.520 -4.971 6.095) 7.883 5.886 ( -6.547 -3.133 -2.178) 7.578 6.096 ( 7.322 7.991 -1.256) 10.911 6.176 ( 5.084 6.197 -6.875) 10.560 6.288 ( 5.107 6.947 0.221) 8.625 6.467 ( 7.466 0.424 0.892) 7.531 6.513 ( 5.499 -2.247 1.765) 6.196 6.836 ( 18.763 -15.327 -3.398) 24.464 7.542 ( -4.462 7.576 6.630) 11.012 7.615 ( -6.898 1.081 6.508) 9.545 7.814 ( -5.388 -4.331 -2.097) 7.224 7.956 ( -9.990 3.048 -9.089) 13.846 8.139 ( -8.806 8.988 3.410) 13.037 8.425 ( -6.887 -6.730 -5.791) 11.237 18.966 ( 1.638 2.769 -0.088) 3.218 19.001 ( 0.283 -0.718 0.414) 0.876 19.019 ( 0.284 -0.312 0.057) 0.426 19.061 ( 1.013 -3.067 -0.434) 3.258 19.400 ( 0.193 0.259 0.650) 0.725 19.424 ( -0.128 -0.095 -0.502) 0.527 19.474 ( -1.352 3.763 -0.043) 3.999 19.529 ( -0.911 -2.709 -0.043) 2.858 42.466 ( 2.896 2.265 -0.064) 3.677 42.512 ( 2.864 -3.101 -0.134) 4.223 42.543 ( -1.742 1.863 0.032) 2.550 42.573 ( -1.035 -1.589 0.035) 1.897 66.128 ( 5.231 7.921 1.445) 9.602 66.349 ( 3.126 -11.589 -2.275) 12.216 68.045 ( 0.103 16.350 10.306) 19.327 68.644 ( 2.288 -12.663 -10.710) 16.742 ======================= Grid point 335 (138/216) ======================= q-point: ( 0.45 0.64 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.623 ( 9.945 -0.000 8.109) 12.832 2.720 ( 10.919 0.000 -3.324) 11.414 3.333 ( 3.718 -0.000 12.223) 12.776 3.377 ( 3.363 0.000 9.363) 9.948 3.630 ( -14.613 -0.000 -7.706) 16.520 3.682 ( -10.645 0.000 -10.872) 15.216 4.083 ( -10.338 -0.000 8.088) 13.126 4.240 ( -6.222 0.000 -10.819) 12.481 4.857 ( 3.634 -0.000 6.549) 7.490 4.898 ( -9.608 0.000 0.700) 9.633 5.250 ( 2.537 -0.000 0.208) 2.545 5.289 ( 5.667 0.000 -3.270) 6.543 5.734 ( 0.389 -0.000 8.730) 8.738 5.860 ( 7.001 0.000 -7.175) 10.025 5.989 ( 6.856 0.000 -0.940) 6.921 6.000 ( 12.351 -0.000 -3.246) 12.770 6.238 ( 8.561 -0.000 6.279) 10.617 6.334 ( 6.658 0.000 -5.332) 8.530 6.455 ( 2.582 0.000 3.173) 4.091 6.528 ( 5.934 -0.000 -5.511) 8.098 7.671 ( 2.898 -0.000 7.995) 8.504 7.715 ( -1.846 0.000 2.759) 3.319 7.889 ( -6.658 0.000 0.364) 6.668 7.977 ( -2.652 -0.000 -9.263) 9.635 8.375 ( -10.763 -0.000 3.664) 11.370 8.460 ( -9.158 0.000 -5.905) 10.897 18.963 ( 1.680 0.000 0.018) 1.680 18.964 ( 1.573 -0.000 -0.097) 1.576 19.025 ( -0.161 -0.000 1.293) 1.303 19.045 ( -0.491 -0.000 -1.169) 1.268 19.407 ( -0.144 -0.000 0.870) 0.882 19.421 ( -0.302 0.000 -0.845) 0.897 19.520 ( -0.896 -0.000 0.007) 0.896 19.520 ( -1.077 0.000 -0.056) 1.079 42.465 ( -0.318 0.000 -0.117) 0.339 42.465 ( -0.352 -0.000 -0.106) 0.367 42.561 ( 1.036 0.000 0.241) 1.064 42.564 ( 0.981 -0.000 -0.136) 0.990 66.115 ( 4.944 0.000 6.077) 7.834 66.221 ( 2.038 -0.000 -6.857) 7.153 68.186 ( 5.407 0.000 12.060) 13.217 68.391 ( 7.708 -0.000 -13.134) 15.229 ======================= Grid point 345 (139/216) ======================= q-point: ( 0.27 -0.27 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.544 ( -12.365 16.767 -2.778) 21.017 2.681 ( -0.819 14.603 -5.773) 15.724 2.991 ( -0.394 24.658 -1.613) 24.714 3.351 ( 4.058 4.787 2.534) 6.768 3.734 ( 18.208 -7.352 0.808) 19.653 4.096 ( 11.100 -11.575 0.674) 16.051 4.317 ( 9.772 -0.864 -1.356) 9.903 4.501 ( 21.961 -11.215 0.519) 24.664 4.685 ( -8.406 8.721 0.598) 12.128 4.990 ( -0.185 5.067 4.464) 6.756 5.199 ( -8.004 -7.723 -1.934) 11.290 5.524 ( -3.866 -4.765 7.310) 9.544 5.727 ( -2.844 -4.738 -0.871) 5.594 5.785 ( 2.732 -2.629 -1.211) 3.980 5.974 ( -5.510 0.354 -6.902) 8.839 6.113 ( -5.350 10.258 0.554) 11.583 6.222 ( -0.112 -0.987 -3.498) 3.637 6.479 ( 5.208 11.105 1.642) 12.375 6.833 ( 3.665 -8.523 3.669) 9.977 7.076 ( -10.512 18.142 -2.682) 21.138 7.126 ( -11.028 4.213 -0.117) 11.806 7.450 ( -7.917 -0.152 -3.800) 8.782 7.658 ( -3.075 -12.101 3.146) 12.876 7.729 ( -6.879 -3.318 1.948) 7.882 8.118 ( 12.828 -8.982 6.262) 16.866 8.462 ( 2.124 -9.282 -5.526) 11.010 18.967 ( 0.906 2.162 -0.211) 2.354 18.989 ( 0.289 1.647 0.130) 1.677 19.016 ( -0.281 -0.543 -0.396) 0.729 19.217 ( 2.889 -5.518 -0.017) 6.228 19.338 ( -1.962 4.804 0.172) 5.192 19.409 ( 0.511 1.022 0.332) 1.190 19.439 ( 0.412 -0.548 0.079) 0.690 19.541 ( -1.025 -2.263 0.016) 2.484 42.430 ( -1.856 1.300 -0.174) 2.273 42.519 ( -3.741 -1.649 -0.298) 4.099 42.561 ( 3.556 1.934 0.189) 4.053 42.679 ( 3.910 -1.305 0.729) 4.186 66.084 ( 1.788 9.369 0.097) 9.539 66.755 ( 5.497 -16.064 -0.695) 16.993 67.631 ( -2.649 22.373 6.638) 23.487 68.832 ( -5.029 -15.269 -2.922) 16.339 ======================= Grid point 346 (140/216) ======================= q-point: ( 0.36 -0.27 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.682 ( 6.495 13.859 1.071) 15.342 2.918 ( -13.273 14.285 -0.115) 19.499 3.181 ( -1.842 20.985 -3.538) 21.361 3.358 ( 5.341 -5.376 6.249) 9.822 3.410 ( 9.828 -7.234 -0.281) 12.206 3.865 ( 3.062 -15.233 -2.960) 15.817 4.105 ( 13.361 -4.544 3.923) 14.647 4.189 ( 10.285 2.419 -5.453) 11.890 4.775 ( -1.685 -2.864 1.377) 3.597 5.113 ( -1.185 13.479 1.643) 13.630 5.149 ( 0.357 -16.591 -0.917) 16.620 5.510 ( 3.995 -6.022 3.594) 8.071 5.712 ( -4.668 -5.689 1.019) 7.429 5.804 ( -6.861 -6.844 -0.220) 9.693 6.025 ( -3.450 6.194 -4.234) 8.258 6.175 ( 3.758 2.551 -2.761) 5.316 6.250 ( 0.351 11.230 0.811) 11.264 6.499 ( 7.517 15.487 -0.195) 17.216 6.690 ( 6.089 -10.984 1.820) 12.690 7.200 ( 7.603 -3.815 -0.829) 8.547 7.434 ( -14.188 5.642 1.278) 15.322 7.513 ( -3.084 -2.657 7.524) 8.554 7.637 ( -9.294 3.852 -7.457) 12.523 7.776 ( -5.547 -7.967 -1.102) 9.770 8.045 ( -0.471 6.056 3.436) 6.979 8.369 ( -3.700 -8.744 -3.266) 10.040 18.967 ( 1.433 2.561 -0.057) 2.936 19.002 ( -0.224 1.022 0.384) 1.114 19.014 ( -0.311 -0.418 -0.416) 0.667 19.129 ( 2.610 -5.266 -0.045) 5.877 19.396 ( -0.770 2.106 0.093) 2.245 19.420 ( -0.393 2.369 0.461) 2.445 19.430 ( 0.148 0.316 -0.390) 0.523 19.536 ( -0.920 -2.524 -0.010) 2.686 42.486 ( -3.065 2.113 -0.014) 3.723 42.511 ( 4.590 1.907 0.017) 4.970 42.556 ( -2.880 -1.820 -0.049) 3.407 42.597 ( 4.660 -2.581 0.119) 5.328 66.119 ( 3.373 9.220 -0.017) 9.817 66.533 ( 5.757 -15.226 -0.225) 16.279 67.912 ( -2.010 24.593 4.515) 25.085 68.719 ( -2.095 -18.312 -3.730) 18.805 ======================= Grid point 347 (141/216) ======================= q-point: (-0.55 -0.27 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.687 ( 9.304 16.573 -0.000) 19.006 3.004 ( 9.352 -19.874 -0.000) 21.965 3.271 ( -8.796 13.088 0.000) 15.769 3.336 ( 0.293 17.184 -0.000) 17.186 3.452 ( -10.329 -6.270 0.000) 12.083 3.660 ( 2.366 -19.942 0.000) 20.082 4.058 ( 3.640 5.429 -0.000) 6.536 4.074 ( -3.238 2.681 0.000) 4.204 4.801 ( -3.470 0.631 0.000) 3.527 4.963 ( 2.106 -16.470 0.000) 16.604 5.233 ( 0.933 11.921 -0.000) 11.957 5.406 ( 4.297 -7.475 -0.000) 8.622 5.766 ( -3.278 -1.069 0.000) 3.448 5.826 ( -5.812 -9.504 0.000) 11.140 6.093 ( 10.849 8.167 -0.000) 13.579 6.101 ( 0.239 5.330 -0.000) 5.336 6.297 ( 5.739 11.485 -0.000) 12.839 6.473 ( 7.334 -2.635 -0.000) 7.793 6.529 ( 7.075 3.364 -0.000) 7.834 6.806 ( 19.930 -19.777 -0.000) 28.077 7.607 ( -4.718 9.258 0.000) 10.391 7.726 ( -5.269 2.818 0.000) 5.975 7.791 ( -6.038 -4.663 0.000) 7.628 7.808 ( -12.474 1.598 0.000) 12.575 8.191 ( -6.256 10.528 0.000) 12.247 8.365 ( -7.453 -9.734 0.000) 12.259 18.965 ( 1.616 2.736 -0.000) 3.178 19.004 ( 0.536 -1.587 -0.000) 1.675 19.020 ( -0.393 1.174 0.000) 1.238 19.057 ( 1.356 -3.661 -0.000) 3.904 19.408 ( 0.013 0.692 -0.000) 0.692 19.418 ( 0.149 -0.543 0.000) 0.563 19.474 ( -1.345 3.805 0.000) 4.036 19.528 ( -0.913 -2.724 0.000) 2.873 42.466 ( 2.980 2.231 -0.000) 3.722 42.511 ( 3.015 -3.068 -0.000) 4.301 42.544 ( -1.818 1.882 0.000) 2.617 42.573 ( -1.087 -1.605 0.000) 1.939 66.142 ( 3.592 9.466 -0.000) 10.125 66.329 ( 5.110 -13.037 -0.000) 14.003 68.148 ( 1.411 25.060 -0.000) 25.100 68.537 ( 1.912 -21.497 0.000) 21.581 ======================= Grid point 357 (142/216) ======================= q-point: ( 0.27 -0.18 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.113 ( -15.789 22.297 -4.032) 27.617 2.467 ( -5.363 18.102 -3.806) 19.260 2.801 ( 2.075 24.280 -0.686) 24.378 3.323 ( 1.286 13.396 -1.220) 13.513 4.070 ( 18.739 -4.950 0.301) 19.384 4.313 ( -13.336 25.489 -0.190) 28.768 4.378 ( 11.897 -11.562 -0.325) 16.592 4.543 ( 7.845 0.180 4.110) 8.858 4.950 ( 13.000 -16.396 -1.198) 20.959 5.033 ( 0.637 -6.328 4.392) 7.729 5.087 ( -3.219 -5.274 -1.495) 6.357 5.362 ( -20.585 3.964 -0.531) 20.970 5.736 ( 0.530 -4.226 -0.421) 4.280 5.797 ( 1.686 8.657 -0.260) 8.823 5.904 ( -8.876 10.295 -0.811) 13.617 5.985 ( 7.239 -3.531 -1.291) 8.157 6.197 ( -1.570 0.482 -0.451) 1.703 6.516 ( 2.644 -1.960 1.756) 3.730 6.731 ( -6.177 15.104 -1.605) 16.397 6.930 ( -4.619 7.078 4.150) 9.415 7.041 ( 3.336 -7.816 -3.212) 9.085 7.359 ( -4.883 -7.207 -1.355) 8.810 7.583 ( -12.067 -2.863 0.401) 12.409 7.698 ( -5.771 -6.180 0.608) 8.478 8.468 ( 6.402 -11.272 6.983) 14.725 8.612 ( 13.892 -15.351 -4.839) 21.262 18.956 ( -0.102 1.275 -0.204) 1.296 18.983 ( 1.256 2.884 0.040) 3.146 19.015 ( -0.257 -0.796 -0.230) 0.867 19.268 ( -1.888 5.020 0.182) 5.367 19.307 ( 2.828 -5.219 -0.000) 5.936 19.410 ( 0.530 1.078 0.126) 1.208 19.453 ( 0.489 -0.714 0.145) 0.878 19.542 ( -1.133 -2.024 0.029) 2.320 42.417 ( 1.052 -0.305 -0.105) 1.101 42.471 ( -3.493 -1.213 -0.224) 3.704 42.579 ( 0.689 2.329 0.107) 2.431 42.735 ( 1.598 -0.213 0.607) 1.723 66.013 ( -0.545 10.478 -0.060) 10.493 66.951 ( 3.483 -15.537 -0.390) 15.927 67.467 ( 0.137 21.180 2.974) 21.388 68.867 ( -6.057 -15.976 0.434) 17.091 ======================= Grid point 358 (143/216) ======================= q-point: ( 0.36 -0.18 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.528 ( -16.760 19.611 0.000) 25.797 2.626 ( -0.094 13.597 -0.000) 13.598 2.975 ( 1.094 24.328 -0.000) 24.353 3.377 ( 2.055 7.556 -0.000) 7.830 3.737 ( 17.741 -7.128 -0.000) 19.119 4.089 ( 10.349 -14.100 -0.000) 17.490 4.321 ( 13.032 -2.313 -0.000) 13.236 4.505 ( 22.142 -11.369 -0.000) 24.890 4.689 ( -8.481 10.617 0.000) 13.589 5.032 ( 1.048 5.061 -0.000) 5.168 5.169 ( -9.375 -7.691 0.000) 12.126 5.636 ( -10.797 -3.457 0.000) 11.337 5.671 ( 3.426 -7.740 -0.000) 8.464 5.819 ( 0.744 -10.251 0.000) 10.278 5.875 ( -4.725 7.048 0.000) 8.485 6.120 ( -4.130 14.285 -0.000) 14.870 6.193 ( -0.643 -4.220 0.000) 4.268 6.493 ( 7.211 12.619 -0.000) 14.535 6.874 ( 4.451 -11.229 -0.000) 12.079 7.040 ( -14.231 19.415 0.000) 24.072 7.128 ( -8.838 7.100 0.000) 11.337 7.416 ( -7.860 -0.810 0.000) 7.902 7.688 ( -5.307 -8.935 0.000) 10.392 7.743 ( -6.343 -7.268 0.000) 9.647 8.183 ( 16.629 -9.399 -0.000) 19.101 8.403 ( -0.019 -9.486 0.000) 9.486 18.965 ( 0.734 2.009 -0.000) 2.139 18.991 ( 0.379 2.014 -0.000) 2.049 19.013 ( -0.357 -0.759 0.000) 0.838 19.217 ( 2.908 -5.533 -0.000) 6.250 19.339 ( -1.905 4.786 0.000) 5.151 19.411 ( 0.508 1.189 -0.000) 1.293 19.440 ( 0.524 -0.662 -0.000) 0.844 19.541 ( -1.007 -2.270 0.000) 2.483 42.429 ( -1.917 1.273 0.000) 2.301 42.517 ( -3.838 -1.665 0.000) 4.183 42.562 ( 3.627 2.007 -0.000) 4.145 42.685 ( 4.121 -1.420 -0.000) 4.359 66.085 ( 1.940 9.551 -0.000) 9.746 66.749 ( 5.274 -15.995 -0.000) 16.842 67.687 ( -2.046 24.552 -0.000) 24.637 68.806 ( -4.486 -17.907 0.000) 18.461 ======================= Grid point 368 (144/216) ======================= q-point: ( 0.27 -0.09 0.18) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.662 ( -13.970 25.496 0.000) 29.072 2.167 ( -7.980 25.559 -0.000) 26.775 2.622 ( 0.790 23.415 -0.000) 23.428 3.150 ( -4.356 20.997 -0.000) 21.444 3.718 ( -25.804 39.491 0.000) 47.174 4.423 ( 18.274 -7.918 -0.000) 19.915 4.564 ( -8.835 7.533 0.000) 11.610 4.645 ( 8.314 -12.194 -0.000) 14.759 4.942 ( -2.499 -2.948 0.000) 3.865 5.010 ( -4.610 9.685 0.000) 10.726 5.209 ( 2.135 -16.799 0.000) 16.934 5.388 ( 9.522 -15.742 -0.000) 18.397 5.604 ( -6.799 20.412 0.000) 21.515 5.774 ( -1.302 0.505 0.000) 1.397 5.840 ( 3.550 -0.620 -0.000) 3.604 6.005 ( 6.813 13.890 -0.000) 15.471 6.270 ( 3.340 -13.632 0.000) 14.035 6.573 ( -0.364 10.962 -0.000) 10.968 6.598 ( 0.429 -8.305 0.000) 8.316 6.807 ( -4.652 7.077 0.000) 8.469 7.184 ( 6.028 -9.384 -0.000) 11.153 7.374 ( -18.072 -2.770 0.000) 18.283 7.379 ( -2.356 -10.562 0.000) 10.822 7.670 ( -3.910 -5.485 0.000) 6.736 8.627 ( 2.632 -10.174 0.000) 10.509 8.984 ( 14.734 -16.787 -0.000) 22.335 18.942 ( -0.339 0.955 0.000) 1.014 18.979 ( 1.532 3.429 -0.000) 3.756 19.018 ( -0.163 -0.851 0.000) 0.866 19.202 ( -1.499 4.564 -0.000) 4.804 19.388 ( 2.429 -4.483 -0.000) 5.098 19.409 ( 0.451 1.119 -0.000) 1.206 19.467 ( 0.369 -0.765 -0.000) 0.850 19.541 ( -1.160 -1.872 0.000) 2.202 42.434 ( -2.042 -0.522 0.000) 2.107 42.465 ( 3.777 -1.799 -0.000) 4.183 42.546 ( -2.181 2.504 0.000) 3.321 42.737 ( -1.626 0.226 0.000) 1.642 65.896 ( -2.393 11.401 -0.000) 11.650 67.111 ( 1.237 -14.119 0.000) 14.173 67.335 ( 2.086 17.763 -0.000) 17.885 68.904 ( -6.623 -14.949 0.000) 16.351 ======================= Grid point 379 (145/216) ======================= q-point: ( 0.27 0.00 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 216 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.428 ( 0.000 29.700 -0.000) 29.700 1.999 ( 0.000 34.574 -0.000) 34.574 2.657 ( 0.000 24.217 -0.000) 24.217 3.028 ( 0.000 27.680 -0.000) 27.680 3.175 ( 0.000 56.766 -0.000) 56.766 4.293 ( 0.000 13.074 -0.000) 13.074 4.573 ( -0.000 -12.197 0.000) 12.197 4.876 ( -0.000 -16.799 0.000) 16.799 5.027 ( -0.000 -4.639 0.000) 4.639 5.218 ( 0.000 19.387 -0.000) 19.387 5.219 ( -0.000 -16.650 0.000) 16.650 5.409 ( 0.000 12.778 -0.000) 12.778 5.531 ( -0.000 -13.977 0.000) 13.977 5.580 ( 0.000 20.141 -0.000) 20.141 6.209 ( -0.000 -1.013 0.000) 1.013 6.283 ( 0.000 1.223 -0.000) 1.223 6.337 ( -0.000 -15.955 0.000) 15.955 6.350 ( 0.000 1.024 -0.000) 1.024 6.596 ( 0.000 7.407 -0.000) 7.407 6.615 ( -0.000 -6.655 0.000) 6.655 7.002 ( 0.000 6.036 -0.000) 6.036 7.197 ( -0.000 -15.784 0.000) 15.784 7.483 ( -0.000 -8.692 0.000) 8.692 7.561 ( -0.000 -6.731 0.000) 6.731 8.669 ( -0.000 -10.372 0.000) 10.372 9.253 ( -0.000 -16.050 0.000) 16.050 18.935 ( 0.000 0.745 -0.000) 0.745 19.015 ( -0.000 -0.945 0.000) 0.945 19.019 ( 0.000 4.904 -0.000) 4.904 19.171 ( 0.000 2.971 -0.000) 2.971 19.418 ( 0.000 1.181 -0.000) 1.181 19.441 ( -0.000 -3.443 0.000) 3.443 19.466 ( -0.000 -1.714 0.000) 1.714 19.515 ( -0.000 -1.978 0.000) 1.978 42.440 ( 0.000 1.582 -0.000) 1.582 42.459 ( 0.000 1.602 -0.000) 1.602 42.592 ( -0.000 -1.513 0.000) 1.513 42.624 ( -0.000 -1.576 0.000) 1.576 65.851 ( 0.000 13.210 -0.000) 13.210 67.118 ( -0.000 -11.688 0.000) 11.688 67.376 ( 0.000 15.872 -0.000) 15.872 68.764 ( -0.000 -11.745 0.000) 11.745 ======================= Grid point 380 (146/216) ======================= q-point: ( 0.36 0.00 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.749 ( -6.661 27.781 5.587) 29.109 2.310 ( -4.117 26.537 3.331) 27.060 2.864 ( 1.412 25.712 2.831) 25.906 3.293 ( -2.741 25.518 2.304) 25.768 3.762 ( -15.529 48.096 0.947) 50.549 4.393 ( -5.846 0.603 -9.764) 11.396 4.537 ( -2.004 -5.119 7.815) 9.555 4.646 ( 10.395 -13.757 0.882) 17.266 4.946 ( 3.634 -8.473 -4.781) 10.385 5.028 ( 1.893 -16.434 0.499) 16.550 5.269 ( 9.026 17.761 -3.269) 20.189 5.351 ( 5.175 -15.407 2.568) 16.455 5.637 ( -8.232 18.792 -0.708) 20.528 5.805 ( -2.072 8.498 5.018) 10.084 6.003 ( 14.891 2.643 -0.840) 15.147 6.171 ( 3.466 5.564 -0.875) 6.613 6.182 ( 2.109 -16.117 -0.057) 16.255 6.532 ( 0.519 -7.194 -2.381) 7.596 6.639 ( -5.889 8.059 -0.528) 9.995 6.705 ( -12.505 2.790 -0.737) 12.834 7.094 ( -9.152 1.232 -4.697) 10.360 7.103 ( -2.821 -16.282 2.655) 16.736 7.361 ( 5.250 -6.972 5.372) 10.248 7.552 ( -4.248 -7.767 0.117) 8.854 8.571 ( 1.618 -8.871 -1.819) 9.199 9.032 ( 9.155 -16.593 -1.676) 19.025 18.945 ( -0.275 0.785 0.302) 0.885 19.009 ( -0.102 -1.000 0.321) 1.055 19.044 ( 1.961 4.982 0.018) 5.354 19.210 ( -1.666 3.855 -0.382) 4.217 19.388 ( 2.246 -4.329 -0.011) 4.877 19.424 ( 0.322 1.179 -0.147) 1.231 19.456 ( -0.553 -1.873 -0.173) 1.961 19.506 ( -0.853 -1.913 -0.124) 2.099 42.427 ( 1.113 0.659 0.117) 1.299 42.514 ( 4.350 -1.865 0.071) 4.734 42.521 ( -3.364 2.400 -0.002) 4.133 42.678 ( -4.783 -1.209 -0.361) 4.946 65.979 ( -1.039 14.110 0.676) 14.164 67.001 ( 0.116 -12.896 -2.465) 13.130 67.508 ( 1.643 16.946 0.584) 17.035 68.677 ( -4.626 -13.881 -3.822) 15.122 ======================= Grid point 381 (147/216) ======================= q-point: ( 0.45 0.00 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.152 ( -10.087 23.693 7.720) 26.884 2.596 ( -3.931 16.912 7.428) 18.885 3.069 ( 3.060 26.623 1.821) 26.860 3.502 ( 3.174 17.958 1.834) 18.328 4.266 ( 10.708 -5.839 0.672) 12.216 4.359 ( -12.399 25.868 -0.194) 28.687 4.399 ( 4.686 -15.246 -0.177) 15.951 4.534 ( 3.573 0.942 -6.416) 7.404 4.827 ( -7.710 -8.308 -7.750) 13.731 4.953 ( 1.787 -9.553 9.075) 13.296 5.156 ( 7.042 -6.250 1.145) 9.485 5.259 ( 1.806 9.200 -3.477) 10.000 5.795 ( 6.551 0.319 2.124) 6.894 5.814 ( -0.232 -4.469 0.544) 4.508 5.958 ( -1.610 17.955 -1.992) 18.137 6.010 ( 4.144 -10.110 1.488) 11.027 6.198 ( 1.234 -1.269 1.969) 2.647 6.523 ( -4.422 7.959 -3.499) 9.754 6.765 ( -3.580 10.175 -0.396) 10.793 6.875 ( -6.040 3.456 -4.461) 8.266 7.025 ( -0.496 -10.830 3.104) 11.277 7.185 ( -10.492 -7.122 -3.169) 13.071 7.389 ( -6.925 -2.843 5.811) 9.477 7.558 ( -4.243 -8.124 1.519) 9.290 8.427 ( 5.348 -7.769 -5.519) 10.927 8.717 ( 12.124 -14.781 0.634) 19.128 18.961 ( -0.436 0.809 0.517) 1.054 19.007 ( -0.168 -0.951 0.469) 1.074 19.048 ( 2.515 4.720 0.001) 5.349 19.273 ( -2.237 4.523 -0.442) 5.065 19.308 ( 2.896 -5.068 -0.012) 5.837 19.425 ( 0.500 1.133 -0.359) 1.290 19.446 ( -0.239 -1.505 -0.334) 1.560 19.504 ( -1.191 -2.313 -0.154) 2.606 42.428 ( -0.544 -0.432 0.174) 0.716 42.445 ( 2.257 -1.065 0.563) 2.559 42.589 ( -2.013 2.899 -0.283) 3.541 42.718 ( -2.118 -1.331 -0.912) 2.663 66.109 ( -0.058 13.422 0.080) 13.422 66.868 ( 1.194 -14.082 -0.219) 14.134 67.607 ( 1.823 18.223 -5.349) 19.079 68.625 ( -7.306 -15.000 -1.203) 16.729 ======================= Grid point 382 (148/216) ======================= q-point: ( 0.55 0.00 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.553 ( -10.329 18.298 7.510) 22.313 2.827 ( -2.806 9.450 9.253) 13.520 3.232 ( 3.322 24.128 -1.248) 24.387 3.501 ( 10.172 9.067 -1.902) 13.758 3.954 ( 19.144 -8.590 -0.923) 21.003 4.133 ( 9.770 -18.721 2.265) 21.238 4.408 ( 3.700 -1.838 -0.951) 4.239 4.647 ( 5.169 -3.210 1.024) 6.170 4.767 ( 8.654 6.926 0.437) 11.093 4.931 ( -11.956 4.027 -8.531) 15.230 5.106 ( 3.377 3.671 -0.778) 5.049 5.355 ( -8.371 -2.200 -1.099) 8.724 5.713 ( 3.725 -3.670 2.026) 5.608 5.819 ( -7.593 -4.609 1.148) 8.956 5.867 ( 4.805 -6.690 6.046) 10.217 6.109 ( -4.255 0.538 -0.751) 4.354 6.239 ( -1.984 10.502 2.515) 10.980 6.641 ( -0.090 15.525 -5.456) 16.457 6.785 ( 3.020 -9.312 -2.181) 10.030 6.962 ( -9.836 4.328 -0.015) 10.746 7.099 ( -7.128 8.216 -2.739) 11.217 7.311 ( -12.606 -2.110 1.769) 12.903 7.504 ( -4.095 -7.856 4.434) 9.906 7.572 ( -5.946 -5.432 0.097) 8.055 8.164 ( 11.297 -7.479 -8.646) 16.072 8.499 ( 5.862 -8.773 4.702) 11.551 18.978 ( -0.389 0.736 0.532) 0.988 19.006 ( -0.150 -0.650 0.484) 0.825 19.048 ( 2.415 4.398 0.034) 5.017 19.218 ( 3.036 -5.400 0.000) 6.195 19.342 ( -2.148 4.416 -0.344) 4.923 19.421 ( 0.570 0.711 -0.689) 1.142 19.436 ( -0.131 -0.703 -0.241) 0.755 19.501 ( -1.266 -2.724 -0.089) 3.005 42.422 ( -0.452 0.384 0.340) 0.683 42.459 ( -2.530 -1.133 0.719) 2.864 42.616 ( 1.188 2.677 -0.556) 2.981 42.702 ( 1.413 -1.728 -1.112) 2.494 66.194 ( 1.568 11.404 -1.146) 11.568 66.719 ( 4.504 -13.935 1.948) 14.774 67.675 ( -1.763 16.070 -12.118) 20.204 68.645 ( -8.088 -12.270 4.891) 15.488 ======================= Grid point 383 (149/216) ======================= q-point: ( 0.64 0.00 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.834 ( -1.182 9.299 6.172) 11.223 3.000 ( -3.577 7.727 5.280) 10.019 3.270 ( 7.485 3.570 -4.594) 9.480 3.405 ( 11.280 7.542 -6.776) 15.167 3.598 ( 14.145 3.587 3.675) 15.049 3.871 ( 6.588 -16.586 3.742) 18.234 4.276 ( 17.872 -6.232 0.864) 18.947 4.384 ( 4.912 -2.624 -1.330) 5.726 4.804 ( 6.915 10.976 -2.005) 13.127 4.977 ( -2.105 -1.738 -12.703) 12.993 5.128 ( -4.820 0.465 5.449) 7.290 5.392 ( -1.299 -5.264 2.587) 6.007 5.692 ( -3.073 0.373 -1.106) 3.288 5.784 ( 6.515 -3.670 6.942) 10.203 6.012 ( -14.482 -3.495 4.436) 15.544 6.228 ( -7.074 4.799 0.880) 8.593 6.331 ( 1.575 5.153 -0.379) 5.401 6.626 ( 4.178 -7.324 0.066) 8.432 6.684 ( 4.688 11.612 -6.874) 14.286 7.152 ( -10.813 0.130 -1.566) 10.926 7.210 ( -7.340 -2.299 -6.431) 10.026 7.442 ( 6.363 -2.148 5.886) 8.930 7.593 ( -18.082 4.332 3.620) 18.943 7.657 ( -7.591 -2.936 0.241) 8.143 7.911 ( 4.693 -3.080 -8.695) 10.349 8.445 ( 0.818 -3.818 6.363) 7.465 18.990 ( -0.099 0.328 0.202) 0.398 19.010 ( 0.009 0.123 0.581) 0.594 19.047 ( 2.149 3.818 0.024) 4.382 19.129 ( 2.728 -5.018 0.098) 5.713 19.395 ( -0.593 1.679 -0.438) 1.834 19.414 ( -0.369 0.817 -0.595) 1.076 19.441 ( -0.682 1.400 -0.121) 1.562 19.496 ( -1.202 -2.888 0.054) 3.128 42.461 ( -2.736 1.648 0.326) 3.211 42.497 ( -3.047 -1.724 0.584) 3.549 42.591 ( 3.751 2.299 -0.606) 4.441 42.635 ( 3.905 -2.153 -0.785) 4.528 66.246 ( 1.321 9.873 -1.088) 10.020 66.525 ( 8.208 -12.327 1.539) 14.890 67.727 ( -5.432 8.789 -14.686) 17.956 68.746 ( -6.734 -5.897 9.488) 13.044 ======================= Grid point 384 (150/216) ======================= q-point: (-0.27 0.00 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.812 ( 14.674 0.000 0.212) 14.676 3.054 ( 6.391 -0.000 -3.791) 7.431 3.058 ( 11.580 -0.000 -10.040) 15.326 3.170 ( 5.671 0.000 3.734) 6.790 3.634 ( -0.074 0.000 5.588) 5.588 3.771 ( 4.646 -0.000 -1.885) 5.014 4.020 ( 5.724 0.000 6.258) 8.481 4.323 ( -3.219 -0.000 -5.975) 6.787 4.756 ( 4.039 0.000 3.328) 5.234 4.826 ( 4.752 -0.000 -14.250) 15.022 5.292 ( -4.778 0.000 12.414) 13.302 5.386 ( 0.606 0.000 1.941) 2.033 5.678 ( 9.911 0.000 1.343) 10.001 5.786 ( -7.961 -0.000 0.330) 7.968 6.180 ( 6.405 -0.000 -3.439) 7.270 6.261 ( -9.708 0.000 0.517) 9.722 6.401 ( -6.078 0.000 1.664) 6.302 6.544 ( 10.856 -0.000 -8.827) 13.992 6.552 ( 6.412 0.000 6.470) 9.109 7.122 ( 9.191 0.000 3.052) 9.684 7.336 ( -10.677 -0.000 -2.310) 10.924 7.409 ( -0.571 -0.000 -2.500) 2.565 7.747 ( -5.618 0.000 0.372) 5.630 7.825 ( -3.223 -0.000 -9.057) 9.613 7.988 ( -24.017 0.000 5.735) 24.692 8.500 ( -2.414 0.000 7.080) 7.481 18.990 ( 0.223 -0.000 -0.161) 0.275 19.014 ( 0.550 0.000 0.640) 0.843 19.032 ( 2.390 -0.000 -0.236) 2.402 19.070 ( 1.345 0.000 0.301) 1.378 19.390 ( 0.364 -0.000 -0.701) 0.789 19.427 ( -0.604 0.000 0.054) 0.606 19.475 ( -1.667 -0.000 -0.215) 1.681 19.497 ( -0.972 0.000 0.256) 1.005 42.522 ( -2.810 -0.000 0.083) 2.811 42.530 ( -1.933 0.000 0.241) 1.948 42.543 ( 3.393 0.000 -0.156) 3.396 42.547 ( 4.274 -0.000 -0.246) 4.281 66.295 ( 12.099 0.000 0.053) 12.099 66.321 ( -3.094 0.000 0.524) 3.138 67.738 ( -5.752 -0.000 -13.147) 14.350 68.892 ( -3.983 0.000 10.986) 11.685 ======================= Grid point 391 (151/216) ======================= q-point: ( 0.36 0.09 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.542 ( 0.000 26.585 12.992) 29.590 2.045 ( 0.000 34.275 5.462) 34.708 2.721 ( 0.000 23.821 7.470) 24.965 3.075 ( 0.000 26.913 5.937) 27.560 3.216 ( 0.000 53.944 5.103) 54.185 4.187 ( 0.000 10.276 -10.539) 14.720 4.662 ( -0.000 -9.355 8.400) 12.573 4.909 ( -0.000 -16.879 3.492) 17.237 4.989 ( 0.000 -7.297 -8.065) 10.876 5.087 ( 0.000 -9.184 -8.919) 12.803 5.186 ( 0.000 18.311 -3.699) 18.681 5.420 ( 0.000 9.459 1.373) 9.558 5.577 ( -0.000 -13.249 5.177) 14.225 5.688 ( 0.000 17.834 9.426) 20.172 6.190 ( 0.000 -1.103 -2.334) 2.582 6.260 ( -0.000 -3.363 -2.304) 4.076 6.311 ( 0.000 0.866 -4.645) 4.725 6.338 ( -0.000 -9.948 -0.337) 9.954 6.589 ( 0.000 6.919 -0.385) 6.929 6.605 ( -0.000 -7.464 -1.278) 7.572 6.958 ( 0.000 4.313 -4.329) 6.111 7.249 ( -0.000 -15.592 5.911) 16.675 7.522 ( -0.000 -5.534 -4.627) 7.213 7.561 ( -0.000 -7.032 8.526) 11.052 8.647 ( -0.000 -10.841 -2.659) 11.162 9.206 ( -0.000 -14.121 -5.457) 15.139 18.940 ( 0.000 0.750 0.614) 0.969 19.020 ( 0.000 4.886 0.117) 4.887 19.021 ( -0.000 -0.861 0.599) 1.049 19.162 ( 0.000 3.029 -0.953) 3.176 19.415 ( 0.000 0.996 -0.274) 1.033 19.442 ( -0.000 -3.366 0.137) 3.369 19.463 ( -0.000 -1.705 -0.373) 1.745 19.513 ( -0.000 -2.041 -0.259) 2.058 42.441 ( 0.000 1.601 0.105) 1.604 42.459 ( 0.000 1.609 -0.024) 1.610 42.593 ( -0.000 -1.506 0.128) 1.511 42.620 ( -0.000 -1.510 -0.381) 1.557 65.868 ( 0.000 12.916 2.005) 13.070 67.026 ( 0.000 -5.344 -9.273) 10.702 67.445 ( 0.000 9.547 6.483) 11.540 68.662 ( 0.000 -7.941 -11.564) 14.028 ======================= Grid point 392 (152/216) ======================= q-point: ( 0.45 0.09 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.913 ( -6.125 23.801 13.638) 28.107 2.408 ( -5.359 26.973 8.234) 28.707 2.952 ( 3.860 23.960 7.720) 25.467 3.368 ( -1.759 23.305 6.807) 24.342 3.797 ( -15.298 42.305 3.311) 45.108 4.228 ( -7.109 5.840 -10.006) 13.592 4.641 ( 2.647 -13.722 3.773) 14.476 4.677 ( 13.400 -7.905 3.539) 15.955 4.774 ( -1.323 -12.594 -14.378) 19.160 5.064 ( -4.937 -8.721 2.847) 10.419 5.209 ( 9.784 14.261 -2.943) 17.543 5.422 ( 6.471 -14.352 5.522) 16.683 5.623 ( -7.806 15.247 -0.953) 17.155 5.863 ( 6.374 6.785 -1.556) 9.438 6.014 ( 8.147 1.484 3.754) 9.092 6.156 ( 2.015 8.208 -0.024) 8.452 6.178 ( 2.385 -12.425 -0.695) 12.671 6.462 ( -1.414 -5.422 -5.854) 8.103 6.620 ( -8.720 2.610 -1.850) 9.289 6.687 ( -7.261 4.397 -1.314) 8.590 7.008 ( -9.163 -0.662 -4.590) 10.270 7.179 ( -0.318 -16.036 5.927) 17.099 7.419 ( 1.536 -3.407 -0.722) 3.806 7.607 ( -2.109 -6.631 8.088) 10.669 8.514 ( 2.613 -9.484 -5.016) 11.043 8.981 ( 7.313 -14.582 -4.354) 16.884 18.954 ( -0.231 0.772 0.858) 1.177 19.019 ( -0.021 -1.012 0.790) 1.284 19.045 ( 2.040 4.950 0.054) 5.354 19.199 ( -1.879 4.086 -0.972) 4.601 19.388 ( 2.238 -4.248 -0.052) 4.802 19.420 ( 0.353 0.921 -0.371) 1.054 19.450 ( -0.503 -1.806 -0.487) 1.937 19.502 ( -1.013 -2.067 -0.338) 2.326 42.431 ( 0.993 0.712 0.318) 1.263 42.515 ( 0.822 0.105 -0.011) 0.829 42.522 ( 0.105 0.420 0.208) 0.480 42.667 ( -4.237 -0.987 -0.851) 4.433 66.000 ( -0.348 13.334 1.887) 13.471 66.926 ( -2.663 -8.188 -6.384) 10.719 67.522 ( 5.951 11.942 0.951) 13.377 68.568 ( -8.043 -9.559 -8.750) 15.252 ======================= Grid point 393 (153/216) ======================= q-point: ( 0.55 0.09 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.322 ( -9.044 19.930 12.580) 25.244 2.756 ( -4.683 17.657 11.405) 21.535 3.115 ( 5.969 22.122 3.743) 23.217 3.533 ( 5.710 12.793 1.543) 14.094 4.244 ( 7.422 8.580 -6.503) 13.076 4.315 ( -7.632 -2.330 -1.451) 8.111 4.426 ( 2.609 2.961 5.494) 6.764 4.532 ( 3.913 0.095 4.131) 5.691 4.658 ( -9.472 -7.101 -11.785) 16.705 5.062 ( 7.791 -9.420 -0.346) 12.229 5.134 ( 9.154 7.144 1.834) 11.756 5.272 ( -3.351 -7.111 3.239) 8.502 5.740 ( 0.872 -0.283 -4.773) 4.860 5.854 ( -3.065 1.966 -1.574) 3.967 5.934 ( 3.298 6.652 0.293) 7.430 6.055 ( 3.836 -3.619 4.241) 6.767 6.242 ( 0.158 -1.787 2.898) 3.408 6.452 ( -4.413 9.055 -4.684) 11.109 6.746 ( -3.920 7.721 -1.870) 8.859 6.810 ( -7.903 2.331 -3.454) 8.934 7.077 ( 1.756 -12.214 3.261) 12.763 7.138 ( -12.702 -3.819 -2.290) 13.460 7.435 ( -5.739 -1.017 -0.231) 5.833 7.642 ( -0.786 -7.077 8.327) 10.956 8.310 ( 7.970 -7.893 -8.438) 14.036 8.719 ( 7.516 -12.944 -0.465) 14.975 18.973 ( -0.303 0.746 0.933) 1.232 19.017 ( 0.085 -0.821 0.734) 1.104 19.048 ( 2.437 4.609 0.016) 5.213 19.264 ( -2.428 4.717 -0.698) 5.351 19.308 ( 2.870 -5.038 -0.033) 5.798 19.417 ( 0.485 0.869 -0.625) 1.175 19.438 ( -0.278 -1.391 -0.591) 1.537 19.500 ( -1.388 -2.435 -0.259) 2.814 42.432 ( -0.045 -0.455 0.402) 0.609 42.457 ( 1.632 -0.881 0.875) 2.050 42.583 ( -1.902 2.674 -0.490) 3.318 42.698 ( -1.755 -0.908 -1.409) 2.427 66.111 ( 0.856 11.713 0.224) 11.746 66.860 ( -2.047 -10.873 -0.903) 11.101 67.490 ( 6.380 13.229 -8.389) 16.914 68.602 ( -11.569 -9.654 -1.555) 15.148 ======================= Grid point 394 (154/216) ======================= q-point: ( 0.64 0.09 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.707 ( -8.605 15.557 10.802) 20.803 3.003 ( -0.261 7.382 11.990) 14.083 3.211 ( 3.532 17.695 -0.813) 18.062 3.465 ( 11.192 7.579 -2.881) 13.821 3.902 ( 19.175 -5.732 -4.768) 20.573 4.187 ( 11.872 -13.390 3.967) 18.330 4.405 ( 2.660 -0.469 -0.434) 2.735 4.679 ( 13.471 -8.271 1.106) 15.846 4.751 ( -1.004 3.970 -2.641) 4.873 4.785 ( -4.437 9.830 -6.521) 12.603 5.082 ( -1.139 2.398 -0.193) 2.662 5.394 ( -7.226 -2.956 4.563) 9.043 5.689 ( 4.606 0.597 -3.565) 5.855 5.856 ( -12.799 -8.251 1.298) 15.283 5.989 ( 4.828 0.956 8.458) 9.786 6.074 ( -4.493 1.851 -2.557) 5.491 6.284 ( -3.166 3.712 2.563) 5.512 6.557 ( -0.435 11.917 -4.364) 12.698 6.763 ( 2.149 -6.142 -0.584) 6.533 6.947 ( -11.520 0.900 -2.069) 11.739 7.050 ( -4.334 1.081 -2.315) 5.031 7.317 ( -14.234 2.056 -0.781) 14.403 7.536 ( -7.694 0.113 -1.308) 7.805 7.633 ( 2.836 -7.530 7.164) 10.774 8.018 ( 10.860 -6.836 -9.103) 15.733 8.563 ( 2.960 -7.788 3.110) 8.893 18.988 ( -0.119 0.508 0.700) 0.873 19.016 ( 0.207 -0.122 0.678) 0.719 19.049 ( 2.223 4.080 0.057) 4.647 19.218 ( 2.990 -5.362 0.005) 6.139 19.336 ( -2.313 4.533 -0.435) 5.108 19.408 ( 0.546 0.352 -0.898) 1.108 19.431 ( -0.388 -0.545 -0.388) 0.774 19.499 ( -1.419 -2.711 -0.121) 3.062 42.429 ( -0.462 0.372 0.510) 0.782 42.473 ( -2.239 -0.996 0.930) 2.621 42.605 ( 1.057 2.283 -0.754) 2.626 42.681 ( 1.321 -1.194 -1.369) 2.246 66.174 ( 1.101 9.172 -1.252) 9.323 66.756 ( 5.114 -11.979 2.607) 13.284 67.459 ( -1.681 11.552 -13.761) 18.045 68.722 ( -10.926 -6.769 4.250) 13.537 ======================= Grid point 395 (155/216) ======================= q-point: ( 0.73 0.09 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.974 ( 1.038 9.557 10.018) 13.885 3.067 ( 7.231 5.583 2.836) 9.566 3.205 ( 11.051 -0.360 -6.239) 12.695 3.304 ( 6.631 0.370 -0.030) 6.641 3.670 ( 8.800 11.513 4.003) 15.033 3.929 ( 10.632 -10.229 3.082) 15.073 4.259 ( 17.239 -5.340 -4.420) 18.581 4.307 ( 6.728 -5.218 -7.783) 11.536 4.759 ( -1.325 -4.588 -12.177) 13.080 4.814 ( 3.939 7.629 4.250) 9.580 5.269 ( -8.572 4.935 11.031) 14.816 5.453 ( 2.071 -2.607 3.063) 4.524 5.661 ( -6.334 0.611 -1.679) 6.581 5.906 ( 10.783 -4.990 7.304) 13.947 6.063 ( -15.994 -2.789 1.293) 16.287 6.186 ( -1.186 10.167 -3.873) 10.944 6.331 ( -3.270 -6.777 -1.021) 7.594 6.562 ( 5.300 7.295 -5.858) 10.753 6.689 ( 2.345 -2.769 5.568) 6.647 7.114 ( -9.655 -1.191 -3.121) 10.217 7.139 ( -9.821 1.099 -1.776) 10.040 7.513 ( 5.928 -1.447 1.106) 6.201 7.612 ( -10.106 4.108 -2.174) 11.123 7.661 ( -12.830 0.920 2.101) 13.034 7.785 ( 2.151 -6.097 -6.348) 9.061 8.541 ( -0.744 -2.687 5.308) 5.995 18.993 ( 0.248 0.085 0.203) 0.331 19.021 ( 0.417 0.834 0.742) 1.191 19.048 ( 1.944 3.233 0.022) 3.772 19.131 ( 2.666 -4.874 0.081) 5.556 19.387 ( -0.161 0.798 -0.588) 1.004 19.405 ( -1.101 1.914 -0.523) 2.269 19.438 ( -0.988 0.928 -0.189) 1.369 19.497 ( -1.280 -2.666 0.047) 2.958 42.467 ( -2.541 1.570 0.391) 3.013 42.507 ( -2.596 -1.598 0.642) 3.115 42.581 ( 3.231 1.891 -0.644) 3.798 42.621 ( 3.496 -1.690 -0.827) 3.970 66.229 ( -0.598 8.236 -0.979) 8.315 66.551 ( 10.554 -11.024 1.518) 15.337 67.500 ( -7.142 6.239 -12.729) 15.873 68.883 ( -8.712 -2.873 7.149) 11.630 ======================= Grid point 396 (156/216) ======================= q-point: (-0.18 0.09 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.718 ( 25.185 -0.000 -11.313) 27.609 3.025 ( 9.583 0.000 -0.150) 9.584 3.031 ( 8.740 0.000 6.792) 11.069 3.237 ( 10.860 0.000 4.810) 11.878 3.711 ( -2.171 0.000 3.694) 4.285 3.727 ( 13.538 -0.000 -3.043) 13.876 4.099 ( -3.903 0.000 1.723) 4.266 4.162 ( -7.028 -0.000 -12.175) 14.058 4.611 ( 5.023 -0.000 -10.510) 11.648 4.864 ( 1.254 0.000 8.842) 8.931 5.393 ( 2.397 -0.000 -1.843) 3.024 5.521 ( -6.453 0.000 14.779) 16.127 5.697 ( 17.259 0.000 1.172) 17.299 5.811 ( -9.376 0.000 2.843) 9.798 6.077 ( 9.922 -0.000 -6.643) 11.940 6.300 ( -13.057 0.000 1.968) 13.205 6.364 ( -5.387 -0.000 -4.923) 7.298 6.423 ( 9.642 -0.000 -5.776) 11.240 6.699 ( 5.069 0.000 9.880) 11.105 7.150 ( 3.408 0.000 0.851) 3.512 7.318 ( -11.505 -0.000 -0.117) 11.505 7.384 ( 5.866 -0.000 -1.039) 5.958 7.673 ( -4.002 -0.000 -9.117) 9.956 7.733 ( -4.819 -0.000 -1.837) 5.158 8.067 ( -27.672 0.000 3.688) 27.917 8.606 ( -2.631 0.000 5.742) 6.316 18.988 ( 0.522 -0.000 -0.120) 0.536 19.026 ( 0.657 0.000 0.781) 1.021 19.030 ( 2.393 -0.000 -0.123) 2.396 19.073 ( 1.461 0.000 -0.011) 1.462 19.379 ( 0.208 -0.000 -0.580) 0.616 19.427 ( -0.911 -0.000 -0.031) 0.911 19.472 ( -1.831 -0.000 -0.158) 1.838 19.500 ( -0.973 0.000 0.191) 0.991 42.523 ( -2.570 -0.000 0.103) 2.572 42.533 ( -1.153 0.000 0.215) 1.173 42.542 ( 2.584 0.000 -0.064) 2.585 42.543 ( 3.581 -0.000 -0.252) 3.590 66.296 ( 13.773 0.000 0.136) 13.774 66.329 ( -5.479 0.000 0.421) 5.495 67.548 ( -7.213 -0.000 -9.848) 12.207 69.048 ( -5.983 0.000 7.997) 9.987 ======================= Grid point 403 (157/216) ======================= q-point: ( 0.45 0.18 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.811 ( -0.000 20.352 19.019) 27.856 2.169 ( 0.000 32.743 9.585) 34.117 2.877 ( 0.000 24.280 10.609) 26.496 3.231 ( 0.000 24.006 13.588) 27.585 3.338 ( 0.000 45.591 9.451) 46.560 3.994 ( 0.000 11.536 -12.569) 17.060 4.725 ( 0.000 -12.835 -20.015) 23.777 4.803 ( -0.000 -10.244 8.177) 13.107 4.973 ( -0.000 -14.338 4.240) 14.952 5.038 ( -0.000 -2.941 -0.586) 2.999 5.107 ( 0.000 17.628 -5.750) 18.542 5.448 ( 0.000 6.365 1.918) 6.647 5.676 ( -0.000 -13.178 5.969) 14.467 5.820 ( 0.000 15.797 5.748) 16.810 6.129 ( 0.000 -1.390 -5.554) 5.726 6.217 ( 0.000 0.443 -5.632) 5.649 6.223 ( -0.000 -6.498 -1.888) 6.766 6.313 ( 0.000 -1.020 -2.841) 3.019 6.574 ( -0.000 -9.135 -2.286) 9.416 6.595 ( 0.000 6.160 1.228) 6.281 6.894 ( 0.000 2.119 -2.951) 3.633 7.361 ( -0.000 -13.396 4.357) 14.087 7.428 ( -0.000 -4.838 -3.612) 6.037 7.726 ( -0.000 -5.269 10.914) 12.119 8.587 ( -0.000 -12.115 -4.440) 12.903 9.091 ( -0.000 -10.546 -8.081) 13.286 18.955 ( -0.000 0.757 1.142) 1.370 19.023 ( 0.000 4.833 0.250) 4.839 19.033 ( -0.000 -0.487 0.771) 0.912 19.142 ( 0.000 3.051 -1.465) 3.384 19.410 ( 0.000 0.587 -0.402) 0.712 19.445 ( -0.000 -3.268 0.244) 3.277 19.454 ( -0.000 -1.677 -0.684) 1.811 19.507 ( -0.000 -2.214 -0.478) 2.265 42.444 ( 0.000 1.648 0.182) 1.658 42.458 ( 0.000 1.632 -0.040) 1.632 42.596 ( -0.000 -1.491 0.210) 1.506 42.614 ( -0.000 -1.436 -0.408) 1.493 65.914 ( 0.000 12.143 3.612) 12.669 66.854 ( 0.000 -0.560 -11.277) 11.291 67.552 ( -0.000 4.903 6.274) 7.963 68.432 ( 0.000 -1.510 -15.265) 15.339 ======================= Grid point 404 (158/216) ======================= q-point: ( 0.55 0.18 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.166 ( -5.810 17.951 16.799) 25.262 2.564 ( -6.882 26.416 10.596) 29.282 3.097 ( 6.803 22.278 9.367) 25.106 3.505 ( 2.755 17.542 8.860) 19.845 3.857 ( -16.302 28.427 3.414) 32.947 4.095 ( -7.799 17.571 -5.033) 19.872 4.474 ( -3.436 -11.565 -19.179) 22.658 4.682 ( 11.580 -11.272 2.791) 16.399 4.791 ( 6.904 -9.025 6.928) 13.308 5.078 ( 0.254 3.113 -1.487) 3.460 5.199 ( -1.711 2.074 1.650) 3.155 5.509 ( 7.037 -11.028 4.489) 13.830 5.606 ( -4.702 7.960 -1.003) 9.299 5.769 ( 9.687 2.164 -8.461) 13.043 6.054 ( 4.597 -0.243 0.211) 4.608 6.152 ( 1.037 -7.982 -2.820) 8.529 6.208 ( -0.961 14.298 5.399) 15.314 6.355 ( -2.503 -6.089 -6.606) 9.326 6.582 ( -9.691 -1.250 -2.476) 10.080 6.670 ( -2.301 5.663 -0.524) 6.136 6.962 ( -8.998 0.551 -0.928) 9.063 7.257 ( 2.626 -11.298 1.184) 11.659 7.392 ( -2.201 -5.424 0.805) 5.909 7.767 ( 0.064 -5.945 10.012) 11.644 8.417 ( 4.520 -10.406 -6.478) 13.064 8.897 ( 4.523 -12.078 -5.787) 14.136 18.972 ( -0.147 0.725 1.275) 1.474 19.033 ( 0.083 -0.921 0.855) 1.260 19.046 ( 2.201 4.895 0.087) 5.368 19.180 ( -2.225 4.424 -1.187) 5.092 19.386 ( 2.133 -3.955 -0.145) 4.496 19.413 ( 0.488 0.296 -0.391) 0.692 19.441 ( -0.381 -1.693 -0.701) 1.871 19.496 ( -1.310 -2.324 -0.455) 2.706 42.437 ( 0.784 0.801 0.428) 1.199 42.513 ( -2.074 1.755 -0.163) 2.722 42.528 ( 2.913 -1.241 0.443) 3.197 42.652 ( -3.366 -0.760 -0.910) 3.569 66.038 ( 0.880 11.877 2.819) 12.239 66.803 ( -5.590 -2.567 -8.468) 10.467 67.534 ( 11.628 6.007 0.341) 13.093 68.420 ( -13.460 -4.366 -8.712) 16.618 ======================= Grid point 405 (159/216) ======================= q-point: ( 0.64 0.18 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.540 ( -8.577 14.778 13.559) 21.813 2.947 ( -5.873 19.161 11.584) 23.148 3.191 ( 7.738 13.508 5.536) 16.523 3.542 ( 8.818 8.753 -0.531) 12.436 4.101 ( 8.524 2.601 -9.241) 12.838 4.331 ( 0.249 9.236 0.136) 9.241 4.433 ( -19.251 -3.457 -10.086) 22.007 4.560 ( 4.116 6.471 10.103) 12.684 4.661 ( 4.744 -4.658 8.416) 10.726 4.989 ( 8.702 0.302 -5.121) 10.102 5.189 ( 16.137 -7.319 1.664) 17.797 5.330 ( -8.268 -4.655 3.839) 10.236 5.653 ( -1.336 0.128 -5.780) 5.934 5.782 ( -6.346 6.189 -5.798) 10.593 5.941 ( 4.362 -1.930 -0.794) 4.835 6.138 ( -1.620 0.431 5.476) 5.727 6.263 ( -0.971 -5.573 -0.788) 5.712 6.401 ( -2.960 12.413 -0.819) 12.787 6.710 ( -6.329 6.573 -2.632) 9.497 6.757 ( -7.446 -0.595 -2.714) 7.948 7.113 ( -5.937 -1.123 -0.797) 6.094 7.133 ( -0.439 -9.434 3.516) 10.077 7.419 ( -4.860 -0.819 -1.011) 5.031 7.780 ( 0.400 -7.750 7.233) 10.609 8.168 ( 10.043 -7.414 -8.221) 14.947 8.701 ( 3.523 -10.793 -1.771) 11.491 18.990 ( -0.088 0.591 1.144) 1.290 19.029 ( 0.480 -0.316 0.678) 0.889 19.049 ( 2.224 4.259 0.053) 4.805 19.252 ( -2.675 4.985 -0.706) 5.701 19.307 ( 2.850 -5.026 -0.048) 5.777 19.406 ( 0.503 0.432 -0.711) 0.972 19.427 ( -0.376 -1.203 -0.692) 1.438 19.496 ( -1.639 -2.588 -0.282) 3.076 42.440 ( 0.194 -0.410 0.532) 0.700 42.472 ( 1.220 -0.711 0.927) 1.689 42.574 ( -1.744 2.374 -0.567) 3.000 42.675 ( -1.276 -0.468 -1.382) 1.939 66.116 ( 1.968 9.257 0.460) 9.475 66.834 ( -6.754 -4.777 -2.337) 8.596 67.354 ( 11.893 6.312 -7.644) 15.482 68.578 ( -15.745 -4.726 -1.256) 16.487 ======================= Grid point 406 (160/216) ======================= q-point: ( 0.73 0.18 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.877 ( -8.068 11.277 9.123) 16.598 3.205 ( 3.947 3.597 5.305) 7.527 3.225 ( 0.519 12.866 9.615) 16.070 3.414 ( 13.268 5.545 -2.201) 14.548 3.817 ( 15.405 2.305 -5.482) 16.514 4.225 ( 8.348 -7.269 -2.003) 11.248 4.363 ( 15.646 2.749 -3.340) 16.233 4.610 ( 13.709 -8.312 -7.586) 17.736 4.690 ( -1.217 -11.060 -1.942) 11.295 4.818 ( 0.490 11.768 6.970) 13.686 5.155 ( -8.270 5.690 8.968) 13.462 5.468 ( -6.815 -0.145 4.034) 7.921 5.611 ( 5.736 2.158 -6.047) 8.609 5.840 ( -13.534 -3.463 -2.978) 14.284 5.989 ( -7.781 3.796 -5.727) 10.380 6.152 ( 4.572 -3.707 7.658) 9.659 6.337 ( -4.890 -1.082 5.257) 7.261 6.503 ( -0.637 7.646 -2.330) 8.018 6.756 ( 0.506 -1.840 -0.773) 2.059 6.894 ( -12.802 1.900 -3.857) 13.504 7.048 ( -1.701 -4.422 1.880) 5.097 7.288 ( -11.870 2.638 -2.643) 12.443 7.503 ( -5.577 4.267 -2.514) 7.459 7.739 ( 2.049 -8.941 4.538) 10.234 7.882 ( 10.746 -5.907 -6.635) 13.942 8.602 ( 0.248 -5.841 1.753) 6.103 19.000 ( 0.265 0.208 0.618) 0.703 19.028 ( 0.592 0.741 0.724) 1.193 19.050 ( 1.937 3.534 0.047) 4.030 19.218 ( 2.947 -5.329 0.010) 6.089 19.329 ( -2.489 4.673 -0.377) 5.308 19.393 ( 0.480 0.049 -0.878) 1.002 19.424 ( -0.642 -0.481 -0.392) 0.893 19.497 ( -1.588 -2.713 -0.115) 3.146 42.438 ( -0.393 0.406 0.538) 0.780 42.488 ( -1.985 -0.892 0.864) 2.342 42.593 ( 0.885 1.844 -0.739) 2.175 42.660 ( 1.260 -0.658 -1.182) 1.848 66.156 ( 0.646 6.963 -0.921) 7.053 66.802 ( 6.126 -9.791 2.939) 11.918 67.244 ( -2.369 8.642 -12.112) 15.066 68.780 ( -13.470 -3.283 2.841) 14.153 ======================= Grid point 407 (161/216) ======================= q-point: (-0.18 0.18 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.995 ( 18.503 4.470 -7.241) 20.366 3.119 ( 4.333 -0.121 2.820) 5.171 3.236 ( 6.901 4.051 12.318) 14.689 3.390 ( 3.404 2.197 8.570) 9.480 3.715 ( 4.363 13.342 1.280) 14.095 3.964 ( 16.076 -4.812 0.958) 16.808 4.099 ( 13.287 -2.025 -12.411) 18.294 4.164 ( 11.519 -8.614 -11.280) 18.279 4.620 ( -0.013 -8.298 -4.399) 9.392 4.937 ( 1.190 4.478 9.974) 10.997 5.436 ( 7.462 1.879 -4.446) 8.887 5.470 ( -10.507 6.570 12.016) 17.261 5.668 ( -10.499 1.466 2.581) 10.911 5.975 ( 4.499 -4.140 -0.747) 6.160 6.048 ( -11.007 -1.599 -2.888) 11.491 6.151 ( 0.411 5.607 0.987) 5.708 6.311 ( 1.136 -11.606 -0.678) 11.681 6.487 ( 5.393 2.972 -3.301) 6.986 6.789 ( -1.572 2.665 5.548) 6.352 7.079 ( -10.151 3.047 -1.050) 10.651 7.135 ( -9.394 -0.899 1.268) 9.522 7.456 ( -8.376 -2.153 -6.441) 10.783 7.565 ( 4.965 6.560 -3.375) 8.893 7.694 ( -2.785 -7.797 -1.513) 8.417 7.725 ( -10.108 -0.562 1.492) 10.233 8.614 ( -2.211 -1.415 3.570) 4.431 18.996 ( 0.580 0.019 0.149) 0.600 19.032 ( 0.928 1.631 0.677) 1.995 19.048 ( 1.585 2.466 -0.012) 2.931 19.132 ( 2.657 -4.809 0.035) 5.494 19.377 ( 0.102 0.145 -0.526) 0.555 19.398 ( -1.681 2.614 -0.340) 3.126 19.435 ( -1.240 0.689 -0.164) 1.428 19.498 ( -1.369 -2.513 0.028) 2.862 42.473 ( -2.307 1.546 0.329) 2.797 42.517 ( -2.193 -1.532 0.502) 2.722 42.571 ( 2.692 1.539 -0.489) 3.139 42.609 ( 3.149 -1.296 -0.619) 3.461 66.215 ( -2.032 7.052 -0.640) 7.367 66.572 ( 12.635 -10.163 1.107) 16.252 67.324 ( -8.949 5.072 -8.623) 13.422 68.977 ( -10.531 -1.289 4.393) 11.483 ======================= Grid point 408 (162/216) ======================= q-point: (-0.09 0.18 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.543 ( 27.135 -0.000 -8.468) 28.425 3.033 ( 12.719 0.000 0.765) 12.742 3.186 ( 14.933 0.000 10.379) 18.186 3.329 ( 20.108 0.000 6.034) 20.994 3.674 ( 16.630 -0.000 -3.518) 16.998 3.753 ( -6.587 0.000 1.469) 6.749 3.967 ( -13.448 -0.000 -10.637) 17.146 4.053 ( -9.394 -0.000 -5.976) 11.134 4.517 ( 5.006 -0.000 -1.571) 5.247 5.019 ( 1.442 0.000 9.657) 9.764 5.321 ( 2.008 -0.000 -6.565) 6.865 5.694 ( 12.230 0.000 2.049) 12.401 5.774 ( 0.623 0.000 11.963) 11.979 5.868 ( -9.159 0.000 3.495) 9.803 5.990 ( 10.184 -0.000 -3.697) 10.834 6.257 ( -3.427 -0.000 -7.792) 8.512 6.315 ( -12.953 -0.000 0.152) 12.954 6.355 ( 8.188 -0.000 -2.655) 8.607 6.840 ( 3.747 0.000 6.580) 7.572 7.173 ( 2.986 0.000 2.698) 4.024 7.325 ( -12.582 0.000 0.698) 12.601 7.356 ( 5.452 -0.000 -3.095) 6.269 7.545 ( -2.787 -0.000 -5.847) 6.477 7.698 ( -4.075 -0.000 -2.039) 4.556 8.109 ( -30.327 0.000 1.644) 30.371 8.681 ( -2.906 0.000 3.218) 4.336 18.986 ( 0.756 -0.000 -0.062) 0.758 19.028 ( 2.371 0.000 -0.051) 2.372 19.038 ( 0.492 0.000 0.704) 0.859 19.070 ( 1.852 -0.000 -0.267) 1.871 19.371 ( 0.036 -0.000 -0.330) 0.332 19.426 ( -1.120 -0.000 -0.040) 1.121 19.470 ( -1.943 -0.000 -0.085) 1.944 19.503 ( -0.992 0.000 0.101) 0.997 42.525 ( -2.474 -0.000 0.072) 2.475 42.536 ( 0.066 0.000 0.132) 0.147 42.540 ( 2.416 -0.000 -0.159) 2.421 42.541 ( 2.056 0.000 -0.008) 2.056 66.299 ( 14.692 0.000 0.112) 14.692 66.334 ( -7.003 -0.000 0.234) 7.007 67.424 ( -8.156 -0.000 -5.294) 9.723 69.149 ( -7.735 0.000 4.254) 8.827 ======================= Grid point 409 (163/216) ======================= q-point: ( 0.00 0.27 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 216 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.471 ( 28.067 0.000 -0.000) 28.067 3.040 ( 14.077 0.000 -0.000) 14.077 3.294 ( 19.786 0.000 -0.000) 19.786 3.392 ( 29.932 0.000 -0.000) 29.932 3.632 ( 15.518 0.000 -0.000) 15.518 3.762 ( -16.270 -0.000 0.000) 16.270 3.868 ( -14.438 -0.000 0.000) 14.438 3.989 ( -11.129 -0.000 0.000) 11.129 4.512 ( 4.272 0.000 -0.000) 4.272 5.143 ( 5.941 0.000 -0.000) 5.941 5.221 ( -2.561 -0.000 0.000) 2.561 5.705 ( 19.752 0.000 -0.000) 19.752 5.901 ( -8.703 -0.000 0.000) 8.703 5.911 ( -9.600 -0.000 0.000) 9.600 5.960 ( 10.351 0.000 -0.000) 10.351 6.162 ( 0.715 0.000 -0.000) 0.715 6.316 ( -14.788 -0.000 0.000) 14.788 6.332 ( 9.322 0.000 -0.000) 9.322 6.895 ( 2.527 0.000 -0.000) 2.527 7.224 ( 10.113 0.000 -0.000) 10.113 7.299 ( -3.359 -0.000 0.000) 3.359 7.332 ( -13.144 -0.000 0.000) 13.144 7.498 ( -0.311 -0.000 0.000) 0.311 7.679 ( -3.668 -0.000 0.000) 3.668 8.123 ( -31.247 -0.000 0.000) 31.247 8.707 ( -3.027 -0.000 0.000) 3.027 18.986 ( 0.842 0.000 -0.000) 0.842 19.028 ( 2.362 0.000 -0.000) 2.362 19.045 ( 0.112 0.000 -0.000) 0.112 19.067 ( 2.327 0.000 -0.000) 2.327 19.369 ( -0.040 -0.000 0.000) 0.040 19.426 ( -1.195 -0.000 0.000) 1.195 19.469 ( -1.982 -0.000 0.000) 1.982 19.504 ( -1.001 -0.000 0.000) 1.001 42.526 ( -2.464 -0.000 0.000) 2.464 42.537 ( 3.714 0.000 -0.000) 3.714 42.538 ( -1.215 -0.000 0.000) 1.215 42.541 ( 1.884 0.000 -0.000) 1.884 66.300 ( 14.973 0.000 -0.000) 14.973 66.336 ( -7.527 -0.000 0.000) 7.527 67.380 ( -8.472 -0.000 0.000) 8.472 69.184 ( -8.433 -0.000 0.000) 8.433 ======================= Grid point 415 (164/216) ======================= q-point: ( 0.55 0.27 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.139 ( -0.000 14.324 20.822) 25.273 2.352 ( 0.000 29.468 12.762) 32.112 3.040 ( -0.000 25.949 8.956) 27.451 3.481 ( 0.000 28.835 5.301) 29.318 3.514 ( -0.000 19.732 20.432) 28.405 3.803 ( -0.000 19.933 -8.854) 21.811 4.387 ( -0.000 -13.920 -20.696) 24.942 4.900 ( 0.000 -8.572 2.406) 8.903 4.995 ( 0.000 11.826 -5.295) 12.957 5.042 ( -0.000 -2.619 1.168) 2.868 5.075 ( 0.000 -6.193 7.321) 9.589 5.475 ( -0.000 4.341 1.095) 4.477 5.731 ( -0.000 -10.294 -0.735) 10.320 5.855 ( -0.000 8.165 -1.581) 8.316 6.016 ( 0.000 -4.312 -6.710) 7.976 6.163 ( 0.000 0.250 -0.957) 0.989 6.171 ( 0.000 -5.366 -6.442) 8.384 6.278 ( -0.000 7.585 0.492) 7.601 6.548 ( 0.000 -9.115 -0.283) 9.119 6.629 ( 0.000 5.103 2.898) 5.869 6.865 ( -0.000 1.526 -0.872) 1.758 7.255 ( 0.000 0.845 -9.899) 9.935 7.538 ( 0.000 -15.870 9.506) 18.499 7.893 ( -0.000 -5.075 8.801) 10.159 8.515 ( 0.000 -13.469 -3.839) 14.006 8.954 ( 0.000 -8.148 -8.512) 11.783 18.976 ( -0.000 0.757 1.495) 1.675 19.028 ( -0.000 4.738 0.413) 4.756 19.043 ( 0.000 0.280 0.471) 0.548 19.117 ( 0.000 2.872 -1.558) 3.268 19.403 ( 0.000 0.065 -0.315) 0.322 19.441 ( -0.000 -1.630 -0.876) 1.850 19.450 ( 0.000 -3.214 0.352) 3.233 19.497 ( -0.000 -2.451 -0.624) 2.529 42.447 ( 0.000 1.707 0.213) 1.720 42.457 ( -0.000 1.669 -0.050) 1.670 42.600 ( -0.000 -1.478 0.222) 1.495 42.608 ( -0.000 -1.451 -0.218) 1.467 65.984 ( 0.000 11.037 4.896) 12.074 66.668 ( -0.000 2.220 -11.425) 11.639 67.646 ( 0.000 2.588 5.248) 5.852 68.197 ( -0.000 1.944 -12.979) 13.123 ======================= Grid point 416 (165/216) ======================= q-point: ( 0.64 0.27 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.446 ( -4.930 11.805 17.237) 21.466 2.749 ( -7.527 23.934 12.088) 27.850 3.232 ( 6.971 18.844 6.196) 21.025 3.573 ( 5.467 10.875 -2.016) 12.338 3.938 ( -13.536 17.785 6.786) 23.357 4.075 ( -11.032 17.398 0.138) 20.601 4.172 ( -1.642 -0.931 -14.274) 14.398 4.760 ( 13.109 -2.379 6.655) 14.893 4.879 ( 2.281 -5.158 2.488) 6.165 5.059 ( 7.290 1.629 1.144) 7.557 5.232 ( -11.335 -2.667 1.914) 11.801 5.537 ( 6.950 5.891 -3.003) 9.593 5.590 ( 7.115 -8.107 -2.012) 10.973 5.629 ( 0.863 -5.192 -5.329) 7.490 6.040 ( 4.088 -0.951 -3.236) 5.299 6.080 ( -5.183 -1.097 -4.933) 7.238 6.234 ( -6.149 1.208 -2.516) 6.753 6.310 ( 0.902 3.454 1.316) 3.805 6.555 ( -5.020 -2.232 -0.472) 5.514 6.681 ( -0.124 6.224 2.266) 6.625 6.968 ( -8.076 2.859 0.962) 8.621 7.199 ( 0.259 2.576 -5.866) 6.412 7.477 ( 0.219 -15.374 7.582) 17.143 7.894 ( 0.012 -8.022 4.208) 9.059 8.329 ( 7.365 -10.416 -3.086) 13.125 8.798 ( 1.616 -10.123 -6.275) 12.019 18.995 ( -0.029 0.603 1.461) 1.581 19.044 ( 0.139 -0.667 0.490) 0.839 19.047 ( 2.449 4.824 0.102) 5.411 19.162 ( -2.622 4.785 -1.034) 5.553 19.383 ( 1.853 -3.421 -0.238) 3.898 19.408 ( 0.705 -0.648 -0.205) 0.979 19.429 ( -0.105 -1.592 -0.736) 1.757 19.488 ( -1.686 -2.600 -0.435) 3.129 42.444 ( 0.535 0.898 0.409) 1.123 42.510 ( -2.615 2.103 -0.164) 3.360 42.535 ( 3.377 -1.595 0.441) 3.761 42.639 ( -2.480 -0.650 -0.687) 2.654 66.090 ( 2.558 9.798 3.475) 10.706 66.661 ( -7.628 2.319 -8.640) 11.756 67.533 ( 16.227 1.334 -0.283) 16.284 68.300 ( -18.718 -0.760 -5.851) 19.625 ======================= Grid point 417 (166/216) ======================= q-point: ( 0.73 0.27 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.748 ( -7.509 8.785 11.658) 16.416 3.105 ( -1.957 19.550 6.037) 20.554 3.293 ( -2.458 -0.251 7.203) 7.615 3.539 ( 12.214 14.154 1.477) 18.753 3.951 ( 10.621 1.039 -9.172) 14.072 4.165 ( -2.731 6.589 -13.917) 15.638 4.471 ( -13.370 5.547 8.084) 16.579 4.713 ( 13.766 9.015 6.855) 17.826 4.811 ( 3.109 -5.241 9.140) 10.986 4.925 ( 8.037 -2.878 -2.110) 8.794 5.201 ( 11.732 -4.763 1.408) 12.740 5.380 ( -8.233 -1.951 1.423) 8.580 5.555 ( -3.211 0.855 -5.996) 6.855 5.690 ( -6.961 -0.334 -4.761) 8.440 5.881 ( 3.405 -2.679 -6.652) 7.939 6.217 ( -4.697 0.468 3.287) 5.752 6.258 ( -7.500 -0.019 1.871) 7.730 6.400 ( -0.719 10.195 -0.340) 10.226 6.650 ( -12.494 -1.315 -4.263) 13.267 6.748 ( 1.108 4.098 1.451) 4.487 7.089 ( -5.336 -0.623 -2.318) 5.851 7.205 ( 0.477 -0.648 5.219) 5.281 7.414 ( -0.718 -5.449 0.415) 5.511 7.824 ( -0.633 -10.375 -2.924) 10.798 8.090 ( 11.907 -6.724 -0.166) 13.676 8.666 ( 0.311 -8.386 -2.246) 8.687 19.008 ( 0.224 0.293 1.024) 1.088 19.038 ( 0.925 0.809 0.414) 1.296 19.050 ( 1.826 3.500 0.032) 3.948 19.242 ( -2.885 5.229 -0.503) 5.993 19.306 ( 2.823 -5.008 -0.044) 5.749 19.395 ( 0.586 -0.109 -0.564) 0.821 19.417 ( -0.536 -0.962 -0.570) 1.240 19.492 ( -1.863 -2.723 -0.215) 3.307 42.449 ( 0.268 -0.345 0.476) 0.646 42.486 ( 0.980 -0.572 0.713) 1.341 42.565 ( -1.585 2.089 -0.476) 2.665 42.655 ( -0.841 -0.150 -0.972) 1.294 66.126 ( 2.977 6.581 0.620) 7.249 66.786 ( -10.647 3.082 -3.333) 11.574 67.256 ( 15.908 -1.075 -4.280) 16.509 68.562 ( -18.629 -1.614 -0.760) 18.714 ======================= Grid point 418 (167/216) ======================= q-point: ( 0.82 0.27 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.995 ( -6.650 5.085 5.717) 10.137 3.182 ( 2.794 4.045 -4.220) 6.479 3.440 ( 15.854 10.916 6.566) 20.338 3.478 ( -2.997 0.296 15.502) 15.792 3.722 ( 12.575 9.903 -6.075) 17.121 4.068 ( 4.084 3.617 -14.557) 15.546 4.365 ( 26.053 -2.732 1.951) 26.269 4.497 ( 22.519 -8.648 -5.602) 24.765 4.668 ( -2.733 -12.801 -0.754) 13.111 4.974 ( -1.585 8.716 10.844) 14.002 5.331 ( -9.668 6.838 10.766) 16.005 5.490 ( -0.573 1.448 -6.418) 6.604 5.525 ( -0.957 3.350 1.492) 3.790 5.770 ( -13.523 0.119 -5.837) 14.730 5.881 ( -9.590 -1.740 -6.172) 11.536 6.230 ( 2.124 -0.715 2.410) 3.291 6.463 ( -4.472 -0.655 5.146) 6.849 6.483 ( -1.795 -1.269 3.514) 4.145 6.721 ( -3.713 -2.144 -3.907) 5.801 6.845 ( -9.768 8.200 -1.686) 12.865 7.093 ( -2.114 -4.910 3.126) 6.193 7.240 ( -7.385 -2.593 -2.854) 8.331 7.458 ( -2.256 9.042 -2.714) 9.706 7.725 ( -1.377 -8.947 -3.986) 9.891 7.862 ( 10.909 -7.301 2.289) 13.325 8.622 ( -1.748 -3.844 0.754) 4.290 19.008 ( 0.641 0.053 0.337) 0.726 19.039 ( 0.943 1.633 0.600) 1.979 19.050 ( 1.586 2.839 -0.074) 3.252 19.218 ( 2.920 -5.311 0.009) 6.061 19.324 ( -2.626 4.810 -0.206) 5.484 19.381 ( 0.416 -0.206 -0.565) 0.731 19.419 ( -0.831 -0.450 -0.245) 0.976 19.496 ( -1.719 -2.723 -0.070) 3.221 42.446 ( -0.295 0.458 0.359) 0.652 42.499 ( -1.823 -0.837 0.528) 2.074 42.583 ( 0.728 1.503 -0.476) 1.737 42.644 ( 1.239 -0.275 -0.673) 1.437 66.145 ( 0.329 5.284 -0.439) 5.313 66.852 ( 8.644 -7.825 3.284) 12.113 67.075 ( -4.785 6.780 -8.443) 11.838 68.814 ( -15.194 -1.417 1.391) 15.323 ======================= Grid point 419 (168/216) ======================= q-point: (-0.09 0.27 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.898 ( 23.502 0.330 -3.380) 23.746 3.152 ( -0.907 -1.322 1.164) 1.980 3.446 ( 11.533 13.698 10.985) 21.007 3.546 ( 1.998 1.421 7.589) 7.975 3.714 ( 0.977 12.109 0.054) 12.149 3.895 ( 11.335 -1.833 -10.025) 15.243 3.948 ( 9.709 -10.543 -7.328) 16.097 4.004 ( 24.653 -4.642 -2.157) 25.179 4.590 ( 0.346 -9.727 -0.356) 9.739 5.113 ( 1.203 3.835 10.821) 11.543 5.308 ( 7.118 3.172 -9.517) 12.301 5.671 ( -10.378 5.455 10.992) 16.071 5.713 ( -10.068 4.293 1.889) 11.107 5.887 ( -5.057 0.162 -8.016) 9.479 6.002 ( -9.347 -0.086 -1.782) 9.516 6.186 ( 1.491 -2.655 1.508) 3.398 6.314 ( 10.865 -13.314 0.623) 17.196 6.452 ( 5.591 1.170 -1.032) 5.805 6.849 ( -5.479 4.463 1.786) 7.289 7.072 ( -11.683 8.027 -0.124) 14.175 7.181 ( -6.479 -0.223 3.514) 7.373 7.353 ( -10.457 -7.673 -5.031) 13.912 7.513 ( 2.868 7.585 -2.183) 8.397 7.662 ( -2.924 -7.999 -1.230) 8.605 7.761 ( -7.701 -0.648 1.352) 7.845 8.654 ( -3.080 -0.612 1.262) 3.385 18.998 ( 0.778 0.025 0.055) 0.780 19.041 ( 1.874 3.061 0.360) 3.607 19.047 ( 0.715 1.059 -0.090) 1.281 19.132 ( 2.684 -4.816 0.004) 5.513 19.371 ( 0.150 -0.115 -0.211) 0.283 19.394 ( -1.938 2.866 -0.119) 3.462 19.433 ( -1.380 0.596 -0.064) 1.505 19.498 ( -1.427 -2.440 0.009) 2.826 42.476 ( -2.137 1.553 0.131) 2.645 42.523 ( -1.954 -1.521 0.192) 2.484 42.566 ( 2.332 1.337 -0.184) 2.695 42.602 ( 2.957 -1.068 -0.229) 3.152 66.208 ( -2.781 6.417 -0.218) 6.998 66.585 ( 13.970 -9.725 0.411) 17.027 67.227 ( -10.215 4.603 -3.058) 11.614 69.025 ( -11.618 -0.581 1.481) 11.726 ======================= Grid point 427 (169/216) ======================= q-point: ( 0.64 0.36 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.481 ( 0.000 10.294 20.813) 23.220 2.580 ( 0.000 24.989 14.905) 29.096 3.150 ( -0.000 25.917 3.623) 26.169 3.407 ( -0.000 13.193 -12.526) 18.192 3.780 ( 0.000 25.058 3.349) 25.280 3.857 ( -0.000 10.279 18.521) 21.182 4.089 ( -0.000 -5.659 -12.378) 13.611 4.803 ( 0.000 16.778 -11.536) 20.361 5.007 ( 0.000 -5.864 4.883) 7.631 5.076 ( -0.000 -3.885 2.850) 4.818 5.228 ( 0.000 -7.111 10.506) 12.686 5.476 ( -0.000 3.873 -1.186) 4.051 5.637 ( 0.000 -2.397 -9.112) 9.422 5.781 ( -0.000 1.125 -7.112) 7.200 5.946 ( 0.000 -8.108 -2.391) 8.453 6.036 ( 0.000 -0.764 -8.472) 8.506 6.180 ( 0.000 -1.165 2.727) 2.965 6.299 ( -0.000 3.889 0.568) 3.931 6.581 ( 0.000 -4.315 4.532) 6.258 6.682 ( 0.000 3.110 3.285) 4.524 6.857 ( -0.000 3.544 -0.326) 3.559 7.087 ( -0.000 5.244 -10.323) 11.579 7.692 ( 0.000 -16.695 9.230) 19.076 7.984 ( -0.000 -8.002 1.666) 8.173 8.489 ( -0.000 -12.580 1.341) 12.651 8.817 ( 0.000 -7.373 -8.359) 11.146 19.002 ( -0.000 0.793 1.571) 1.759 19.037 ( -0.000 4.522 0.638) 4.567 19.046 ( 0.000 1.230 -0.083) 1.233 19.092 ( 0.000 2.618 -1.470) 3.002 19.400 ( 0.000 -0.508 -0.015) 0.508 19.426 ( -0.000 -1.539 -0.900) 1.783 19.457 ( 0.000 -3.159 0.471) 3.194 19.487 ( -0.000 -2.698 -0.685) 2.783 42.450 ( 0.000 1.753 0.197) 1.764 42.457 ( -0.000 1.715 -0.067) 1.716 42.603 ( -0.000 -1.479 0.165) 1.488 42.606 ( -0.000 -1.492 -0.058) 1.493 66.074 ( 0.000 9.636 6.192) 11.453 66.487 ( -0.000 4.321 -10.629) 11.474 67.725 ( 0.000 1.511 4.615) 4.856 68.016 ( -0.000 2.445 -9.251) 9.569 ======================= Grid point 428 (170/216) ======================= q-point: ( 0.73 0.36 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.717 ( -1.965 7.188 15.467) 17.169 2.947 ( -5.324 20.378 11.181) 23.846 3.254 ( -0.582 6.178 -3.859) 7.308 3.511 ( -0.445 20.520 -4.212) 20.953 3.876 ( -8.349 -4.266 -10.169) 13.831 3.982 ( 1.070 12.950 -3.311) 13.410 4.293 ( -4.284 20.203 16.571) 26.479 4.782 ( 7.411 13.672 -7.113) 17.101 4.946 ( 0.745 -2.131 8.645) 8.935 5.126 ( 4.488 -7.617 5.045) 10.179 5.262 ( -4.829 -3.067 1.896) 6.027 5.411 ( 11.331 2.632 -8.468) 14.388 5.520 ( -1.314 -7.012 -5.114) 8.777 5.643 ( 1.692 -7.483 3.253) 8.333 5.910 ( 3.306 -3.217 -9.706) 10.747 6.041 ( -12.038 2.590 -1.496) 12.404 6.221 ( -2.597 -1.869 0.950) 3.337 6.312 ( -1.606 3.594 -1.085) 4.083 6.559 ( 2.357 -1.581 0.463) 2.875 6.750 ( -0.074 6.253 6.021) 8.682 6.959 ( -6.130 1.685 -3.195) 7.115 7.120 ( -3.109 13.013 -2.722) 13.653 7.609 ( 1.943 -18.239 8.309) 20.137 7.879 ( 0.162 -12.777 -5.307) 13.836 8.339 ( 10.062 -8.566 3.434) 13.653 8.699 ( -1.518 -8.776 -5.452) 10.443 19.018 ( 0.129 0.352 1.321) 1.373 19.047 ( 0.100 -0.111 -0.159) 0.219 19.049 ( 2.710 4.579 0.072) 5.321 19.148 ( -2.973 5.110 -0.597) 5.942 19.379 ( 1.643 -3.133 -0.169) 3.542 19.407 ( 0.395 -1.168 -0.028) 1.233 19.418 ( 0.631 -1.659 -0.520) 1.850 19.482 ( -2.027 -2.809 -0.268) 3.474 42.449 ( 0.322 0.975 0.252) 1.058 42.508 ( -2.666 2.177 -0.097) 3.443 42.541 ( 3.387 -1.669 0.271) 3.786 42.631 ( -1.837 -0.627 -0.358) 1.974 66.147 ( 4.918 7.145 3.270) 9.270 66.534 ( -9.613 6.407 -6.359) 13.187 67.527 ( 18.682 -1.454 -0.352) 18.742 68.231 ( -22.073 0.995 -2.706) 22.260 ======================= Grid point 429 (171/216) ======================= q-point: ( 0.82 0.36 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.910 ( -5.661 2.766 7.361) 9.689 3.112 ( 2.025 11.655 -3.324) 12.288 3.429 ( -15.841 -4.443 7.860) 18.233 3.590 ( 12.223 23.497 1.964) 26.559 3.839 ( 10.089 2.490 -1.442) 10.491 3.950 ( 3.259 8.320 -11.764) 14.773 4.600 ( -7.687 1.945 5.864) 9.862 4.767 ( 12.068 7.687 1.006) 14.343 4.864 ( 19.335 -3.431 -1.968) 19.735 4.976 ( 6.028 1.583 5.844) 8.544 5.259 ( -5.135 0.227 4.638) 6.923 5.350 ( -6.147 -0.593 -4.508) 7.646 5.490 ( -6.504 -3.287 -1.423) 7.425 5.651 ( -0.046 -4.366 0.335) 4.379 5.754 ( -1.629 -3.941 -7.151) 8.326 6.246 ( -1.270 -0.087 0.946) 1.586 6.311 ( -15.184 6.922 3.057) 16.965 6.381 ( -2.106 8.132 -1.648) 8.560 6.594 ( -11.488 -5.796 -2.047) 13.029 6.782 ( 6.293 6.602 1.808) 9.298 7.049 ( -8.285 -1.725 -1.882) 8.670 7.283 ( -0.676 13.231 3.297) 13.653 7.426 ( 7.248 -16.905 0.792) 18.411 7.741 ( -2.286 -10.935 -4.436) 12.020 8.119 ( 11.731 -8.169 1.791) 14.407 8.636 ( -1.843 -6.399 -1.123) 6.753 19.021 ( 0.652 -0.017 0.432) 0.782 19.043 ( 0.658 1.171 0.291) 1.374 19.049 ( 1.875 3.524 -0.164) 3.995 19.236 ( -3.001 5.372 -0.179) 6.157 19.306 ( 2.796 -4.989 -0.019) 5.719 19.389 ( 0.687 -0.530 -0.215) 0.894 19.410 ( -0.680 -0.765 -0.224) 1.048 19.489 ( -1.995 -2.801 -0.080) 3.439 42.454 ( 0.270 -0.301 0.197) 0.450 42.494 ( 0.880 -0.495 0.271) 1.045 42.559 ( -1.486 1.915 -0.193) 2.432 42.644 ( -0.588 0.010 -0.348) 0.683 66.134 ( 3.631 4.623 0.327) 5.887 66.741 ( -12.095 8.331 -1.664) 14.781 67.213 ( 17.188 -5.450 -1.209) 18.072 68.554 ( -20.038 -0.217 -0.251) 20.041 ======================= Grid point 430 (172/216) ======================= q-point: (-0.09 0.36 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.062 ( -9.571 -1.541 0.000) 9.694 3.119 ( 7.705 6.420 -0.000) 10.029 3.556 ( 1.124 -6.936 0.000) 7.027 3.571 ( 16.414 24.077 -0.000) 29.140 3.750 ( -4.716 -1.166 0.000) 4.858 3.847 ( 13.290 12.746 -0.000) 18.414 4.388 ( 28.583 -3.960 -0.000) 28.856 4.444 ( 25.456 -7.993 -0.000) 26.681 4.663 ( -4.472 -13.323 0.000) 14.054 5.095 ( -1.325 12.009 -0.000) 12.082 5.364 ( 3.218 -0.477 -0.000) 3.253 5.500 ( -11.193 6.330 0.000) 12.859 5.542 ( -4.744 4.371 0.000) 6.450 5.680 ( -10.861 1.197 0.000) 10.927 5.829 ( -12.167 -4.559 0.000) 12.993 6.248 ( 1.894 -0.432 -0.000) 1.942 6.463 ( -1.756 3.707 0.000) 4.102 6.608 ( 1.197 -19.630 0.000) 19.667 6.638 ( -14.034 8.380 0.000) 16.346 6.834 ( -6.175 11.778 0.000) 13.299 7.126 ( -4.538 -1.291 0.000) 4.718 7.211 ( -3.219 -9.538 0.000) 10.067 7.432 ( -0.483 12.102 -0.000) 12.112 7.688 ( -2.615 -8.785 0.000) 9.166 7.884 ( 10.142 -8.298 -0.000) 13.104 8.628 ( -2.496 -2.990 0.000) 3.895 19.010 ( 0.798 0.046 -0.000) 0.800 19.046 ( 2.496 4.374 -0.000) 5.036 19.047 ( 0.018 0.129 -0.000) 0.131 19.218 ( 2.912 -5.307 -0.000) 6.053 19.323 ( -2.680 4.877 0.000) 5.565 19.376 ( 0.391 -0.320 -0.000) 0.506 19.417 ( -0.901 -0.440 0.000) 1.003 19.495 ( -1.768 -2.729 0.000) 3.251 42.449 ( -0.248 0.483 0.000) 0.543 42.504 ( -1.770 -0.824 0.000) 1.952 42.578 ( 0.664 1.376 -0.000) 1.528 42.639 ( 1.237 -0.138 -0.000) 1.245 66.141 ( 0.218 4.637 -0.000) 4.642 66.893 ( 15.653 -8.615 -0.000) 17.867 66.991 ( -11.777 7.715 0.000) 14.079 68.826 ( -15.801 -0.833 0.000) 15.823 ======================= Grid point 439 (173/216) ======================= q-point: ( 0.73 0.45 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.794 ( -0.000 10.942 15.787) 19.209 2.818 ( -0.000 19.580 12.649) 23.311 3.127 ( -0.000 19.722 -5.739) 20.541 3.177 ( -0.000 15.930 -13.326) 20.769 3.818 ( 0.000 10.387 1.165) 10.452 3.856 ( -0.000 -6.718 -5.208) 8.500 4.264 ( -0.000 20.716 20.406) 29.078 4.572 ( 0.000 19.472 -16.743) 25.681 5.098 ( 0.000 -4.012 4.921) 6.349 5.122 ( -0.000 -5.462 1.905) 5.784 5.396 ( 0.000 -7.749 8.262) 11.328 5.442 ( -0.000 3.429 -2.147) 4.045 5.512 ( 0.000 4.258 -2.711) 5.048 5.629 ( -0.000 -0.852 -10.947) 10.981 5.921 ( -0.000 -5.962 -0.612) 5.994 5.937 ( 0.000 -2.426 -3.169) 3.991 6.234 ( 0.000 -2.122 3.489) 4.083 6.283 ( -0.000 -0.757 -2.270) 2.393 6.677 ( -0.000 -2.048 5.963) 6.305 6.722 ( 0.000 -0.645 0.808) 1.034 6.858 ( -0.000 8.305 1.104) 8.378 6.932 ( 0.000 9.413 -8.078) 12.404 7.834 ( 0.000 -16.012 8.130) 17.958 7.948 ( -0.000 -13.080 -5.344) 14.129 8.559 ( -0.000 -9.507 6.622) 11.586 8.682 ( 0.000 -7.789 -8.101) 11.238 19.025 ( -0.000 1.188 1.229) 1.709 19.040 ( 0.000 1.712 -0.649) 1.831 19.050 ( -0.000 3.812 1.009) 3.943 19.069 ( 0.000 2.791 -1.341) 3.097 19.403 ( 0.000 -1.011 0.390) 1.084 19.413 ( -0.000 -1.353 -0.731) 1.538 19.465 ( 0.000 -3.064 0.585) 3.120 19.476 ( -0.000 -2.910 -0.666) 2.985 42.453 ( 0.000 1.770 0.152) 1.777 42.455 ( -0.000 1.754 -0.102) 1.757 42.605 ( -0.000 -1.493 0.078) 1.495 42.606 ( -0.000 -1.505 -0.020) 1.505 66.186 ( 0.000 7.989 7.682) 11.083 66.324 ( -0.000 6.201 -9.262) 11.146 67.801 ( 0.000 1.344 4.871) 5.053 67.891 ( 0.000 1.836 -6.369) 6.628 ======================= Grid point 440 (174/216) ======================= q-point: ( 0.82 0.45 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.888 ( 1.358 5.393 -0.000) 5.562 3.033 ( 5.059 17.924 -0.000) 18.625 3.209 ( -15.923 -0.760 0.000) 15.941 3.444 ( -7.453 22.323 0.000) 23.534 3.807 ( 1.011 6.279 -0.000) 6.360 3.941 ( 0.793 7.394 -0.000) 7.436 4.512 ( 2.443 16.494 -0.000) 16.674 4.643 ( -1.697 18.608 -0.000) 18.685 5.044 ( -0.093 -1.542 0.000) 1.545 5.171 ( -3.866 -7.011 0.000) 8.007 5.266 ( 19.977 5.623 -0.000) 20.753 5.356 ( 1.844 -8.318 0.000) 8.520 5.454 ( -4.901 -9.696 0.000) 10.864 5.695 ( -2.145 -1.261 0.000) 2.488 5.798 ( 5.418 -6.662 -0.000) 8.587 6.027 ( -13.902 2.962 0.000) 14.214 6.238 ( -0.867 -2.404 0.000) 2.555 6.295 ( -2.659 3.421 0.000) 4.333 6.563 ( 4.892 -1.453 -0.000) 5.103 6.847 ( 7.423 7.765 -0.000) 10.742 6.882 ( -11.994 -0.564 0.000) 12.007 7.105 ( -5.316 17.054 -0.000) 17.863 7.721 ( 4.557 -20.547 0.000) 21.047 7.785 ( -1.382 -13.275 0.000) 13.347 8.381 ( 12.161 -8.111 -0.000) 14.618 8.646 ( -4.201 -8.126 0.000) 9.148 19.033 ( 0.438 -0.055 -0.000) 0.442 19.042 ( -0.154 0.195 0.000) 0.249 19.050 ( 2.817 4.700 -0.000) 5.480 19.143 ( -3.122 5.251 0.000) 6.109 19.378 ( 1.610 -3.130 -0.000) 3.519 19.407 ( -0.574 -0.998 0.000) 1.151 19.413 ( 1.730 -1.963 -0.000) 2.616 19.480 ( -2.170 -2.886 0.000) 3.611 42.452 ( 0.235 1.005 -0.000) 1.033 42.507 ( -2.653 2.188 0.000) 3.439 42.544 ( 3.363 -1.681 -0.000) 3.760 42.628 ( -1.603 -0.627 0.000) 1.722 66.179 ( 6.912 5.287 -0.000) 8.702 66.476 ( -11.366 8.683 0.000) 14.303 67.524 ( 19.360 -2.354 -0.000) 19.502 68.209 ( -23.147 1.477 0.000) 23.194 ======================= Grid point 459 (175/216) ======================= q-point: ( 0.36 0.64 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.816 ( 5.989 -0.000 2.103) 6.347 3.102 ( 1.115 0.000 -4.973) 5.096 3.152 ( 5.238 -0.000 7.941) 9.513 3.230 ( 13.043 0.000 9.018) 15.857 3.542 ( 2.153 -0.000 -5.142) 5.574 3.740 ( -6.710 0.000 -6.921) 9.640 3.975 ( 16.168 0.000 2.585) 16.373 4.328 ( 0.550 0.000 -4.548) 4.581 4.770 ( 5.689 -0.000 3.874) 6.883 4.979 ( 4.262 0.000 -0.261) 4.270 5.196 ( -3.074 -0.000 4.861) 5.752 5.359 ( -0.222 0.000 -0.755) 0.787 5.655 ( 2.828 0.000 -1.243) 3.089 5.785 ( -6.737 -0.000 -0.589) 6.763 6.133 ( -6.729 -0.000 -5.003) 8.385 6.296 ( -3.154 0.000 -8.900) 9.442 6.342 ( 3.659 0.000 6.786) 7.710 6.513 ( 4.284 -0.000 -0.284) 4.293 6.695 ( 12.432 0.000 9.152) 15.437 7.048 ( 13.456 -0.000 -5.744) 14.631 7.400 ( -10.660 -0.000 5.778) 12.125 7.468 ( -5.999 0.000 4.581) 7.548 7.717 ( -6.622 -0.000 -3.260) 7.381 7.847 ( -15.641 0.000 -8.068) 17.599 7.995 ( -6.516 0.000 8.260) 10.521 8.381 ( -2.462 0.000 -7.386) 7.786 18.993 ( -0.002 -0.000 0.175) 0.175 19.005 ( 0.326 0.000 -0.441) 0.549 19.037 ( 2.286 -0.000 0.390) 2.319 19.064 ( 1.452 0.000 -0.517) 1.541 19.401 ( 0.411 0.000 0.690) 0.803 19.424 ( -0.254 -0.000 -0.209) 0.329 19.478 ( -1.477 -0.000 0.253) 1.498 19.492 ( -1.018 0.000 -0.288) 1.058 42.521 ( -3.076 -0.000 -0.023) 3.076 42.526 ( -2.576 0.000 -0.211) 2.585 42.546 ( 4.228 0.000 0.213) 4.234 42.551 ( 4.778 -0.000 0.137) 4.780 66.295 ( 9.666 0.000 0.101) 9.667 66.312 ( -0.077 -0.000 -0.526) 0.532 67.969 ( -4.091 -0.000 14.981) 15.529 68.694 ( -2.532 -0.000 -13.228) 13.468 ======================= Grid point 471 (176/216) ======================= q-point: ( 0.36 -0.27 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.781 ( -5.979 9.964 -0.316) 11.625 2.907 ( -7.153 9.334 -5.799) 13.112 3.374 ( 6.513 7.407 6.687) 11.917 3.428 ( 8.275 18.503 -1.675) 20.338 3.590 ( 19.279 -7.929 0.971) 20.869 3.815 ( 6.248 -21.208 -3.062) 22.321 4.262 ( 13.588 -3.085 0.094) 13.934 4.374 ( 9.614 -4.044 -1.988) 10.617 4.829 ( 4.246 10.960 0.624) 11.770 5.037 ( -0.739 -11.452 -2.486) 11.742 5.188 ( -0.885 13.038 8.429) 15.550 5.421 ( -0.519 -8.064 6.533) 10.391 5.654 ( -0.420 -1.523 -5.041) 5.283 5.704 ( -2.165 -5.187 -4.302) 7.078 5.953 ( -11.184 -0.831 -1.414) 11.304 6.146 ( -7.095 -2.850 -6.923) 10.315 6.368 ( 1.833 15.030 2.759) 15.391 6.640 ( 3.483 -13.092 1.365) 13.616 6.795 ( 6.161 19.953 5.825) 21.680 7.163 ( -7.883 -1.557 -0.536) 8.053 7.326 ( -8.420 0.251 6.738) 10.787 7.366 ( -1.078 -1.241 -2.013) 2.599 7.520 ( -12.765 1.045 -4.811) 13.681 7.627 ( -7.476 -8.530 -3.290) 11.810 8.053 ( 4.883 -0.414 8.341) 9.674 8.337 ( 1.815 -4.784 -6.736) 8.459 18.987 ( -0.331 0.706 -0.136) 0.791 19.002 ( -0.313 -0.528 -0.298) 0.682 19.047 ( 2.272 4.226 -0.014) 4.798 19.128 ( 2.803 -5.167 -0.066) 5.879 19.401 ( -0.857 2.243 0.225) 2.412 19.423 ( 0.092 -0.280 0.435) 0.526 19.442 ( -0.415 2.180 0.010) 2.219 19.496 ( -1.161 -3.111 -0.037) 3.321 42.456 ( -2.843 1.753 -0.180) 3.345 42.489 ( -3.412 -1.867 -0.348) 3.905 42.600 ( 4.113 2.634 0.368) 4.898 42.645 ( 4.240 -2.539 0.480) 4.965 66.262 ( 3.213 11.648 0.773) 12.107 66.503 ( 6.106 -13.859 -1.027) 15.179 67.961 ( -4.230 14.810 13.133) 20.242 68.582 ( -5.218 -12.299 -10.005) 16.691 ======================= Grid point 472 (177/216) ======================= q-point: ( 0.45 -0.27 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.887 ( 1.822 0.000 6.251) 6.511 3.001 ( 0.393 -0.000 -7.145) 7.156 3.289 ( 3.462 -0.000 7.304) 8.083 3.326 ( 9.052 -0.000 2.518) 9.396 3.494 ( 4.371 0.000 0.482) 4.398 3.589 ( -0.887 -0.000 -9.719) 9.759 4.075 ( 10.499 -0.000 8.294) 13.380 4.216 ( 5.439 -0.000 -8.385) 9.995 4.838 ( 3.870 0.000 3.937) 5.521 4.907 ( 2.072 -0.000 -4.946) 5.362 5.329 ( 1.934 0.000 6.332) 6.621 5.364 ( 1.465 -0.000 0.608) 1.586 5.659 ( -3.955 -0.000 2.788) 4.839 5.740 ( -6.604 -0.000 -5.189) 8.398 6.091 ( -5.619 -0.000 0.909) 5.692 6.161 ( -3.575 -0.000 -6.997) 7.857 6.441 ( 4.370 0.000 5.055) 6.682 6.499 ( 4.256 -0.000 -1.990) 4.698 6.830 ( 13.851 -0.000 7.476) 15.740 6.945 ( 14.443 0.000 -6.729) 15.933 7.524 ( -11.500 -0.000 9.109) 14.670 7.552 ( -7.638 0.000 5.453) 9.385 7.646 ( -7.915 -0.000 -5.068) 9.398 7.692 ( -14.213 -0.000 -10.191) 17.489 8.132 ( -3.709 0.000 8.189) 8.990 8.260 ( -2.860 -0.000 -7.563) 8.086 18.996 ( -0.040 0.000 0.196) 0.200 19.000 ( 0.098 -0.000 -0.279) 0.296 19.045 ( 2.038 0.000 0.534) 2.106 19.054 ( 1.717 -0.000 -0.593) 1.816 19.412 ( 0.311 -0.000 0.576) 0.654 19.420 ( 0.074 0.000 -0.400) 0.407 19.483 ( -1.288 0.000 0.277) 1.317 19.487 ( -1.127 -0.000 -0.291) 1.164 42.521 ( -3.181 -0.000 0.058) 3.182 42.523 ( -3.016 0.000 -0.143) 3.019 42.550 ( 4.811 -0.000 0.168) 4.814 42.551 ( 4.992 0.000 -0.029) 4.992 66.298 ( 6.635 -0.000 0.280) 6.640 66.304 ( 3.277 0.000 -0.435) 3.306 68.218 ( -2.712 -0.000 15.428) 15.665 68.465 ( -2.094 -0.000 -14.752) 14.900 ======================= Grid point 484 (178/216) ======================= q-point: ( 0.36 -0.18 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.472 ( -12.619 20.080 -2.422) 23.839 2.717 ( -3.979 10.079 -3.753) 11.468 3.242 ( 3.790 27.573 0.081) 27.832 3.533 ( 8.483 12.222 1.550) 14.958 3.943 ( 16.523 -10.105 -1.102) 19.399 4.106 ( 9.730 -20.028 -1.081) 22.293 4.444 ( 8.899 -6.180 2.582) 11.137 4.651 ( 8.211 -12.274 0.677) 14.783 4.737 ( 0.312 15.486 -2.227) 15.649 5.023 ( -5.839 -1.409 2.195) 6.395 5.108 ( -2.467 11.015 0.549) 11.302 5.417 ( -9.123 3.516 4.314) 10.686 5.642 ( 0.846 -7.630 -4.238) 8.769 5.790 ( 5.986 -14.408 -2.890) 15.868 5.833 ( -2.514 1.979 1.249) 3.434 6.094 ( -1.353 -9.735 -1.481) 9.940 6.221 ( -2.986 19.495 -0.067) 19.723 6.714 ( -0.758 16.166 2.764) 16.418 6.824 ( 4.585 -9.465 1.962) 10.699 6.955 ( -9.222 9.481 -0.564) 13.238 7.125 ( -6.941 12.300 0.537) 14.133 7.265 ( -9.465 -4.494 -2.630) 10.803 7.471 ( -10.001 -10.996 -0.031) 14.864 7.569 ( -6.843 -9.180 -0.360) 11.455 8.297 ( 10.717 -8.144 7.566) 15.441 8.410 ( 8.355 -8.659 -6.240) 13.554 18.972 ( -0.526 0.835 -0.196) 1.006 19.001 ( -0.366 -0.865 -0.176) 0.956 19.048 ( 2.509 4.535 -0.011) 5.183 19.218 ( 3.066 -5.425 0.000) 6.232 19.346 ( -2.047 4.346 0.131) 4.806 19.429 ( 0.550 1.211 0.287) 1.361 19.438 ( 0.051 -1.084 0.050) 1.087 19.502 ( -1.177 -2.741 0.032) 2.983 42.418 ( -0.390 0.426 -0.114) 0.589 42.451 ( -2.755 -1.249 -0.274) 3.037 42.623 ( 1.256 2.909 0.205) 3.175 42.715 ( 1.485 -2.070 0.430) 2.584 66.208 ( 1.874 12.929 0.476) 13.073 66.696 ( 4.170 -15.241 -0.744) 15.818 67.825 ( -2.284 21.583 5.339) 22.351 68.578 ( -5.906 -18.524 -2.629) 19.620 ======================= Grid point 485 (179/216) ======================= q-point: ( 0.45 -0.18 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.804 ( -12.931 11.624 0.000) 17.387 2.834 ( -3.401 8.252 0.000) 8.925 3.390 ( 4.932 24.986 -0.000) 25.468 3.469 ( 10.243 4.514 -0.000) 11.194 3.587 ( 18.037 -9.789 -0.000) 20.522 3.783 ( 7.885 -21.870 -0.000) 23.248 4.278 ( 9.225 -0.378 -0.000) 9.233 4.344 ( 13.884 -7.672 -0.000) 15.862 4.832 ( 3.055 9.711 -0.000) 10.180 5.011 ( -0.080 -10.990 0.000) 10.991 5.265 ( 2.013 17.937 -0.000) 18.049 5.538 ( 6.356 -12.133 -0.000) 13.697 5.592 ( -7.988 -1.287 0.000) 8.091 5.623 ( -6.502 -7.628 0.000) 10.023 5.961 ( -8.095 5.276 0.000) 9.663 6.069 ( -6.555 -7.777 0.000) 10.171 6.393 ( 0.800 16.737 -0.000) 16.756 6.654 ( 3.563 -14.463 0.000) 14.896 6.849 ( 7.698 23.956 -0.000) 25.163 7.150 ( -5.826 -6.700 0.000) 8.879 7.353 ( -7.884 15.945 0.000) 17.788 7.409 ( -12.286 -0.241 0.000) 12.288 7.467 ( -5.446 -11.344 0.000) 12.584 7.584 ( -7.290 -11.894 0.000) 13.950 8.150 ( 5.931 3.593 -0.000) 6.934 8.254 ( 1.122 -8.154 0.000) 8.230 18.986 ( -0.405 0.896 0.000) 0.983 19.000 ( -0.445 -0.809 0.000) 0.923 19.047 ( 2.315 4.376 -0.000) 4.951 19.127 ( 2.836 -5.230 -0.000) 5.950 19.402 ( -0.925 2.409 0.000) 2.580 19.427 ( 0.231 -0.969 0.000) 0.996 19.441 ( -0.309 2.809 -0.000) 2.826 19.495 ( -1.152 -3.209 0.000) 3.410 42.455 ( -2.872 1.807 0.000) 3.393 42.486 ( -3.555 -1.934 0.000) 4.047 42.603 ( 4.242 2.764 -0.000) 5.063 42.649 ( 4.370 -2.691 -0.000) 5.132 66.268 ( 4.075 12.529 -0.000) 13.175 66.494 ( 5.183 -14.652 -0.000) 15.542 68.093 ( -3.766 24.153 -0.000) 24.445 68.476 ( -4.682 -21.788 0.000) 22.286 ======================= Grid point 496 (180/216) ======================= q-point: ( 0.36 -0.09 0.27) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.087 ( -10.795 25.164 0.000) 27.382 2.533 ( -3.771 16.702 -0.000) 17.122 3.055 ( 1.988 28.019 -0.000) 28.089 3.486 ( 2.342 20.035 -0.000) 20.171 4.258 ( 12.170 -12.817 -0.000) 17.675 4.364 ( -13.623 37.068 0.000) 39.492 4.391 ( 7.001 -17.382 -0.000) 18.739 4.631 ( 0.760 -2.167 -0.000) 2.296 4.845 ( 1.883 -9.383 0.000) 9.570 4.895 ( -8.807 -6.040 0.000) 10.680 5.131 ( 5.746 -13.708 -0.000) 14.864 5.310 ( 4.732 16.012 -0.000) 16.697 5.739 ( 5.465 -5.882 -0.000) 8.029 5.834 ( 2.060 3.186 -0.000) 3.794 5.977 ( -3.693 20.778 -0.000) 21.103 5.997 ( 4.501 -15.952 0.000) 16.575 6.182 ( 2.930 -1.670 -0.000) 3.372 6.553 ( -4.828 7.778 0.000) 9.155 6.766 ( -2.908 11.801 -0.000) 12.154 6.930 ( -8.602 7.697 0.000) 11.543 6.985 ( 1.161 -14.103 0.000) 14.150 7.223 ( -1.430 -8.281 0.000) 8.404 7.318 ( -15.424 -4.063 0.000) 15.950 7.553 ( -5.124 -8.598 0.000) 10.009 8.475 ( 3.294 -7.383 -0.000) 8.084 8.709 ( 14.997 -15.795 -0.000) 21.780 18.956 ( -0.481 0.826 0.000) 0.956 19.003 ( -0.260 -0.968 0.000) 1.002 19.048 ( 2.535 4.748 -0.000) 5.382 19.277 ( -2.170 4.464 0.000) 4.964 19.308 ( 2.915 -5.096 -0.000) 5.871 19.428 ( 0.510 1.221 -0.000) 1.323 19.449 ( -0.230 -1.542 0.000) 1.559 19.505 ( -1.117 -2.266 0.000) 2.526 42.426 ( -0.988 -0.374 0.000) 1.056 42.440 ( 2.748 -1.182 -0.000) 2.991 42.592 ( -2.053 2.983 0.000) 3.621 42.726 ( -2.251 -1.513 0.000) 2.712 66.108 ( -0.418 14.037 -0.000) 14.043 66.870 ( 2.307 -15.060 0.000) 15.235 67.652 ( 0.005 20.196 -0.000) 20.196 68.636 ( -5.400 -17.457 0.000) 18.273 ======================= Grid point 507 (181/216) ======================= q-point: ( 0.36 0.00 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 216 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.913 ( 0.000 28.342 -0.000) 28.342 2.460 ( 0.000 18.842 -0.000) 18.842 3.071 ( 0.000 26.252 -0.000) 26.252 3.493 ( 0.000 28.130 -0.000) 28.130 4.045 ( 0.000 47.528 -0.000) 47.528 4.319 ( -0.000 -18.521 0.000) 18.521 4.519 ( 0.000 14.557 -0.000) 14.557 4.594 ( -0.000 -17.280 0.000) 17.280 4.906 ( -0.000 -16.112 0.000) 16.112 4.933 ( -0.000 -6.608 0.000) 6.608 5.242 ( -0.000 -19.895 0.000) 19.895 5.555 ( 0.000 20.819 -0.000) 20.819 5.724 ( 0.000 21.506 -0.000) 21.506 5.809 ( -0.000 -1.934 0.000) 1.934 6.090 ( -0.000 -6.171 0.000) 6.171 6.212 ( 0.000 0.854 -0.000) 0.854 6.307 ( 0.000 1.562 -0.000) 1.562 6.367 ( 0.000 0.805 -0.000) 0.805 6.481 ( -0.000 -9.291 0.000) 9.291 6.740 ( 0.000 10.015 -0.000) 10.015 6.905 ( -0.000 -19.308 0.000) 19.308 7.100 ( 0.000 5.957 -0.000) 5.957 7.320 ( -0.000 -10.916 0.000) 10.916 7.442 ( -0.000 -7.486 0.000) 7.486 8.533 ( -0.000 -5.031 0.000) 5.031 8.971 ( -0.000 -17.460 0.000) 17.460 18.948 ( 0.000 0.857 -0.000) 0.857 18.999 ( -0.000 -1.067 0.000) 1.067 19.107 ( 0.000 5.647 -0.000) 5.647 19.226 ( 0.000 3.708 -0.000) 3.708 19.375 ( -0.000 -4.476 0.000) 4.476 19.423 ( -0.000 -3.383 0.000) 3.383 19.437 ( 0.000 1.175 -0.000) 1.175 19.489 ( -0.000 -1.141 0.000) 1.141 42.469 ( 0.000 1.856 -0.000) 1.856 42.489 ( 0.000 1.980 -0.000) 1.980 42.565 ( -0.000 -1.795 0.000) 1.795 42.594 ( -0.000 -1.960 0.000) 1.960 66.092 ( 0.000 15.735 -0.000) 15.735 66.899 ( -0.000 -14.593 0.000) 14.593 67.661 ( 0.000 18.202 -0.000) 18.202 68.541 ( -0.000 -15.053 0.000) 15.053 ======================= Grid point 508 (182/216) ======================= q-point: ( 0.45 0.00 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.193 ( -4.813 24.986 4.014) 25.760 2.602 ( -2.434 7.002 3.919) 8.385 3.306 ( 0.042 27.621 1.248) 27.650 3.713 ( 2.157 24.570 0.814) 24.678 4.162 ( -1.777 -20.273 -0.424) 20.355 4.377 ( 4.008 -11.086 -2.627) 12.077 4.479 ( -4.402 24.261 0.735) 24.668 4.662 ( 0.629 16.339 -1.414) 16.412 4.767 ( -0.428 -5.693 -5.145) 7.686 4.854 ( 2.941 -8.186 3.757) 9.475 5.066 ( 1.637 -15.713 2.643) 16.017 5.581 ( 11.138 13.746 -5.419) 18.503 5.706 ( 1.005 -15.690 3.539) 16.115 5.941 ( 4.353 10.625 0.484) 11.492 5.998 ( 5.549 -1.093 0.463) 5.675 6.109 ( 5.663 10.970 -0.054) 12.346 6.219 ( 4.181 -5.118 0.246) 6.614 6.474 ( -10.038 3.348 -1.362) 10.669 6.694 ( -21.482 -1.696 -3.029) 21.761 6.789 ( -6.326 -6.402 -1.435) 9.114 6.853 ( -1.298 0.223 3.809) 4.030 7.105 ( -1.280 -1.408 -8.543) 8.753 7.267 ( 1.163 -3.057 10.424) 10.925 7.414 ( -3.491 -8.378 1.004) 9.132 8.479 ( 3.080 -1.347 -1.989) 3.906 8.759 ( 8.058 -15.595 -0.931) 17.579 18.959 ( -0.253 0.911 0.293) 0.990 18.992 ( -0.160 -1.063 0.298) 1.116 19.132 ( 2.502 5.481 0.004) 6.025 19.277 ( -2.161 4.205 -0.254) 4.734 19.310 ( 2.651 -5.049 -0.000) 5.703 19.411 ( -1.714 -3.445 -0.142) 3.851 19.444 ( 0.285 1.142 -0.228) 1.199 19.481 ( -0.152 -1.220 -0.200) 1.246 42.440 ( 2.397 0.956 0.139) 2.585 42.483 ( 4.317 -1.665 0.154) 4.630 42.565 ( -4.214 2.762 -0.108) 5.039 42.650 ( -5.012 -2.083 -0.230) 5.432 66.229 ( -0.095 15.897 0.134) 15.898 66.765 ( 0.589 -15.262 -0.592) 15.285 67.807 ( 0.541 18.642 -1.705) 18.728 68.424 ( -3.137 -16.547 -1.565) 16.914 ======================= Grid point 509 (183/216) ======================= q-point: ( 0.55 0.00 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.514 ( -7.305 18.543 6.020) 20.820 2.721 ( -5.022 -2.737 7.306) 9.279 3.500 ( 3.028 23.174 -3.053) 23.569 3.772 ( 8.951 11.825 -2.790) 15.091 4.037 ( 4.338 -14.696 7.319) 16.981 4.126 ( 11.386 -13.951 1.236) 18.050 4.496 ( 4.340 3.260 -4.326) 6.941 4.635 ( 3.667 -10.154 -1.447) 10.893 4.818 ( -5.656 -1.502 -7.307) 9.362 4.944 ( -2.078 18.503 3.623) 18.969 5.099 ( -6.863 5.019 4.909) 9.818 5.418 ( 6.116 -1.963 -6.890) 9.420 5.594 ( 2.418 -9.627 1.445) 10.031 5.844 ( 7.133 2.592 1.251) 7.692 5.894 ( 8.274 -2.692 3.497) 9.377 6.047 ( 3.183 -7.878 0.397) 8.506 6.326 ( -4.751 19.484 -0.035) 20.055 6.620 ( -6.363 -10.365 -0.912) 12.197 6.823 ( -3.998 5.679 -5.791) 9.042 6.907 ( -7.065 5.558 -3.661) 9.706 6.988 ( -15.820 -2.535 -2.738) 16.254 7.104 ( -7.023 -0.999 1.375) 7.226 7.351 ( -2.757 -1.050 7.624) 8.175 7.425 ( -3.849 -6.621 3.650) 8.484 8.349 ( 9.678 -1.638 -5.993) 11.500 8.517 ( 8.204 -7.827 1.915) 11.500 18.975 ( -0.368 0.871 0.460) 1.052 18.991 ( -0.317 -0.941 0.513) 1.118 19.132 ( 3.016 5.281 -0.028) 6.082 19.221 ( 3.116 -5.371 -0.012) 6.210 19.346 ( -2.299 4.185 -0.292) 4.783 19.408 ( -1.569 -3.116 -0.262) 3.498 19.444 ( 0.398 1.089 -0.547) 1.282 19.471 ( -0.271 -1.520 -0.190) 1.555 42.422 ( 0.793 -0.185 0.106) 0.822 42.433 ( 0.957 -0.339 0.712) 1.240 42.638 ( -2.053 2.880 -0.522) 3.576 42.686 ( -2.187 -2.383 -0.544) 3.280 66.335 ( 1.707 12.763 -2.176) 13.059 66.636 ( 1.418 -12.933 2.440) 13.237 67.888 ( 0.798 13.454 -11.012) 17.404 68.383 ( -6.915 -12.202 5.020) 14.896 ======================= Grid point 510 (184/216) ======================= q-point: ( 0.64 0.00 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.769 ( -5.911 0.000 6.795) 9.007 2.857 ( -8.083 0.000 7.625) 11.112 3.467 ( 6.720 -0.000 -8.586) 10.903 3.699 ( 8.091 -0.000 -3.735) 8.911 3.834 ( 13.827 0.000 5.589) 14.913 3.858 ( 17.034 0.000 3.421) 17.374 4.445 ( 4.509 -0.000 -1.743) 4.834 4.487 ( 11.596 0.000 5.110) 12.672 4.877 ( -10.285 -0.000 -4.390) 11.183 5.044 ( 8.859 0.000 1.837) 9.048 5.131 ( -1.103 -0.000 -8.407) 8.479 5.329 ( -2.155 -0.000 -5.084) 5.521 5.637 ( -6.516 0.000 7.219) 9.725 5.796 ( -3.519 -0.000 -3.796) 5.176 5.804 ( 7.505 0.000 9.895) 12.419 6.065 ( -6.723 0.000 3.871) 7.758 6.465 ( 1.492 -0.000 -3.925) 4.199 6.577 ( -1.092 0.000 2.145) 2.407 6.818 ( -2.666 -0.000 -9.296) 9.671 7.072 ( -8.630 -0.000 -4.687) 9.821 7.106 ( -7.922 -0.000 -5.107) 9.426 7.300 ( -12.862 0.000 5.324) 13.921 7.441 ( -3.096 0.000 4.950) 5.838 7.505 ( -5.886 0.000 4.855) 7.630 8.100 ( 11.321 -0.000 -8.410) 14.103 8.422 ( 4.482 0.000 4.740) 6.524 18.987 ( -0.242 0.000 0.300) 0.386 18.997 ( -0.452 0.000 0.764) 0.888 19.123 ( 3.106 -0.000 -0.253) 3.116 19.136 ( 2.818 0.000 0.245) 2.829 19.402 ( -1.030 -0.000 -0.387) 1.100 19.404 ( -1.352 -0.000 -0.309) 1.387 19.442 ( -0.331 -0.000 -0.834) 0.898 19.466 ( -0.471 0.000 0.143) 0.493 42.428 ( -1.662 0.000 0.211) 1.676 42.446 ( -1.567 0.000 0.901) 1.807 42.654 ( 1.278 -0.000 -1.126) 1.703 42.672 ( 1.542 -0.000 -0.465) 1.611 66.334 ( 1.551 -0.000 -4.094) 4.378 66.559 ( 5.764 0.000 4.746) 7.466 67.832 ( -2.549 -0.000 -16.718) 16.911 68.520 ( -8.020 0.000 9.972) 12.797 ======================= Grid point 520 (185/216) ======================= q-point: ( 0.45 0.09 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.989 ( 0.000 26.837 8.785) 28.239 2.513 ( 0.000 19.776 6.068) 20.686 3.118 ( 0.000 24.596 5.775) 25.264 3.525 ( 0.000 27.008 3.879) 27.285 4.015 ( 0.000 36.846 -3.814) 37.043 4.276 ( 0.000 -0.484 -3.493) 3.526 4.533 ( -0.000 -5.143 1.772) 5.439 4.666 ( -0.000 -7.557 7.232) 10.460 4.784 ( 0.000 -13.088 -13.122) 18.533 4.944 ( -0.000 -7.229 0.745) 7.267 5.260 ( -0.000 -17.251 1.806) 17.345 5.551 ( 0.000 18.526 -0.463) 18.531 5.653 ( 0.000 12.215 -4.362) 12.971 5.946 ( -0.000 4.187 11.179) 11.937 6.057 ( -0.000 -4.678 -3.722) 5.978 6.193 ( 0.000 1.017 -2.211) 2.433 6.321 ( -0.000 1.349 1.410) 1.951 6.326 ( 0.000 0.744 -4.863) 4.920 6.463 ( -0.000 -9.280 -2.135) 9.523 6.710 ( 0.000 6.221 -1.940) 6.516 6.976 ( -0.000 -15.938 6.878) 17.359 7.016 ( 0.000 2.287 -6.815) 7.189 7.427 ( -0.000 -5.620 -1.750) 5.886 7.438 ( -0.000 -7.319 11.040) 13.246 8.505 ( -0.000 -5.205 -3.379) 6.206 8.944 ( -0.000 -16.767 -3.179) 17.065 18.953 ( 0.000 0.850 0.606) 1.045 19.004 ( -0.000 -1.096 0.616) 1.257 19.108 ( 0.000 5.636 0.092) 5.637 19.220 ( 0.000 3.853 -0.711) 3.918 19.375 ( -0.000 -4.458 0.043) 4.458 19.420 ( -0.000 -3.372 -0.326) 3.387 19.434 ( 0.000 1.087 -0.361) 1.146 19.486 ( -0.000 -1.206 -0.413) 1.275 42.470 ( 0.000 1.870 0.137) 1.875 42.489 ( 0.000 1.971 -0.023) 1.971 42.566 ( -0.000 -1.786 0.144) 1.792 42.592 ( -0.000 -1.889 -0.258) 1.907 66.103 ( 0.000 15.310 1.299) 15.365 66.867 ( -0.000 -12.640 -3.870) 13.219 67.670 ( 0.000 16.179 1.056) 16.213 68.483 ( -0.000 -13.242 -6.843) 14.905 ======================= Grid point 521 (186/216) ======================= q-point: ( 0.55 0.09 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.311 ( -4.312 23.368 9.718) 25.673 2.717 ( -3.002 7.711 9.440) 12.554 3.345 ( 2.801 23.602 3.459) 24.018 3.736 ( 4.123 20.097 1.767) 20.592 4.131 ( -9.991 -7.310 -3.607) 12.894 4.361 ( 0.907 -10.813 2.208) 11.073 4.468 ( 5.667 10.484 -3.026) 12.295 4.614 ( -2.011 6.479 -8.022) 10.505 4.665 ( 4.485 2.645 -1.147) 5.332 4.942 ( -3.840 -5.141 6.213) 8.931 5.130 ( 1.270 -12.710 4.241) 13.459 5.493 ( 13.492 10.884 -4.880) 18.008 5.713 ( -0.665 -10.283 -2.872) 10.697 5.951 ( 10.472 3.879 -1.172) 11.228 6.007 ( -2.989 6.113 1.315) 6.931 6.098 ( 7.989 1.618 -1.286) 8.252 6.246 ( 4.106 -1.871 2.759) 5.289 6.437 ( -10.383 6.982 -2.274) 12.717 6.617 ( -18.049 -3.708 -5.634) 19.268 6.780 ( -5.829 3.719 -0.160) 6.916 6.912 ( -0.238 -12.589 2.684) 12.874 7.011 ( -4.366 0.069 -2.096) 4.844 7.383 ( -0.061 -0.758 2.360) 2.479 7.491 ( -1.519 -6.887 9.423) 11.770 8.418 ( 4.066 -1.288 -5.367) 6.855 8.730 ( 6.109 -14.909 -2.645) 16.328 18.968 ( -0.198 0.884 0.820) 1.222 19.001 ( -0.102 -1.077 0.784) 1.336 19.132 ( 2.571 5.460 0.017) 6.035 19.270 ( -2.288 4.387 -0.655) 4.992 19.310 ( 2.678 -5.022 -0.008) 5.691 19.407 ( -1.728 -3.417 -0.388) 3.849 19.437 ( 0.301 1.007 -0.625) 1.223 19.474 ( -0.310 -1.302 -0.553) 1.448 42.445 ( 2.288 0.975 0.374) 2.515 42.488 ( 4.060 -1.615 0.424) 4.390 42.562 ( -3.974 2.628 -0.286) 4.773 42.643 ( -4.630 -1.866 -0.574) 5.025 66.233 ( 0.953 14.444 0.334) 14.479 66.746 ( -1.535 -12.642 -1.743) 12.854 67.754 ( 5.198 14.645 -4.603) 16.207 68.379 ( -7.442 -12.503 -3.644) 14.999 ======================= Grid point 522 (187/216) ======================= q-point: ( 0.64 0.09 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.648 ( -6.368 17.974 9.739) 21.412 2.873 ( -4.601 -4.369 10.575) 12.333 3.433 ( 5.263 13.247 -4.663) 14.998 3.744 ( 9.883 12.424 -1.140) 15.916 4.136 ( 12.542 -10.721 0.283) 16.503 4.167 ( 6.148 -11.033 7.675) 14.779 4.436 ( 0.143 6.420 -1.721) 6.648 4.596 ( -9.416 -3.117 -6.728) 11.985 4.725 ( 1.424 -3.401 0.966) 3.811 4.997 ( 4.253 14.844 0.790) 15.462 5.179 ( -7.009 -3.585 5.678) 9.707 5.292 ( 12.196 3.997 -8.084) 15.168 5.613 ( -5.914 -11.086 0.198) 12.566 5.822 ( 8.731 1.349 -1.224) 8.919 6.001 ( 4.829 -1.114 5.229) 7.204 6.031 ( 0.260 -3.926 -0.919) 4.041 6.322 ( -4.021 14.097 -0.977) 14.692 6.600 ( -5.830 -0.724 -1.338) 6.025 6.734 ( -0.516 -3.342 -4.314) 5.481 6.836 ( -10.199 1.357 -4.604) 11.273 6.955 ( -9.671 -2.422 -0.942) 10.014 7.130 ( -10.246 1.338 1.604) 10.457 7.445 ( -3.396 2.361 3.159) 5.204 7.522 ( -0.694 -6.671 7.803) 10.289 8.234 ( 11.576 -1.517 -7.801) 14.041 8.539 ( 4.145 -7.124 0.841) 8.285 18.985 ( -0.173 0.707 0.787) 1.072 19.003 ( -0.232 -0.785 0.901) 1.218 19.131 ( 3.021 5.236 -0.044) 6.045 19.221 ( 3.089 -5.329 -0.015) 6.159 19.340 ( -2.405 4.309 -0.477) 4.957 19.402 ( -1.527 -3.022 -0.454) 3.416 19.432 ( 0.351 0.718 -0.935) 1.230 19.466 ( -0.587 -1.383 -0.359) 1.545 42.427 ( 0.937 -0.192 0.423) 1.046 42.448 ( 0.680 -0.277 0.991) 1.233 42.626 ( -1.849 2.368 -0.884) 3.132 42.674 ( -1.936 -1.791 -0.866) 2.776 66.292 ( 2.505 8.463 -2.847) 9.274 66.685 ( -0.353 -8.353 3.405) 9.028 67.679 ( 4.802 7.463 -13.850) 16.449 68.458 ( -11.494 -5.965 3.894) 13.522 ======================= Grid point 523 (188/216) ======================= q-point: ( 0.73 0.09 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.924 ( -3.889 0.000 11.763) 12.389 2.975 ( -6.006 0.000 6.098) 8.559 3.367 ( 4.767 -0.000 -3.185) 5.733 3.583 ( 15.010 -0.000 -8.977) 17.489 3.922 ( 14.452 0.000 4.327) 15.086 3.948 ( 14.028 0.000 6.826) 15.600 4.423 ( 4.057 -0.000 -0.312) 4.069 4.548 ( 17.360 0.000 1.228) 17.403 4.750 ( -12.047 -0.000 -11.213) 16.457 4.997 ( 12.893 -0.000 -5.815) 14.143 5.092 ( -5.532 0.000 4.312) 7.014 5.347 ( -6.993 0.000 5.669) 9.002 5.687 ( 5.252 -0.000 -1.581) 5.484 5.778 ( -15.504 0.000 1.793) 15.608 5.965 ( 7.990 0.000 9.439) 12.367 6.087 ( -10.477 -0.000 -0.796) 10.507 6.392 ( 2.375 -0.000 -4.933) 5.475 6.634 ( -0.885 0.000 4.766) 4.848 6.675 ( -1.437 -0.000 -7.875) 8.005 6.993 ( -10.837 -0.000 -4.336) 11.672 7.038 ( -5.994 -0.000 -3.174) 6.783 7.349 ( -15.663 -0.000 0.232) 15.664 7.537 ( 0.823 0.000 6.460) 6.512 7.560 ( -5.469 0.000 1.820) 5.764 7.960 ( 12.575 -0.000 -8.517) 15.188 8.492 ( 1.375 0.000 3.896) 4.131 18.994 ( 0.059 0.000 0.468) 0.472 19.012 ( -0.309 0.000 1.001) 1.047 19.119 ( 3.142 -0.000 -0.206) 3.149 19.139 ( 2.714 0.000 0.195) 2.721 19.394 ( -0.733 -0.000 -0.529) 0.904 19.398 ( -1.467 -0.000 -0.452) 1.536 19.428 ( -0.792 -0.000 -0.891) 1.192 19.467 ( -0.792 -0.000 -0.014) 0.793 42.434 ( -1.548 0.000 0.475) 1.619 42.462 ( -1.386 0.000 1.037) 1.731 42.634 ( 1.088 -0.000 -1.298) 1.693 42.661 ( 1.526 -0.000 -0.754) 1.702 66.273 ( 0.383 -0.000 -3.355) 3.376 66.635 ( 7.481 0.000 4.583) 8.773 67.563 ( -2.617 -0.000 -15.996) 16.209 68.657 ( -10.878 0.000 6.942) 12.904 ======================= Grid point 533 (189/216) ======================= q-point: ( 0.55 0.18 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.173 ( -0.000 22.941 13.015) 26.376 2.639 ( 0.000 21.482 8.870) 23.241 3.254 ( -0.000 21.008 10.404) 23.443 3.620 ( -0.000 22.577 7.841) 23.900 3.919 ( 0.000 15.858 -7.753) 17.652 4.248 ( -0.000 24.323 0.199) 24.324 4.524 ( -0.000 -8.115 -17.402) 19.201 4.573 ( 0.000 -16.413 3.211) 16.724 4.797 ( -0.000 -5.473 8.405) 10.030 4.959 ( 0.000 -6.005 1.025) 6.091 5.281 ( 0.000 -7.796 0.158) 7.797 5.545 ( 0.000 9.194 -0.080) 9.194 5.593 ( -0.000 6.443 -3.257) 7.219 5.977 ( -0.000 -5.522 -5.642) 7.894 6.111 ( 0.000 5.766 7.479) 9.444 6.133 ( 0.000 1.371 -5.989) 6.144 6.230 ( 0.000 0.883 -5.292) 5.366 6.333 ( -0.000 -1.972 -1.113) 2.265 6.432 ( 0.000 -4.585 0.102) 4.586 6.702 ( 0.000 5.754 0.852) 5.817 6.930 ( 0.000 1.533 -3.208) 3.555 7.094 ( 0.000 -16.629 7.101) 18.081 7.390 ( 0.000 -0.716 -2.504) 2.604 7.626 ( -0.000 -6.755 11.225) 13.100 8.429 ( 0.000 -5.661 -5.632) 7.985 8.872 ( -0.000 -15.166 -5.486) 16.128 18.967 ( -0.000 0.818 1.106) 1.375 19.017 ( 0.000 -1.115 0.955) 1.468 19.110 ( -0.000 5.606 0.204) 5.610 19.204 ( 0.000 4.203 -1.172) 4.363 19.376 ( 0.000 -4.361 0.064) 4.362 19.412 ( -0.000 -3.328 -0.585) 3.379 19.426 ( 0.000 0.787 -0.565) 0.969 19.476 ( -0.000 -1.390 -0.754) 1.581 42.473 ( 0.000 1.903 0.233) 1.917 42.488 ( 0.000 1.953 -0.030) 1.953 42.569 ( -0.000 -1.762 0.235) 1.777 42.587 ( -0.000 -1.751 -0.318) 1.780 66.133 ( 0.000 14.121 2.366) 14.318 66.779 ( -0.000 -8.207 -6.589) 10.524 67.693 ( 0.000 11.642 1.711) 11.767 68.336 ( -0.000 -9.259 -10.422) 13.941 ======================= Grid point 534 (190/216) ======================= q-point: ( 0.64 0.18 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.486 ( -4.219 20.161 11.166) 23.430 2.884 ( -4.419 8.351 10.409) 14.058 3.402 ( 7.919 14.203 2.557) 16.462 3.763 ( 6.639 14.994 1.591) 16.475 4.075 ( -18.750 1.489 -2.795) 19.016 4.340 ( 7.195 -0.161 -9.342) 11.792 4.454 ( -0.175 -10.948 5.272) 12.153 4.519 ( -0.741 17.213 -0.309) 17.232 4.704 ( 7.816 1.588 4.697) 9.256 5.036 ( -6.370 -3.445 4.862) 8.723 5.182 ( 1.481 -10.812 1.737) 11.050 5.426 ( 14.156 6.256 -3.129) 15.790 5.635 ( -0.280 -8.382 -6.200) 10.429 5.871 ( 1.902 9.123 -8.042) 12.309 6.033 ( 7.239 -0.656 0.421) 7.281 6.084 ( -0.496 -1.219 -0.015) 1.316 6.243 ( -0.416 -4.216 -3.623) 5.575 6.442 ( -8.866 12.361 1.667) 15.303 6.534 ( -10.837 -3.111 -3.039) 11.677 6.777 ( -1.315 5.654 0.052) 5.805 6.957 ( -4.179 -8.516 3.952) 10.276 7.027 ( -2.780 -7.326 2.716) 8.293 7.398 ( -0.680 4.010 0.146) 4.070 7.648 ( -0.242 -8.293 8.473) 11.858 8.315 ( 5.638 -0.961 -6.661) 8.779 8.676 ( 3.113 -13.699 -3.849) 14.566 18.985 ( -0.090 0.801 1.170) 1.421 19.016 ( -0.023 -1.020 0.985) 1.419 19.132 ( 2.706 5.421 0.035) 6.059 19.257 ( -2.531 4.702 -0.810) 5.401 19.310 ( 2.741 -4.998 -0.023) 5.700 19.399 ( -1.735 -3.324 -0.528) 3.786 19.424 ( 0.359 0.722 -0.850) 1.171 19.463 ( -0.629 -1.454 -0.765) 1.759 42.452 ( 2.097 1.004 0.499) 2.378 42.497 ( 3.611 -1.524 0.585) 3.963 42.556 ( -3.544 2.411 -0.372) 4.303 42.633 ( -4.005 -1.566 -0.670) 4.352 66.239 ( 2.790 11.771 0.418) 12.104 66.709 ( -5.145 -7.840 -2.717) 9.763 67.666 ( 12.134 8.616 -5.867) 15.997 68.316 ( -13.682 -7.097 -3.808) 15.877 ======================= Grid point 535 (191/216) ======================= q-point: ( 0.73 0.18 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.805 ( -6.420 16.609 8.566) 19.760 3.043 ( -5.100 -8.912 9.651) 14.091 3.367 ( 4.783 8.743 -2.813) 10.355 3.727 ( 14.108 9.859 -0.721) 17.227 4.115 ( 13.063 2.886 -2.387) 13.589 4.290 ( 3.787 -11.924 7.005) 14.338 4.434 ( -7.339 1.374 -11.060) 13.344 4.492 ( -0.237 0.527 8.555) 8.574 4.815 ( 5.474 -4.254 6.027) 9.186 4.977 ( 3.689 12.158 -1.236) 12.766 5.169 ( 13.357 1.102 -6.204) 14.769 5.277 ( -8.413 -3.016 5.625) 10.561 5.591 ( -10.728 -5.984 -2.658) 12.569 5.804 ( 8.350 1.026 -2.359) 8.737 5.939 ( -3.780 -1.889 -6.679) 7.903 6.129 ( 1.263 -0.839 7.137) 7.296 6.285 ( -5.192 5.943 -2.800) 8.374 6.579 ( 0.257 8.057 -1.472) 8.194 6.670 ( -9.459 -4.756 -4.619) 11.551 6.794 ( -4.003 -1.309 0.749) 4.278 6.965 ( -3.358 -4.410 2.302) 6.002 7.150 ( -9.729 1.407 0.715) 9.856 7.472 ( -2.899 5.787 0.353) 6.482 7.634 ( -0.326 -8.839 5.126) 10.223 8.107 ( 12.711 -0.633 -7.248) 14.646 8.547 ( 0.401 -6.174 0.194) 6.190 18.999 ( 0.122 0.437 0.878) 0.988 19.019 ( -0.156 -0.507 1.049) 1.175 19.131 ( 3.031 5.178 -0.042) 6.000 19.221 ( 3.055 -5.274 -0.010) 6.095 19.332 ( -2.536 4.461 -0.493) 5.155 19.394 ( -1.394 -2.787 -0.514) 3.158 19.415 ( 0.188 0.259 -1.086) 1.132 19.459 ( -0.991 -1.354 -0.421) 1.730 42.435 ( 0.953 -0.166 0.583) 1.130 42.464 ( 0.480 -0.227 1.029) 1.158 42.611 ( -1.555 1.791 -0.981) 2.567 42.659 ( -1.626 -1.145 -0.888) 2.178 66.247 ( 3.042 5.249 -2.524) 6.571 66.742 ( -2.887 -4.392 3.466) 6.296 67.456 ( 8.843 4.107 -13.035) 16.278 68.507 ( -15.426 -2.847 2.188) 15.838 ======================= Grid point 536 (192/216) ======================= q-point: ( 0.82 0.18 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.039 ( -5.573 0.000 1.690) 5.824 3.125 ( -4.150 0.000 11.167) 11.913 3.371 ( 1.301 0.000 3.368) 3.610 3.457 ( 21.140 -0.000 -4.246) 21.562 3.960 ( 13.572 0.000 0.510) 13.581 4.050 ( 13.186 0.000 4.541) 13.946 4.421 ( 14.802 -0.000 -1.171) 14.848 4.514 ( 20.038 -0.000 -7.527) 21.405 4.564 ( -8.686 -0.000 -7.379) 11.397 4.945 ( 6.022 0.000 1.567) 6.222 5.230 ( -11.454 0.000 11.159) 15.991 5.451 ( -8.988 0.000 6.123) 10.876 5.633 ( 8.242 -0.000 -4.655) 9.466 5.794 ( -16.741 -0.000 -0.610) 16.752 5.986 ( -7.000 -0.000 -6.494) 9.549 6.168 ( 1.749 0.000 10.455) 10.600 6.312 ( 2.140 -0.000 -4.440) 4.928 6.571 ( 0.383 -0.000 -4.905) 4.920 6.714 ( -3.349 0.000 4.023) 5.235 6.945 ( -11.392 -0.000 -0.895) 11.427 7.004 ( -4.387 -0.000 -0.951) 4.489 7.314 ( -12.538 -0.000 -4.243) 13.237 7.566 ( -5.334 -0.000 -0.911) 5.412 7.627 ( -0.548 0.000 3.723) 3.763 7.837 ( 13.826 -0.000 -5.759) 14.978 8.548 ( -1.409 0.000 2.963) 3.280 19.001 ( 0.384 0.000 0.459) 0.598 19.029 ( -0.151 0.000 0.983) 0.995 19.116 ( 3.155 0.000 -0.140) 3.158 19.142 ( 2.652 0.000 0.128) 2.655 19.385 ( -0.234 -0.000 -0.570) 0.616 19.390 ( -1.592 -0.000 -0.449) 1.654 19.414 ( -1.520 -0.000 -0.719) 1.682 19.466 ( -1.113 -0.000 -0.079) 1.116 42.443 ( -1.407 0.000 0.548) 1.510 42.479 ( -1.188 0.000 0.920) 1.502 42.614 ( 0.895 -0.000 -1.142) 1.451 42.649 ( 1.490 -0.000 -0.737) 1.663 66.225 ( -0.558 -0.000 -2.384) 2.448 66.708 ( 9.826 0.000 4.411) 10.771 67.322 ( -3.960 -0.000 -13.364) 13.939 68.748 ( -13.438 0.000 4.295) 14.108 ======================= Grid point 546 (193/216) ======================= q-point: ( 0.64 0.27 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.396 ( -0.000 17.022 14.150) 22.136 2.791 ( 0.000 21.152 9.661) 23.254 3.422 ( -0.000 17.635 8.741) 19.682 3.764 ( -0.000 10.316 8.163) 13.154 3.772 ( -0.000 7.748 -10.050) 12.690 4.252 ( 0.000 29.572 -0.981) 29.588 4.277 ( -0.000 4.995 -9.821) 11.018 4.656 ( 0.000 -16.839 7.587) 18.469 4.936 ( -0.000 -6.053 8.685) 10.586 4.978 ( -0.000 -4.979 1.311) 5.149 5.252 ( 0.000 5.941 -3.737) 7.019 5.539 ( -0.000 -0.192 -3.587) 3.593 5.543 ( 0.000 -4.632 -0.579) 4.668 5.879 ( -0.000 -2.515 -6.249) 6.736 5.993 ( 0.000 0.601 -9.840) 9.859 6.136 ( 0.000 -1.059 -5.260) 5.365 6.187 ( 0.000 2.363 -0.546) 2.425 6.296 ( -0.000 -4.957 -1.252) 5.113 6.492 ( 0.000 4.547 5.974) 7.507 6.727 ( 0.000 6.106 1.825) 6.373 6.918 ( -0.000 3.440 1.750) 3.860 7.192 ( 0.000 -14.027 4.083) 14.609 7.361 ( -0.000 0.769 -0.152) 0.784 7.779 ( -0.000 -8.615 6.665) 10.892 8.340 ( 0.000 -6.063 -4.302) 7.435 8.771 ( 0.000 -13.410 -6.741) 15.009 18.988 ( -0.000 0.726 1.396) 1.573 19.033 ( 0.000 -1.003 0.870) 1.327 19.115 ( -0.000 5.561 0.349) 5.572 19.184 ( 0.000 4.609 -1.308) 4.791 19.377 ( 0.000 -4.020 0.016) 4.020 19.402 ( -0.000 -3.230 -0.717) 3.308 19.418 ( 0.000 0.121 -0.439) 0.456 19.462 ( -0.000 -1.658 -0.959) 1.916 42.477 ( 0.000 1.943 0.261) 1.960 42.488 ( 0.000 1.943 -0.026) 1.943 42.573 ( -0.000 -1.731 0.244) 1.748 42.583 ( -0.000 -1.656 -0.206) 1.669 66.179 ( 0.000 12.331 3.240) 12.749 66.660 ( -0.000 -3.438 -7.787) 8.512 67.724 ( 0.000 6.981 2.136) 7.300 68.163 ( -0.000 -5.495 -10.349) 11.718 ======================= Grid point 547 (194/216) ======================= q-point: ( 0.73 0.27 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.662 ( -4.096 14.480 10.216) 18.188 3.042 ( -6.608 6.032 8.769) 12.528 3.392 ( 10.146 4.297 -4.132) 11.768 3.811 ( 7.765 18.080 4.921) 20.283 3.983 ( -20.495 -2.817 -9.496) 22.763 4.255 ( 9.770 10.346 -1.507) 14.310 4.469 ( -0.038 14.384 2.580) 14.613 4.657 ( 0.467 -8.104 11.800) 14.322 4.809 ( 4.236 3.421 8.182) 9.828 5.085 ( 2.456 -1.700 0.548) 3.037 5.192 ( -3.295 -6.828 0.330) 7.588 5.399 ( 12.256 -2.685 -0.307) 12.551 5.523 ( -1.532 -8.677 -7.151) 11.348 5.707 ( 0.182 8.433 -11.528) 14.284 5.976 ( 4.968 -6.495 -7.993) 11.435 6.089 ( -9.462 1.468 0.273) 9.579 6.204 ( -0.904 0.422 0.404) 1.077 6.405 ( -13.795 0.719 -4.144) 14.422 6.554 ( 4.218 7.275 2.414) 8.749 6.798 ( -0.050 5.866 2.820) 6.508 7.024 ( -6.097 2.214 2.720) 7.033 7.101 ( 1.800 -14.817 7.527) 16.716 7.392 ( -0.894 5.904 -0.840) 6.030 7.733 ( -0.762 -10.565 0.998) 10.640 8.227 ( 7.834 -1.348 -3.178) 8.561 8.609 ( -0.213 -11.769 -4.205) 12.499 19.005 ( 0.072 0.612 1.235) 1.380 19.031 ( 0.018 -0.796 0.816) 1.141 19.133 ( 2.886 5.373 0.050) 6.099 19.245 ( -2.819 5.028 -0.699) 5.807 19.309 ( 2.804 -4.956 -0.038) 5.695 19.390 ( -1.711 -3.112 -0.518) 3.589 19.410 ( 0.510 0.266 -0.806) 0.990 19.451 ( -1.091 -1.646 -0.752) 2.113 42.460 ( 1.865 1.034 0.476) 2.185 42.506 ( 3.109 -1.424 0.581) 3.469 42.550 ( -3.040 2.192 -0.356) 3.765 42.623 ( -3.344 -1.316 -0.553) 3.636 66.246 ( 4.986 8.353 0.447) 9.738 66.661 ( -9.019 -1.933 -3.079) 9.725 67.575 ( 18.102 3.078 -4.977) 19.024 68.261 ( -18.973 -3.032 -2.806) 19.418 ======================= Grid point 548 (195/216) ======================= q-point: ( 0.82 0.27 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.903 ( -5.997 9.376 3.363) 11.627 3.164 ( -6.097 -10.578 4.345) 12.960 3.360 ( 0.164 9.558 2.324) 9.838 3.744 ( 17.876 5.699 3.632) 19.111 4.072 ( 11.056 13.909 -2.679) 17.969 4.245 ( -7.452 2.650 -11.583) 14.026 4.401 ( 6.521 -12.592 6.293) 15.514 4.672 ( 8.237 -1.470 11.336) 14.090 4.816 ( 17.469 -5.750 -4.373) 18.904 5.020 ( 4.234 13.393 3.855) 14.565 5.150 ( -1.609 -1.360 6.227) 6.574 5.348 ( -9.138 -2.371 2.685) 9.815 5.541 ( -13.348 -3.705 -3.059) 14.186 5.708 ( 1.217 4.350 -9.025) 10.092 5.810 ( -2.590 -5.146 -9.383) 11.011 6.234 ( -1.915 2.119 4.542) 5.365 6.276 ( -6.228 -0.780 3.319) 7.100 6.545 ( 3.867 6.291 -2.697) 7.861 6.580 ( -14.754 -1.805 -5.976) 16.020 6.853 ( 0.717 3.210 5.516) 6.422 7.022 ( 2.137 -6.189 4.057) 7.702 7.149 ( -6.405 0.044 -0.862) 6.463 7.463 ( -3.276 4.482 -1.159) 5.672 7.669 ( -1.125 -7.072 -1.019) 7.233 8.020 ( 13.072 -1.581 -2.964) 13.497 8.548 ( -2.531 -4.636 0.029) 5.282 19.012 ( 0.432 0.153 0.686) 0.825 19.035 ( -0.121 -0.192 0.862) 0.892 19.130 ( 3.048 5.128 -0.027) 5.965 19.221 ( 3.025 -5.224 -0.003) 6.037 19.325 ( -2.654 4.597 -0.348) 5.320 19.386 ( -1.008 -2.221 -0.400) 2.471 19.398 ( -0.234 -0.459 -0.921) 1.056 19.453 ( -1.365 -1.401 -0.334) 1.985 42.444 ( 0.914 -0.138 0.521) 1.061 42.480 ( 0.339 -0.185 0.787) 0.876 42.596 ( -1.258 1.359 -0.777) 2.008 42.647 ( -1.356 -0.678 -0.654) 1.651 66.212 ( 3.298 3.160 -1.686) 4.868 66.796 ( -6.833 -0.667 3.041) 7.508 67.268 ( 13.739 1.227 -9.709) 16.868 68.532 ( -18.243 -1.289 1.000) 18.316 ======================= Grid point 549 (196/216) ======================= q-point: (-0.09 0.27 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.047 ( -7.783 -0.000 -0.168) 7.785 3.197 ( 5.527 -0.000 -1.464) 5.718 3.448 ( -2.303 0.000 4.954) 5.463 3.540 ( 13.598 0.000 13.372) 19.071 3.948 ( 13.306 -0.000 -1.687) 13.413 4.034 ( 11.203 -0.000 -8.093) 13.821 4.376 ( 26.954 -0.000 -3.257) 27.150 4.384 ( 17.808 -0.000 -3.842) 18.218 4.508 ( -1.836 -0.000 -2.111) 2.797 5.057 ( 1.000 0.000 10.700) 10.746 5.427 ( -12.159 0.000 12.490) 17.431 5.487 ( -4.744 -0.000 -6.043) 7.682 5.571 ( 2.805 0.000 1.088) 3.009 5.765 ( -17.494 -0.000 -2.291) 17.643 5.844 ( -10.532 -0.000 -10.345) 14.762 6.263 ( 3.201 -0.000 -1.459) 3.517 6.332 ( 3.528 0.000 8.664) 9.354 6.510 ( 0.502 -0.000 -2.616) 2.664 6.737 ( -10.154 -0.000 -0.933) 10.197 6.984 ( -8.730 0.000 5.332) 10.229 7.002 ( -2.509 0.000 0.368) 2.536 7.220 ( -8.404 -0.000 -6.912) 10.881 7.542 ( -5.780 -0.000 -1.612) 6.001 7.636 ( 0.924 -0.000 -1.940) 2.148 7.797 ( 11.668 0.000 0.324) 11.672 8.586 ( -3.267 0.000 1.637) 3.654 19.008 ( 0.636 0.000 0.282) 0.695 19.042 ( -0.039 0.000 0.628) 0.629 19.114 ( 3.156 0.000 -0.068) 3.157 19.143 ( 2.638 0.000 0.058) 2.639 19.377 ( 0.214 -0.000 -0.404) 0.457 19.384 ( -1.695 -0.000 -0.282) 1.718 19.405 ( -2.168 -0.000 -0.379) 2.201 19.465 ( -1.346 -0.000 -0.063) 1.348 42.451 ( -1.287 0.000 0.379) 1.342 42.491 ( -1.029 0.000 0.547) 1.166 42.598 ( 0.744 -0.000 -0.682) 1.009 42.639 ( 1.456 -0.000 -0.451) 1.524 66.196 ( -1.176 -0.000 -1.239) 1.708 66.777 ( 13.991 0.000 3.904) 14.525 67.138 ( -7.596 -0.000 -8.821) 11.641 68.800 ( -15.201 0.000 2.036) 15.337 ======================= Grid point 550 (197/216) ======================= q-point: ( 0.00 0.36 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 216 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 3.044 ( -9.178 -0.000 0.000) 9.178 3.175 ( 10.590 0.000 -0.000) 10.590 3.496 ( -4.734 -0.000 0.000) 4.734 3.745 ( 2.332 0.000 -0.000) 2.332 3.868 ( 16.721 0.000 -0.000) 16.721 3.927 ( 14.462 0.000 -0.000) 14.462 4.347 ( 30.637 0.000 -0.000) 30.637 4.368 ( 24.837 0.000 -0.000) 24.837 4.489 ( -6.739 -0.000 0.000) 6.739 5.201 ( 1.116 0.000 -0.000) 1.116 5.371 ( 1.854 0.000 -0.000) 1.854 5.590 ( -10.799 -0.000 0.000) 10.799 5.597 ( -5.631 -0.000 0.000) 5.631 5.697 ( -12.649 -0.000 0.000) 12.649 5.741 ( -17.515 -0.000 0.000) 17.515 6.254 ( 4.380 0.000 -0.000) 4.380 6.412 ( 4.720 0.000 -0.000) 4.720 6.488 ( -0.035 -0.000 0.000) 0.035 6.720 ( -14.176 -0.000 0.000) 14.176 7.007 ( -1.527 -0.000 0.000) 1.527 7.077 ( -9.485 -0.000 0.000) 9.485 7.116 ( -4.892 -0.000 0.000) 4.892 7.526 ( -6.162 -0.000 0.000) 6.162 7.613 ( 3.102 0.000 -0.000) 3.102 7.806 ( 9.460 0.000 -0.000) 9.460 8.600 ( -3.908 -0.000 0.000) 3.908 19.010 ( 0.731 0.000 -0.000) 0.731 19.048 ( -0.002 -0.000 0.000) 0.002 19.114 ( 3.156 0.000 -0.000) 3.156 19.144 ( 2.643 0.000 -0.000) 2.643 19.373 ( 0.365 0.000 -0.000) 0.365 19.382 ( -1.736 -0.000 0.000) 1.736 19.402 ( -2.399 -0.000 0.000) 2.399 19.465 ( -1.432 -0.000 0.000) 1.432 42.454 ( -1.239 -0.000 0.000) 1.239 42.496 ( -0.968 -0.000 0.000) 0.968 42.593 ( 0.685 0.000 -0.000) 0.685 42.635 ( 1.441 0.000 -0.000) 1.441 66.186 ( -1.392 -0.000 0.000) 1.392 66.817 ( 18.893 0.000 -0.000) 18.893 67.058 ( -12.334 -0.000 0.000) 12.334 68.816 ( -15.829 -0.000 0.000) 15.829 ======================= Grid point 558 (198/216) ======================= q-point: ( 0.73 0.36 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.633 ( -0.000 9.372 15.018) 17.702 2.949 ( 0.000 16.956 9.458) 19.415 3.466 ( -0.000 6.794 -5.319) 8.628 3.599 ( -0.000 8.849 -11.011) 14.126 3.834 ( -0.000 6.354 3.363) 7.189 4.196 ( 0.000 22.453 -5.779) 23.185 4.319 ( -0.000 20.943 13.853) 25.110 4.809 ( 0.000 -9.528 9.757) 13.638 5.001 ( -0.000 -4.949 1.564) 5.190 5.069 ( -0.000 -3.212 5.642) 6.492 5.169 ( 0.000 10.639 -4.638) 11.606 5.470 ( 0.000 -6.416 -5.051) 8.166 5.520 ( -0.000 -11.161 -1.812) 11.307 5.777 ( -0.000 0.827 -6.418) 6.472 5.857 ( 0.000 -1.138 -5.935) 6.043 5.991 ( -0.000 -6.604 -10.487) 12.393 6.198 ( 0.000 2.790 1.574) 3.203 6.286 ( -0.000 -1.732 -0.779) 1.899 6.591 ( -0.000 4.596 5.702) 7.323 6.747 ( 0.000 4.514 0.243) 4.520 6.978 ( -0.000 8.249 5.095) 9.696 7.205 ( 0.000 6.386 -1.946) 6.676 7.414 ( 0.000 -14.294 6.324) 15.630 7.809 ( -0.000 -12.222 -3.348) 12.673 8.324 ( -0.000 -6.381 2.855) 6.990 8.656 ( 0.000 -11.699 -7.319) 13.800 19.011 ( -0.000 0.529 1.389) 1.487 19.043 ( 0.000 -0.702 0.366) 0.792 19.122 ( -0.000 5.500 0.526) 5.526 19.163 ( 0.000 4.973 -1.191) 5.113 19.377 ( 0.000 -3.324 -0.065) 3.324 19.390 ( -0.000 -3.067 -0.672) 3.139 19.414 ( 0.000 -0.982 0.048) 0.983 19.446 ( -0.000 -1.931 -0.994) 2.172 42.481 ( 0.000 1.972 0.225) 1.985 42.487 ( -0.000 1.950 -0.035) 1.951 42.577 ( -0.000 -1.699 0.179) 1.708 42.581 ( -0.000 -1.630 -0.076) 1.632 66.239 ( 0.000 10.066 4.183) 10.900 66.533 ( -0.000 0.754 -7.667) 7.704 67.764 ( 0.000 3.332 2.754) 4.323 68.010 ( -0.000 -2.897 -8.263) 8.756 ======================= Grid point 559 (199/216) ======================= q-point: ( 0.82 0.36 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.816 ( -2.152 5.981 8.591) 10.686 3.146 ( -9.203 -5.046 1.956) 10.676 3.311 ( 7.597 11.366 -2.883) 13.972 3.814 ( -18.596 7.190 -8.641) 21.730 3.924 ( 10.137 15.730 7.589) 20.194 4.191 ( 9.829 9.814 -6.556) 15.359 4.593 ( 4.867 12.411 10.083) 16.715 4.837 ( -0.769 -6.514 9.420) 11.479 4.962 ( -2.030 6.403 9.380) 11.537 5.062 ( 13.506 -0.801 -1.788) 13.647 5.206 ( -10.042 -3.239 0.911) 10.591 5.358 ( 9.458 -5.696 -7.010) 13.078 5.445 ( -2.579 -8.094 -2.302) 8.801 5.536 ( 0.567 0.801 -5.870) 5.952 5.804 ( 1.318 -9.268 -11.818) 15.077 6.093 ( -16.863 3.732 0.185) 17.272 6.234 ( -0.280 2.737 2.303) 3.588 6.347 ( -8.979 -0.912 -2.724) 9.427 6.573 ( 8.146 6.022 0.193) 10.132 6.858 ( -4.101 5.381 3.822) 7.771 7.045 ( 3.303 6.485 0.313) 7.285 7.255 ( 2.023 -8.907 10.157) 13.660 7.375 ( -2.504 1.429 -0.961) 3.039 7.673 ( -1.946 -10.180 -7.349) 12.706 8.221 ( 10.118 -5.127 1.623) 11.459 8.546 ( -3.631 -8.926 -3.260) 10.173 19.023 ( 0.310 0.261 0.911) 0.997 19.041 ( -0.064 -0.363 0.347) 0.506 19.134 ( 3.050 5.330 0.039) 6.141 19.236 ( -3.057 5.266 -0.391) 6.101 19.309 ( 2.826 -4.892 -0.037) 5.649 19.383 ( -1.673 -2.809 -0.334) 3.286 19.400 ( 0.757 -0.274 -0.479) 0.937 19.440 ( -1.576 -1.817 -0.475) 2.452 42.467 ( 1.657 1.062 0.296) 1.990 42.515 ( 2.750 -1.382 0.384) 3.101 42.545 ( -2.653 2.066 -0.240) 3.371 42.615 ( -2.848 -1.170 -0.307) 3.094 66.253 ( 6.974 5.093 0.360) 8.643 66.616 ( -11.945 3.261 -2.184) 12.573 67.511 ( 21.490 -0.511 -2.693) 21.664 68.226 ( -22.092 -0.951 -1.436) 22.159 ======================= Grid point 560 (200/216) ======================= q-point: ( 0.91 0.36 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 666 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.929 ( -5.423 0.389 0.422) 5.453 3.191 ( -4.371 -1.334 0.161) 4.573 3.414 ( -4.841 3.237 2.596) 6.375 3.849 ( 15.553 2.895 8.248) 17.841 4.034 ( 12.861 21.016 -2.103) 24.729 4.061 ( -3.212 4.316 -9.808) 11.187 4.485 ( 3.762 -14.542 3.238) 15.366 4.746 ( 18.753 -4.516 -2.972) 19.516 4.792 ( 24.223 -1.470 2.858) 24.435 5.126 ( 0.489 8.407 9.452) 12.659 5.293 ( -9.872 4.567 4.709) 11.852 5.351 ( -9.664 -0.075 -0.336) 9.670 5.501 ( -12.255 -0.479 -1.700) 12.382 5.572 ( -6.550 -1.788 -4.482) 8.135 5.643 ( -2.426 -6.693 -9.634) 11.979 6.278 ( 0.385 2.105 1.683) 2.722 6.371 ( -10.274 -2.144 6.425) 12.305 6.480 ( -14.728 1.057 -5.990) 15.935 6.505 ( 3.565 3.173 -1.828) 5.111 6.949 ( 4.410 8.336 5.445) 10.890 7.049 ( -1.843 1.170 -1.859) 2.868 7.146 ( 3.670 -10.538 1.159) 11.219 7.443 ( -4.690 -0.029 -0.946) 4.784 7.629 ( -1.986 -0.521 -2.257) 3.051 8.001 ( 12.261 -4.641 -0.110) 13.110 8.548 ( -4.111 -3.367 0.011) 5.314 19.020 ( 0.636 -0.023 0.260) 0.687 19.045 ( -0.118 0.013 0.339) 0.359 19.130 ( 3.063 5.102 -0.009) 5.951 19.220 ( 3.006 -5.195 0.000) 6.003 19.321 ( -2.729 4.683 -0.119) 5.421 19.382 ( 0.076 -0.828 -0.123) 0.840 19.387 ( -1.336 -1.940 -0.400) 2.389 19.449 ( -1.592 -1.451 -0.127) 2.157 42.451 ( 0.872 -0.120 0.215) 0.906 42.489 ( 0.265 -0.161 0.297) 0.429 42.587 ( -1.068 1.144 -0.301) 1.594 42.639 ( -1.202 -0.454 -0.241) 1.307 66.194 ( 3.381 2.093 -0.588) 4.020 66.835 ( -12.211 2.820 1.530) 12.625 67.153 ( 19.586 -1.719 -3.917) 20.048 68.542 ( -19.702 -0.639 0.278) 19.714 ======================= Grid point 570 (201/216) ======================= q-point: ( 0.82 0.45 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.881 ( 0.000 1.691 14.933) 15.028 3.050 ( -0.000 4.250 -1.214) 4.420 3.338 ( -0.000 9.965 -3.626) 10.604 3.423 ( -0.000 12.960 -10.030) 16.388 3.938 ( -0.000 15.183 8.284) 17.296 4.077 ( 0.000 17.905 -8.348) 19.756 4.605 ( -0.000 19.942 18.746) 27.370 4.861 ( 0.000 10.867 -8.854) 14.017 5.024 ( -0.000 -5.806 0.913) 5.878 5.028 ( 0.000 0.696 -1.255) 1.435 5.243 ( 0.000 -9.795 8.302) 12.840 5.371 ( 0.000 -10.047 -7.115) 12.311 5.531 ( 0.000 -5.435 4.545) 7.085 5.655 ( -0.000 1.297 -8.791) 8.886 5.808 ( 0.000 -4.510 -0.260) 4.518 5.849 ( -0.000 -7.571 -5.719) 9.488 6.230 ( 0.000 1.916 2.232) 2.942 6.264 ( -0.000 0.315 -1.808) 1.836 6.673 ( -0.000 2.443 4.321) 4.964 6.729 ( 0.000 2.281 -2.374) 3.292 7.069 ( -0.000 13.587 5.635) 14.710 7.151 ( 0.000 15.079 -4.365) 15.698 7.544 ( 0.000 -18.313 9.197) 20.493 7.698 ( -0.000 -15.794 -9.067) 18.211 8.413 ( -0.000 -7.887 7.045) 10.575 8.534 ( 0.000 -9.857 -7.584) 12.437 19.031 ( -0.000 0.191 1.036) 1.054 19.043 ( 0.000 -0.261 -0.377) 0.458 19.132 ( -0.000 5.408 0.726) 5.456 19.146 ( 0.000 5.244 -0.957) 5.330 19.376 ( 0.000 -2.868 0.096) 2.869 19.381 ( -0.000 -2.886 -0.432) 2.918 19.419 ( 0.000 -1.833 0.541) 1.911 19.431 ( -0.000 -2.067 -0.852) 2.235 42.484 ( 0.000 1.979 0.151) 1.985 42.486 ( -0.000 1.968 -0.078) 1.969 42.579 ( -0.000 -1.669 0.087) 1.671 42.580 ( 0.000 -1.643 -0.035) 1.644 66.317 ( 0.000 7.390 5.377) 9.139 66.415 ( -0.000 4.313 -6.683) 7.954 67.817 ( 0.000 0.786 3.926) 4.004 67.896 ( -0.000 -1.065 -5.829) 5.925 ======================= Grid point 571 (202/216) ======================= q-point: ( 0.91 0.45 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.907 ( 1.237 -1.246 -0.000) 1.756 3.121 ( -8.670 -5.570 0.000) 10.305 3.315 ( 2.445 13.396 -0.000) 13.617 3.732 ( -18.237 10.750 0.000) 21.170 4.042 ( 10.631 20.465 -0.000) 23.062 4.082 ( 9.650 6.933 -0.000) 11.882 4.695 ( 10.916 1.333 -0.000) 10.997 4.923 ( 3.684 11.755 -0.000) 12.319 5.049 ( -3.929 5.675 0.000) 6.903 5.066 ( -1.086 -1.902 0.000) 2.190 5.211 ( -4.049 -7.538 0.000) 8.557 5.262 ( 4.526 -5.568 -0.000) 7.176 5.389 ( 4.818 1.640 -0.000) 5.090 5.564 ( -3.052 -13.773 0.000) 14.107 5.656 ( 1.898 -9.015 0.000) 9.213 6.095 ( -20.127 4.743 0.000) 20.679 6.258 ( -0.639 2.977 -0.000) 3.044 6.322 ( -6.580 -0.927 0.000) 6.645 6.572 ( 9.579 4.936 -0.000) 10.775 6.895 ( -9.768 2.940 0.000) 10.201 7.045 ( 11.990 12.226 -0.000) 17.125 7.349 ( -5.657 8.230 0.000) 9.987 7.392 ( 6.813 -17.710 -0.000) 18.976 7.573 ( -5.372 -8.881 0.000) 10.379 8.242 ( 11.597 -7.944 -0.000) 14.057 8.516 ( -5.728 -6.966 0.000) 9.019 19.031 ( 0.549 -0.086 -0.000) 0.556 19.043 ( -0.245 0.030 0.000) 0.247 19.134 ( 3.119 5.312 -0.000) 6.159 19.232 ( -3.150 5.353 0.000) 6.211 19.308 ( 2.821 -4.856 -0.000) 5.616 19.380 ( -1.658 -2.648 0.000) 3.125 19.396 ( 0.903 -0.539 -0.000) 1.052 19.436 ( -1.802 -1.888 0.000) 2.610 42.469 ( 1.568 1.075 -0.000) 1.901 42.518 ( 2.652 -1.404 -0.000) 3.000 42.543 ( -2.536 2.058 0.000) 3.266 42.613 ( -2.664 -1.124 0.000) 2.891 66.256 ( 7.856 3.623 -0.000) 8.651 66.597 ( -13.072 5.437 0.000) 14.157 67.489 ( 22.496 -1.719 -0.000) 22.562 68.215 ( -23.083 -0.355 0.000) 23.086 ======================= Grid point 616 (203/216) ======================= q-point: ( 0.45 -0.18 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.710 ( -8.370 0.000 -0.454) 8.382 2.750 ( -9.304 -0.000 -5.014) 10.569 3.621 ( 6.917 -0.000 9.030) 11.375 3.703 ( 6.589 -0.000 -1.714) 6.808 3.768 ( 13.765 0.000 -1.597) 13.857 3.808 ( 15.400 -0.000 -4.436) 16.026 4.437 ( 9.219 0.000 -0.207) 9.221 4.454 ( 7.957 -0.000 -0.908) 8.009 4.929 ( -1.776 -0.000 2.760) 3.282 4.982 ( 2.121 0.000 -4.018) 4.543 5.303 ( -6.604 0.000 11.531) 13.288 5.463 ( -5.170 -0.000 5.628) 7.642 5.494 ( 0.357 -0.000 -5.852) 5.863 5.641 ( 6.452 -0.000 -10.230) 12.095 5.875 ( -1.335 -0.000 5.713) 5.867 5.976 ( -3.142 0.000 -6.351) 7.086 6.519 ( -0.358 0.000 2.721) 2.744 6.552 ( -1.450 -0.000 -1.443) 2.045 6.968 ( -2.208 -0.000 8.869) 9.140 7.091 ( -2.682 -0.000 -4.564) 5.294 7.194 ( -11.526 -0.000 5.006) 12.566 7.237 ( -14.461 -0.000 -0.797) 14.483 7.378 ( -5.012 0.000 -2.008) 5.399 7.414 ( -5.648 -0.000 -5.414) 7.824 8.229 ( 9.588 -0.000 7.264) 12.029 8.336 ( 7.303 -0.000 -5.878) 9.375 18.985 ( -0.446 0.000 0.009) 0.446 18.988 ( -0.513 -0.000 -0.395) 0.648 19.127 ( 3.036 -0.000 0.275) 3.049 19.131 ( 2.935 0.000 -0.272) 2.947 19.407 ( -1.170 -0.000 0.175) 1.183 19.407 ( -1.258 0.000 0.077) 1.260 19.454 ( -0.169 -0.000 0.629) 0.651 19.462 ( -0.238 0.000 -0.373) 0.443 42.428 ( -1.715 -0.000 0.172) 1.724 42.434 ( -1.684 0.000 -0.579) 1.780 42.669 ( 1.427 0.000 0.668) 1.576 42.675 ( 1.516 -0.000 -0.067) 1.517 66.404 ( 2.862 -0.000 4.568) 5.390 66.481 ( 4.264 0.000 -4.773) 6.400 68.098 ( -3.512 -0.000 15.568) 15.959 68.332 ( -5.415 -0.000 -13.064) 14.142 ======================= Grid point 628 (204/216) ======================= q-point: ( 0.45 -0.09 0.36) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.464 ( -8.062 19.034 0.000) 20.671 2.658 ( -5.205 -2.637 0.000) 5.835 3.524 ( 2.030 28.003 -0.000) 28.076 3.816 ( 8.720 19.475 -0.000) 21.338 3.957 ( 3.657 -23.399 0.000) 23.683 4.113 ( 11.290 -16.427 -0.000) 19.932 4.544 ( 6.807 -0.647 -0.000) 6.838 4.648 ( 7.114 -11.857 -0.000) 13.827 4.855 ( -2.913 10.737 -0.000) 11.125 4.967 ( -2.739 -6.854 0.000) 7.381 5.023 ( -13.564 26.608 0.000) 29.866 5.486 ( -1.888 -24.493 0.000) 24.565 5.582 ( 10.482 15.683 -0.000) 18.863 5.790 ( 10.217 -9.722 -0.000) 14.104 5.898 ( 5.085 5.481 -0.000) 7.477 6.037 ( 5.745 -11.053 -0.000) 12.457 6.327 ( -5.304 20.567 -0.000) 21.240 6.627 ( -6.012 -12.528 0.000) 13.895 6.877 ( -10.470 9.792 0.000) 14.335 6.946 ( -3.334 9.657 0.000) 10.216 7.017 ( -17.461 -0.970 0.000) 17.488 7.091 ( -1.974 -8.116 0.000) 8.353 7.272 ( -4.971 1.623 0.000) 5.229 7.393 ( -4.503 -10.097 0.000) 11.056 8.409 ( 6.735 0.055 -0.000) 6.735 8.490 ( 11.973 -9.684 -0.000) 15.399 18.971 ( -0.435 0.922 0.000) 1.020 18.987 ( -0.355 -0.985 0.000) 1.047 19.132 ( 3.014 5.298 -0.000) 6.095 19.221 ( 3.126 -5.387 -0.000) 6.229 19.349 ( -2.258 4.136 0.000) 4.713 19.410 ( -1.577 -3.140 0.000) 3.514 19.449 ( 0.399 1.271 -0.000) 1.332 19.472 ( -0.147 -1.625 0.000) 1.632 42.423 ( 0.255 -0.039 -0.000) 0.258 42.426 ( 1.544 -0.507 -0.000) 1.625 42.642 ( -2.125 3.086 0.000) 3.747 42.691 ( -2.283 -2.625 0.000) 3.479 66.354 ( 1.205 15.496 -0.000) 15.543 66.614 ( 2.210 -15.734 0.000) 15.889 67.993 ( -1.992 20.708 -0.000) 20.804 68.328 ( -3.813 -19.619 0.000) 19.986 ======================= Grid point 640 (205/216) ======================= q-point: ( 0.45 0.00 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 216 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.337 ( 0.000 21.687 -0.000) 21.687 2.574 ( -0.000 -4.987 0.000) 4.987 3.526 ( 0.000 27.884 -0.000) 27.884 3.937 ( 0.000 24.769 -0.000) 24.769 3.963 ( -0.000 -24.331 0.000) 24.331 4.298 ( -0.000 -19.088 0.000) 19.088 4.614 ( 0.000 17.055 -0.000) 17.055 4.764 ( 0.000 0.470 -0.000) 0.470 4.806 ( -0.000 -8.911 0.000) 8.911 4.894 ( 0.000 34.620 -0.000) 34.620 4.921 ( -0.000 -16.807 0.000) 16.807 5.461 ( -0.000 -30.818 0.000) 30.818 5.886 ( 0.000 18.340 -0.000) 18.340 6.072 ( 0.000 18.115 -0.000) 18.115 6.106 ( -0.000 -4.718 0.000) 4.718 6.217 ( -0.000 -1.351 0.000) 1.351 6.348 ( 0.000 5.204 -0.000) 5.204 6.355 ( -0.000 -2.675 0.000) 2.675 6.367 ( -0.000 -1.064 0.000) 1.064 6.573 ( -0.000 -19.817 0.000) 19.817 6.923 ( 0.000 11.956 -0.000) 11.956 7.126 ( -0.000 -12.253 0.000) 12.253 7.203 ( 0.000 6.596 -0.000) 6.596 7.318 ( -0.000 -7.298 0.000) 7.298 8.532 ( 0.000 5.327 -0.000) 5.327 8.701 ( -0.000 -14.240 0.000) 14.240 18.963 ( 0.000 0.995 -0.000) 0.995 18.981 ( -0.000 -1.077 0.000) 1.077 19.202 ( 0.000 5.728 -0.000) 5.728 19.292 ( 0.000 4.110 -0.000) 4.110 19.294 ( -0.000 -5.289 0.000) 5.289 19.360 ( -0.000 -4.067 0.000) 4.067 19.456 ( 0.000 1.064 -0.000) 1.064 19.473 ( -0.000 -0.972 0.000) 0.972 42.501 ( 0.000 1.976 -0.000) 1.976 42.524 ( 0.000 2.185 -0.000) 2.185 42.534 ( -0.000 -1.951 0.000) 1.951 42.560 ( -0.000 -2.178 0.000) 2.178 66.364 ( 0.000 16.826 -0.000) 16.826 66.641 ( -0.000 -16.405 0.000) 16.405 67.969 ( 0.000 18.685 -0.000) 18.685 68.270 ( -0.000 -17.511 0.000) 17.511 ======================= Grid point 641 (206/216) ======================= q-point: ( 0.55 0.00 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.523 ( -2.888 0.000 2.758) 3.993 2.542 ( -3.882 0.000 4.863) 6.223 3.723 ( 1.532 -0.000 -4.671) 4.916 3.796 ( -1.924 0.000 4.400) 4.803 4.087 ( 5.114 0.000 -0.029) 5.115 4.104 ( 3.667 0.000 1.469) 3.950 4.651 ( 6.446 -0.000 -2.981) 7.102 4.672 ( 5.433 -0.000 -1.989) 5.785 4.807 ( -2.756 -0.000 -5.460) 6.116 4.867 ( -5.911 0.000 3.104) 6.677 5.190 ( -0.158 -0.000 -0.279) 0.320 5.238 ( -3.142 0.000 5.482) 6.319 5.841 ( 14.971 -0.000 -6.887) 16.479 5.950 ( 10.427 0.000 6.286) 12.175 6.045 ( 9.795 -0.000 -2.867) 10.206 6.082 ( 8.047 0.000 1.244) 8.142 6.383 ( -6.790 -0.000 -2.023) 7.085 6.412 ( -5.354 0.000 2.188) 5.784 6.640 ( -21.492 -0.000 -3.433) 21.765 6.686 ( -18.757 0.000 2.313) 18.899 6.972 ( 2.078 -0.000 -6.624) 6.942 7.040 ( -1.863 0.000 0.387) 1.902 7.281 ( -0.913 0.000 3.763) 3.872 7.306 ( -2.135 0.000 5.447) 5.850 8.529 ( 6.912 -0.000 -3.417) 7.711 8.562 ( 4.684 0.000 0.702) 4.736 18.974 ( -0.177 0.000 0.220) 0.282 18.975 ( -0.248 0.000 0.358) 0.435 19.222 ( 2.787 0.000 -0.104) 2.789 19.224 ( 2.702 0.000 0.098) 2.703 19.347 ( -2.203 -0.000 -0.195) 2.212 19.347 ( -2.208 -0.000 -0.136) 2.212 19.461 ( 0.264 -0.000 -0.422) 0.498 19.464 ( 0.072 -0.000 -0.058) 0.092 42.458 ( 3.656 0.000 0.017) 3.656 42.460 ( 3.407 0.000 0.294) 3.420 42.608 ( -4.660 -0.000 -0.464) 4.683 42.613 ( -4.823 -0.000 0.153) 4.825 66.474 ( 1.875 -0.000 -3.276) 3.774 66.526 ( -0.985 0.000 3.092) 3.246 68.072 ( 1.912 -0.000 -8.042) 8.266 68.177 ( -4.406 0.000 4.839) 6.545 ======================= Grid point 653 (207/216) ======================= q-point: ( 0.55 0.09 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.399 ( -0.000 21.432 7.128) 22.586 2.636 ( -0.000 -4.952 7.187) 8.728 3.545 ( 0.000 26.398 2.339) 26.502 3.945 ( -0.000 22.992 0.897) 23.010 3.954 ( 0.000 -21.626 -1.575) 21.684 4.270 ( -0.000 -15.984 -2.357) 16.157 4.635 ( -0.000 13.177 1.540) 13.267 4.681 ( -0.000 1.927 -8.753) 8.962 4.795 ( -0.000 5.850 -3.962) 7.065 4.819 ( 0.000 -7.903 1.511) 8.046 5.043 ( 0.000 8.067 7.223) 10.828 5.473 ( 0.000 -27.317 0.557) 27.323 5.868 ( -0.000 17.773 -2.278) 17.919 6.028 ( 0.000 6.119 -3.687) 7.144 6.153 ( 0.000 3.198 3.855) 5.009 6.204 ( 0.000 -0.517 -1.378) 1.472 6.296 ( 0.000 -2.365 -4.365) 4.964 6.322 ( -0.000 -1.761 -5.177) 5.469 6.405 ( -0.000 5.685 4.318) 7.139 6.607 ( 0.000 -16.213 4.041) 16.709 6.916 ( 0.000 6.790 -0.738) 6.830 7.013 ( 0.000 -3.259 -7.208) 7.910 7.345 ( -0.000 -3.006 10.636) 11.053 7.350 ( 0.000 -3.139 3.486) 4.691 8.505 ( 0.000 5.647 -3.180) 6.480 8.679 ( -0.000 -14.328 -2.642) 14.570 18.968 ( -0.000 0.989 0.589) 1.151 18.986 ( 0.000 -1.085 0.585) 1.233 19.203 ( -0.000 5.719 0.072) 5.720 19.287 ( 0.000 3.789 -0.489) 3.821 19.295 ( 0.000 -4.872 0.070) 4.872 19.357 ( 0.000 -4.105 -0.352) 4.120 19.452 ( -0.000 1.035 -0.475) 1.139 19.469 ( -0.000 -0.987 -0.491) 1.102 42.502 ( 0.000 1.979 0.153) 1.984 42.523 ( 0.000 2.116 -0.069) 2.117 42.535 ( -0.000 -1.909 0.166) 1.916 42.559 ( -0.000 -2.120 -0.138) 2.125 66.366 ( -0.000 16.221 0.282) 16.224 66.631 ( 0.000 -15.452 -1.235) 15.502 67.953 ( -0.000 17.492 -1.848) 17.590 68.235 ( -0.000 -16.319 -4.103) 16.827 ======================= Grid point 654 (208/216) ======================= q-point: ( 0.64 0.09 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.622 ( -2.046 0.000 8.742) 8.978 2.664 ( -4.285 0.000 9.329) 10.266 3.642 ( 6.594 -0.000 -5.339) 8.484 3.869 ( -1.952 0.000 4.655) 5.048 4.112 ( -2.200 -0.000 -1.144) 2.480 4.113 ( 2.427 0.000 3.414) 4.189 4.589 ( 5.044 -0.000 -6.345) 8.105 4.612 ( 9.467 -0.000 -1.588) 9.599 4.714 ( -2.153 -0.000 -4.213) 4.732 4.942 ( -9.631 0.000 5.769) 11.226 5.192 ( 3.928 -0.000 -0.553) 3.967 5.327 ( -4.251 0.000 4.204) 5.979 5.727 ( 17.077 -0.000 -7.099) 18.494 6.004 ( 11.885 -0.000 -1.693) 12.005 6.027 ( 2.012 0.000 2.157) 2.949 6.077 ( 7.289 -0.000 -1.548) 7.452 6.331 ( -7.975 -0.000 -4.600) 9.207 6.474 ( -1.749 0.000 5.312) 5.593 6.576 ( -21.862 -0.000 -3.613) 22.159 6.723 ( -12.940 0.000 2.564) 13.192 6.869 ( 3.134 -0.000 -5.240) 6.106 7.017 ( -5.517 -0.000 -1.575) 5.738 7.394 ( -0.336 0.000 8.356) 8.363 7.409 ( -1.219 0.000 6.243) 6.361 8.453 ( 8.679 -0.000 -5.750) 10.411 8.554 ( 1.949 -0.000 -1.555) 2.493 18.982 ( -0.046 0.000 0.710) 0.711 18.986 ( -0.272 0.000 0.871) 0.913 19.220 ( 2.919 0.000 -0.102) 2.920 19.225 ( 2.672 0.000 0.093) 2.674 19.341 ( -2.294 -0.000 -0.452) 2.338 19.343 ( -2.287 -0.000 -0.423) 2.326 19.450 ( 0.405 -0.000 -0.860) 0.950 19.459 ( -0.181 -0.000 -0.476) 0.510 42.460 ( 3.704 0.000 0.277) 3.714 42.467 ( 2.988 0.000 0.571) 3.042 42.599 ( -4.204 -0.000 -0.667) 4.257 42.613 ( -4.688 -0.000 -0.139) 4.690 66.420 ( 4.293 -0.000 -3.222) 5.367 66.573 ( -4.154 0.000 2.624) 4.914 67.922 ( 8.108 -0.000 -10.090) 12.944 68.230 ( -10.454 0.000 1.780) 10.604 ======================= Grid point 666 (209/216) ======================= q-point: ( 0.64 0.18 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.544 ( -0.000 20.626 9.763) 22.820 2.783 ( -0.000 -5.065 9.896) 11.117 3.595 ( -0.000 20.689 3.183) 20.932 3.894 ( -0.000 -13.062 -5.853) 14.313 3.963 ( -0.000 18.845 1.303) 18.890 4.263 ( -0.000 -17.750 2.165) 17.881 4.539 ( -0.000 9.642 -6.740) 11.764 4.637 ( 0.000 8.506 -0.545) 8.524 4.800 ( -0.000 0.884 3.724) 3.828 4.852 ( 0.000 -6.429 2.342) 6.842 5.130 ( 0.000 6.133 3.414) 7.019 5.454 ( -0.000 -21.106 -3.109) 21.334 5.810 ( 0.000 16.299 -4.828) 16.999 5.960 ( 0.000 1.272 -4.696) 4.865 6.156 ( 0.000 0.810 -6.472) 6.523 6.198 ( 0.000 -6.104 -7.838) 9.935 6.212 ( -0.000 0.992 2.918) 3.082 6.234 ( 0.000 -0.678 -3.127) 3.200 6.507 ( 0.000 10.201 8.150) 13.057 6.702 ( 0.000 -9.574 7.534) 12.183 6.903 ( 0.000 -2.078 -0.770) 2.216 6.928 ( 0.000 -1.783 -3.035) 3.520 7.414 ( 0.000 3.826 3.830) 5.414 7.509 ( -0.000 -6.995 8.988) 11.389 8.434 ( 0.000 6.499 -5.264) 8.363 8.618 ( -0.000 -14.461 -4.592) 15.172 18.982 ( -0.000 0.954 1.043) 1.413 18.999 ( 0.000 -1.076 0.986) 1.459 19.205 ( -0.000 5.691 0.166) 5.694 19.276 ( 0.000 4.265 -0.813) 4.342 19.296 ( 0.000 -5.093 0.127) 5.094 19.349 ( 0.000 -4.203 -0.615) 4.247 19.441 ( -0.000 0.937 -0.826) 1.250 19.457 ( -0.000 -1.019 -0.884) 1.349 42.506 ( 0.000 1.983 0.256) 2.000 42.522 ( 0.000 2.018 -0.082) 2.020 42.539 ( -0.000 -1.871 0.264) 1.890 42.556 ( -0.000 -1.992 -0.178) 2.000 66.372 ( 0.000 14.479 0.473) 14.486 66.601 ( -0.000 -12.767 -2.358) 12.983 67.913 ( 0.000 14.279 -2.795) 14.550 68.146 ( -0.000 -13.279 -6.545) 14.805 ======================= Grid point 667 (210/216) ======================= q-point: ( 0.73 0.18 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.784 ( -2.706 0.000 10.294) 10.644 2.812 ( -4.002 0.000 7.792) 8.759 3.551 ( 9.465 -0.000 -5.589) 10.991 3.949 ( 1.905 0.000 5.145) 5.486 4.053 ( -9.795 -0.000 -5.852) 11.410 4.195 ( -0.339 0.000 6.005) 6.015 4.523 ( 5.351 -0.000 -0.377) 5.365 4.590 ( 14.007 -0.000 -1.046) 14.046 4.720 ( -3.573 0.000 5.149) 6.267 5.037 ( -11.860 0.000 5.433) 13.045 5.158 ( 6.725 -0.000 -3.510) 7.585 5.354 ( -4.760 -0.000 -0.829) 4.831 5.609 ( 17.319 -0.000 -7.424) 18.844 5.969 ( 0.386 -0.000 -7.866) 7.875 5.983 ( 11.055 -0.000 -2.240) 11.280 6.083 ( -1.260 0.000 1.403) 1.886 6.245 ( -7.417 -0.000 -4.675) 8.768 6.467 ( -15.527 -0.000 -4.876) 16.274 6.642 ( -1.911 0.000 9.908) 10.090 6.752 ( 2.373 -0.000 -0.891) 2.535 6.833 ( -4.542 0.000 2.750) 5.309 7.007 ( -8.108 -0.000 0.360) 8.116 7.489 ( 0.469 0.000 3.181) 3.215 7.521 ( -1.005 0.000 6.581) 6.657 8.348 ( 10.088 -0.000 -6.766) 12.146 8.518 ( -1.171 -0.000 -2.551) 2.807 18.996 ( 0.135 0.000 0.983) 0.992 19.003 ( -0.274 0.000 1.172) 1.203 19.219 ( 3.082 0.000 -0.083) 3.083 19.227 ( 2.703 0.000 0.090) 2.704 19.333 ( -2.477 -0.000 -0.540) 2.536 19.334 ( -2.401 -0.000 -0.573) 2.469 19.433 ( 0.516 -0.000 -1.144) 1.255 19.449 ( -0.490 -0.000 -0.731) 0.880 42.466 ( 3.572 0.000 0.429) 3.598 42.478 ( 2.473 0.000 0.720) 2.576 42.587 ( -3.545 -0.000 -0.699) 3.614 42.609 ( -4.339 -0.000 -0.306) 4.350 66.370 ( 6.129 -0.000 -2.909) 6.784 66.610 ( -7.481 0.000 1.855) 7.707 67.754 ( 13.905 -0.000 -10.036) 17.148 68.241 ( -15.706 -0.000 -0.213) 15.707 ======================= Grid point 679 (211/216) ======================= q-point: ( 0.73 0.27 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.695 ( -0.000 18.214 8.292) 20.013 2.930 ( -0.000 -6.250 7.517) 9.776 3.613 ( -0.000 10.628 -2.022) 10.819 3.779 ( -0.000 -6.455 -7.611) 9.980 4.004 ( -0.000 18.898 4.406) 19.405 4.325 ( 0.000 -18.780 4.080) 19.218 4.510 ( -0.000 18.148 3.923) 18.567 4.653 ( 0.000 8.727 3.340) 9.344 4.883 ( -0.000 -2.696 5.962) 6.543 4.891 ( -0.000 -4.698 2.396) 5.274 5.161 ( 0.000 0.166 0.821) 0.838 5.380 ( -0.000 -16.798 -5.592) 17.704 5.708 ( 0.000 15.069 -8.015) 17.068 5.877 ( 0.000 -1.763 -5.580) 5.851 6.007 ( 0.000 0.483 -10.042) 10.053 6.041 ( 0.000 -6.775 -10.990) 12.911 6.225 ( 0.000 1.841 0.785) 2.002 6.249 ( -0.000 -1.308 1.689) 2.136 6.646 ( 0.000 13.128 7.690) 15.214 6.827 ( 0.000 5.278 4.891) 7.195 6.912 ( 0.000 -16.349 4.587) 16.980 6.924 ( 0.000 -3.301 3.082) 4.516 7.459 ( 0.000 8.663 1.254) 8.754 7.619 ( -0.000 -10.197 3.925) 10.926 8.349 ( 0.000 7.012 -4.612) 8.393 8.536 ( 0.000 -14.062 -5.329) 15.038 19.001 ( -0.000 0.844 1.241) 1.501 19.016 ( 0.000 -0.969 1.063) 1.438 19.208 ( -0.000 5.641 0.291) 5.649 19.262 ( 0.000 4.663 -0.942) 4.757 19.299 ( 0.000 -5.142 0.212) 5.146 19.338 ( -0.000 -4.329 -0.727) 4.390 19.426 ( -0.000 0.735 -0.930) 1.186 19.441 ( -0.000 -1.026 -1.082) 1.492 42.510 ( 0.000 1.983 0.280) 2.003 42.520 ( 0.000 1.952 -0.056) 1.953 42.543 ( -0.000 -1.853 0.276) 1.874 42.553 ( -0.000 -1.871 -0.123) 1.875 66.382 ( 0.000 11.783 0.656) 11.801 66.556 ( -0.000 -8.848 -3.116) 9.380 67.869 ( 0.000 9.954 -2.489) 10.261 68.034 ( -0.000 -9.483 -6.759) 11.645 ======================= Grid point 680 (212/216) ======================= q-point: ( 0.82 0.27 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.896 ( -2.511 0.000 2.374) 3.456 2.936 ( -5.180 0.000 7.977) 9.511 3.473 ( 8.284 -0.000 -3.504) 8.995 3.944 ( -13.519 -0.000 -6.743) 15.107 4.035 ( 6.298 0.000 5.167) 8.146 4.274 ( 1.990 0.000 2.957) 3.565 4.584 ( 17.036 0.000 0.303) 17.039 4.613 ( 2.870 0.000 11.567) 11.918 4.858 ( -5.461 0.000 11.131) 12.398 5.087 ( 8.355 -0.000 -4.801) 9.636 5.112 ( -12.258 0.000 3.741) 12.816 5.322 ( -5.360 -0.000 -2.215) 5.799 5.486 ( 16.971 -0.000 -7.655) 18.617 5.804 ( -1.711 -0.000 -12.030) 12.152 5.880 ( 3.002 -0.000 -10.476) 10.898 6.106 ( -9.235 0.000 1.440) 9.346 6.222 ( -1.422 0.000 1.701) 2.217 6.388 ( -13.417 -0.000 -4.487) 14.148 6.711 ( 7.809 -0.000 -2.986) 8.360 6.808 ( 1.737 0.000 9.407) 9.566 6.938 ( -2.282 0.000 8.705) 8.999 7.030 ( -8.214 0.000 2.596) 8.615 7.502 ( 1.885 -0.000 -1.814) 2.617 7.594 ( -2.429 0.000 2.096) 3.208 8.245 ( 11.163 -0.000 -5.430) 12.414 8.480 ( -4.109 -0.000 -2.017) 4.577 19.012 ( 0.336 0.000 0.949) 1.007 19.022 ( -0.272 0.000 1.137) 1.170 19.218 ( 3.250 0.000 -0.051) 3.251 19.228 ( 2.775 0.000 0.074) 2.776 19.325 ( -2.611 0.000 -0.484) 2.656 19.325 ( -2.612 0.000 -0.483) 2.657 19.414 ( 0.622 -0.000 -1.156) 1.313 19.437 ( -0.825 -0.000 -0.738) 1.107 42.474 ( 3.333 0.000 0.440) 3.362 42.490 ( 1.969 0.000 0.671) 2.080 42.577 ( -2.844 -0.000 -0.577) 2.902 42.604 ( -3.914 -0.000 -0.317) 3.927 66.327 ( 7.321 -0.000 -2.261) 7.663 66.633 ( -10.610 0.000 0.951) 10.653 67.607 ( 18.878 -0.000 -7.805) 20.428 68.230 ( -19.685 -0.000 -0.935) 19.707 ======================= Grid point 692 (213/216) ======================= q-point: ( 0.82 0.36 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.813 ( -0.000 12.383 6.440) 13.958 3.012 ( -0.000 -8.851 2.084) 9.093 3.548 ( -0.000 8.906 -4.174) 9.836 3.661 ( -0.000 -2.092 -6.610) 6.933 4.102 ( -0.000 18.912 6.853) 20.115 4.352 ( 0.000 -7.450 -1.205) 7.547 4.658 ( -0.000 18.155 13.142) 22.412 4.755 ( 0.000 4.152 8.211) 9.201 4.928 ( -0.000 -2.605 2.197) 3.408 4.992 ( -0.000 -4.516 7.325) 8.605 5.177 ( 0.000 -7.069 1.919) 7.324 5.283 ( -0.000 -13.667 -5.981) 14.918 5.538 ( 0.000 13.607 -12.917) 18.762 5.756 ( -0.000 -9.168 -10.741) 14.122 5.867 ( 0.000 0.898 -6.414) 6.477 5.874 ( 0.000 -1.986 -7.586) 7.842 6.244 ( 0.000 2.184 1.353) 2.569 6.269 ( -0.000 -1.042 0.797) 1.312 6.731 ( 0.000 11.560 3.082) 11.964 6.832 ( 0.000 3.879 -1.642) 4.212 7.033 ( 0.000 -2.082 9.497) 9.723 7.075 ( -0.000 -12.869 12.405) 17.875 7.446 ( -0.000 10.510 -2.951) 10.916 7.619 ( -0.000 -10.440 -4.164) 11.240 8.303 ( 0.000 4.372 -0.631) 4.417 8.451 ( 0.000 -12.043 -4.892) 12.999 19.021 ( -0.000 0.606 1.095) 1.251 19.031 ( 0.000 -0.697 0.751) 1.025 19.214 ( -0.000 5.558 0.436) 5.575 19.247 ( 0.000 4.984 -0.889) 5.062 19.303 ( 0.000 -5.057 0.299) 5.066 19.326 ( -0.000 -4.468 -0.678) 4.519 19.413 ( -0.000 0.379 -0.679) 0.778 19.424 ( -0.000 -0.929 -0.996) 1.362 42.514 ( 0.000 1.971 0.229) 1.984 42.520 ( 0.000 1.924 -0.037) 1.924 42.547 ( -0.000 -1.832 0.214) 1.845 42.552 ( -0.000 -1.804 -0.057) 1.805 66.395 ( 0.000 8.367 1.058) 8.433 66.503 ( -0.000 -4.359 -3.226) 5.423 67.838 ( 0.000 5.500 -1.153) 5.619 67.935 ( -0.000 -5.719 -5.294) 7.793 ======================= Grid point 693 (214/216) ======================= q-point: ( 0.91 0.36 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.902 ( -0.150 -0.000 -0.898) 0.911 3.035 ( -7.732 0.000 4.037) 8.723 3.441 ( 5.077 -0.000 -0.744) 5.132 3.853 ( -17.326 -0.000 -4.093) 17.803 4.109 ( 12.117 0.000 3.523) 12.619 4.299 ( 4.907 0.000 0.558) 4.939 4.594 ( 17.567 0.000 0.648) 17.579 4.859 ( 1.019 0.000 17.024) 17.055 5.000 ( 12.935 -0.000 -1.959) 13.082 5.083 ( -8.842 0.000 12.445) 15.266 5.160 ( -11.330 0.000 2.250) 11.551 5.291 ( -9.609 -0.000 -2.428) 9.911 5.361 ( 17.705 -0.000 -7.246) 19.131 5.587 ( -4.244 -0.000 -14.261) 14.879 5.685 ( 0.975 -0.000 -11.700) 11.740 6.129 ( -17.190 0.000 1.247) 17.235 6.264 ( -0.489 0.000 2.538) 2.584 6.327 ( -7.850 -0.000 -2.780) 8.328 6.668 ( 9.772 -0.000 -2.166) 10.009 6.917 ( -3.574 0.000 3.697) 5.142 7.096 ( 3.417 0.000 10.196) 10.754 7.099 ( 0.198 0.000 5.411) 5.415 7.431 ( 1.205 -0.000 -6.464) 6.575 7.589 ( -4.942 -0.000 -2.157) 5.392 8.182 ( 11.629 -0.000 -2.331) 11.860 8.456 ( -5.998 -0.000 -0.860) 6.059 19.025 ( 0.501 0.000 0.588) 0.772 19.038 ( -0.276 0.000 0.713) 0.765 19.217 ( 3.383 0.000 -0.019) 3.383 19.229 ( 2.841 0.000 0.039) 2.841 19.318 ( -2.561 -0.000 -0.329) 2.582 19.320 ( -2.952 -0.000 -0.197) 2.959 19.398 ( 0.737 -0.000 -0.771) 1.066 19.426 ( -1.107 -0.000 -0.468) 1.201 42.480 ( 3.101 0.000 0.287) 3.114 42.499 ( 1.594 0.000 0.409) 1.646 42.569 ( -2.298 -0.000 -0.334) 2.322 42.600 ( -3.568 -0.000 -0.198) 3.574 66.298 ( 7.941 -0.000 -1.252) 8.039 66.642 ( -12.887 -0.000 0.277) 12.890 67.508 ( 22.305 -0.000 -4.153) 22.688 68.216 ( -22.119 -0.000 -0.703) 22.131 ======================= Grid point 695 (215/216) ======================= q-point: ( 1.00 0.45 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 216 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.891 ( 0.900 0.000 -0.000) 0.900 3.068 ( -8.687 -0.000 0.000) 8.687 3.437 ( 3.543 0.000 -0.000) 3.543 3.818 ( -18.594 -0.000 0.000) 18.594 4.139 ( 14.100 0.000 -0.000) 14.100 4.302 ( 5.787 0.000 -0.000) 5.787 4.600 ( 17.467 0.000 -0.000) 17.467 4.972 ( 13.535 0.000 -0.000) 13.535 5.095 ( 4.811 0.000 -0.000) 4.811 5.145 ( -14.176 -0.000 0.000) 14.176 5.219 ( 4.143 0.000 -0.000) 4.143 5.275 ( -8.388 -0.000 0.000) 8.388 5.309 ( -1.679 -0.000 0.000) 1.679 5.389 ( -5.463 -0.000 0.000) 5.463 5.572 ( 4.341 0.000 -0.000) 4.341 6.141 ( -21.897 -0.000 0.000) 21.897 6.287 ( -1.245 -0.000 0.000) 1.245 6.303 ( -3.931 -0.000 0.000) 3.931 6.648 ( 10.841 0.000 -0.000) 10.841 6.944 ( -7.334 -0.000 0.000) 7.334 7.156 ( 6.576 0.000 -0.000) 6.576 7.223 ( 12.024 0.000 -0.000) 12.024 7.336 ( -5.693 -0.000 0.000) 5.693 7.561 ( -7.242 -0.000 0.000) 7.242 8.164 ( 11.634 0.000 -0.000) 11.634 8.450 ( -6.582 -0.000 0.000) 6.582 19.030 ( 0.566 0.000 -0.000) 0.566 19.044 ( -0.279 -0.000 0.000) 0.279 19.217 ( 3.433 0.000 -0.000) 3.433 19.229 ( 2.863 0.000 -0.000) 2.863 19.315 ( -2.577 -0.000 0.000) 2.577 19.318 ( -3.057 -0.000 0.000) 3.057 19.391 ( 0.800 0.000 -0.000) 0.800 19.422 ( -1.221 -0.000 0.000) 1.221 42.482 ( 3.003 0.000 -0.000) 3.003 42.502 ( 1.454 0.000 -0.000) 1.454 42.566 ( -2.089 -0.000 0.000) 2.089 42.598 ( -3.435 -0.000 0.000) 3.435 66.288 ( 8.125 0.000 -0.000) 8.125 66.644 ( -13.709 -0.000 0.000) 13.709 67.474 ( 23.520 0.000 -0.000) 23.520 68.210 ( -22.932 -0.000 0.000) 22.932 ======================= Grid point 708 (216/216) ======================= q-point: ( 0.91 0.45 0.45) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 1.84e-05 2.98e-04 2.98e-04 Number of triplets: 366 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.912 ( -0.000 3.097 5.794) 6.570 2.994 ( -0.000 -6.352 -3.769) 7.386 3.519 ( 0.000 8.860 0.914) 8.907 3.568 ( -0.000 3.428 -4.672) 5.794 4.209 ( -0.000 14.009 6.156) 15.302 4.299 ( 0.000 5.349 -4.695) 7.117 4.866 ( -0.000 4.950 7.299) 8.819 4.868 ( 0.000 -1.153 4.406) 4.554 4.995 ( -0.000 8.636 9.523) 12.855 5.095 ( -0.000 -3.120 4.199) 5.232 5.192 ( -0.000 -8.815 -4.886) 10.078 5.217 ( 0.000 4.841 -4.533) 6.632 5.353 ( 0.000 -5.755 -0.062) 5.755 5.535 ( -0.000 -14.015 -14.722) 20.327 5.802 ( 0.000 1.188 -1.813) 2.168 5.803 ( 0.000 0.837 -1.952) 2.124 6.264 ( 0.000 1.391 1.017) 1.722 6.274 ( -0.000 0.097 -0.166) 0.192 6.768 ( -0.000 7.424 1.927) 7.670 6.800 ( 0.000 4.429 -2.015) 4.866 7.198 ( -0.000 0.683 9.773) 9.797 7.269 ( 0.000 -12.327 8.520) 14.984 7.375 ( -0.000 10.402 -3.042) 10.837 7.496 ( -0.000 -7.009 -10.110) 12.302 8.323 ( -0.000 -1.707 2.647) 3.150 8.379 ( 0.000 -7.737 -3.985) 8.703 19.035 ( -0.000 0.218 0.594) 0.633 19.039 ( 0.000 -0.264 0.118) 0.289 19.223 ( -0.000 5.427 0.585) 5.458 19.233 ( 0.000 5.236 -0.741) 5.288 19.309 ( 0.000 -4.864 0.390) 4.879 19.316 ( -0.000 -4.641 -0.527) 4.671 19.406 ( 0.000 -0.129 -0.090) 0.158 19.410 ( -0.000 -0.629 -0.573) 0.851 42.517 ( 0.000 1.949 0.141) 1.954 42.519 ( -0.000 1.928 -0.065) 1.929 42.550 ( -0.000 -1.807 0.119) 1.811 42.551 ( 0.000 -1.790 -0.052) 1.791 66.418 ( 0.000 4.444 1.799) 4.795 66.454 ( -0.000 0.161 -2.672) 2.676 67.835 ( 0.000 1.469 0.809) 1.677 67.866 ( -0.000 -2.157 -3.082) 3.761 =================== 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 3/55902 10.0 183.534 226.721 274.707 0.000 -0.000 0.000 3/55902 20.0 50.689 47.588 41.259 0.000 -0.000 0.000 3/55902 30.0 22.033 22.792 15.634 0.000 -0.000 0.000 3/55902 40.0 12.616 13.514 8.374 0.000 -0.000 0.000 3/55902 50.0 8.683 9.317 5.470 0.000 -0.000 0.000 3/55902 60.0 6.662 7.097 4.029 0.000 -0.000 0.000 3/55902 70.0 5.458 5.770 3.199 0.000 -0.000 0.000 3/55902 80.0 4.661 4.902 2.667 0.000 -0.000 0.000 3/55902 90.0 4.093 4.299 2.298 0.000 -0.000 0.000 3/55902 100.0 3.664 3.863 2.026 0.000 -0.000 0.000 3/55902 110.0 3.327 3.543 1.818 0.000 -0.000 0.000 3/55902 120.0 3.054 3.307 1.651 0.000 -0.000 0.000 3/55902 130.0 2.827 3.134 1.515 0.000 -0.000 0.000 3/55902 140.0 2.635 3.010 1.401 0.000 -0.000 0.000 3/55902 150.0 2.471 2.922 1.305 0.000 -0.000 0.000 3/55902 160.0 2.329 2.862 1.222 0.000 -0.000 0.000 3/55902 170.0 2.205 2.823 1.149 0.000 -0.000 0.000 3/55902 180.0 2.096 2.799 1.086 0.000 -0.000 0.000 3/55902 190.0 1.999 2.785 1.029 0.000 -0.000 0.000 3/55902 200.0 1.912 2.779 0.979 0.000 -0.000 0.000 3/55902 210.0 1.835 2.778 0.933 0.000 -0.000 0.000 3/55902 220.0 1.765 2.780 0.892 0.000 -0.000 0.000 3/55902 230.0 1.702 2.783 0.855 0.000 -0.000 0.000 3/55902 240.0 1.645 2.787 0.821 0.000 -0.000 0.000 3/55902 250.0 1.593 2.791 0.790 0.000 -0.000 0.000 3/55902 260.0 1.546 2.794 0.762 0.000 -0.000 0.000 3/55902 270.0 1.503 2.797 0.735 0.000 -0.000 0.000 3/55902 280.0 1.463 2.798 0.711 0.000 -0.000 0.000 3/55902 290.0 1.427 2.798 0.688 0.000 -0.000 0.000 3/55902 300.0 1.393 2.798 0.668 0.000 -0.000 0.000 3/55902 310.0 1.363 2.796 0.648 0.000 -0.000 0.000 3/55902 320.0 1.335 2.794 0.630 0.000 -0.000 0.000 3/55902 330.0 1.309 2.790 0.614 0.000 -0.000 0.000 3/55902 340.0 1.285 2.786 0.598 0.000 -0.000 0.000 3/55902 350.0 1.263 2.781 0.584 0.000 -0.000 0.000 3/55902 360.0 1.243 2.776 0.571 0.000 -0.000 0.000 3/55902 370.0 1.225 2.771 0.558 0.000 -0.000 0.000 3/55902 380.0 1.208 2.765 0.547 0.000 -0.000 0.000 3/55902 390.0 1.192 2.760 0.536 0.000 -0.000 0.000 3/55902 400.0 1.178 2.754 0.527 0.000 -0.000 0.000 3/55902 410.0 1.165 2.748 0.518 0.000 -0.000 0.000 3/55902 420.0 1.153 2.742 0.509 0.000 -0.000 0.000 3/55902 430.0 1.143 2.737 0.502 0.000 -0.000 0.000 3/55902 440.0 1.133 2.732 0.495 0.000 -0.000 0.000 3/55902 450.0 1.124 2.726 0.488 0.000 -0.000 0.000 3/55902 460.0 1.116 2.722 0.482 0.000 -0.000 0.000 3/55902 470.0 1.109 2.717 0.477 0.000 -0.000 0.000 3/55902 480.0 1.102 2.713 0.472 0.000 -0.000 0.000 3/55902 490.0 1.096 2.709 0.468 0.000 -0.000 0.000 3/55902 500.0 1.091 2.706 0.464 0.000 -0.000 0.000 3/55902 510.0 1.086 2.702 0.460 0.000 -0.000 0.000 3/55902 520.0 1.082 2.699 0.457 0.000 -0.000 0.000 3/55902 530.0 1.079 2.697 0.454 0.000 -0.000 0.000 3/55902 540.0 1.076 2.695 0.452 0.000 -0.000 0.000 3/55902 550.0 1.073 2.693 0.450 0.000 -0.000 0.000 3/55902 560.0 1.071 2.691 0.448 0.000 -0.000 0.000 3/55902 570.0 1.069 2.690 0.446 0.000 -0.000 0.000 3/55902 580.0 1.068 2.689 0.445 0.000 -0.000 0.000 3/55902 590.0 1.066 2.688 0.444 0.000 -0.000 0.000 3/55902 600.0 1.065 2.687 0.443 0.000 -0.000 0.000 3/55902 610.0 1.065 2.687 0.442 0.000 -0.000 0.000 3/55902 620.0 1.064 2.687 0.442 0.000 -0.000 0.000 3/55902 630.0 1.064 2.687 0.441 0.000 -0.000 0.000 3/55902 640.0 1.064 2.687 0.441 0.000 -0.000 0.000 3/55902 650.0 1.064 2.687 0.441 0.000 -0.000 0.000 3/55902 660.0 1.064 2.688 0.441 0.000 -0.000 0.000 3/55902 670.0 1.064 2.688 0.441 0.000 -0.000 0.000 3/55902 680.0 1.065 2.689 0.441 0.000 -0.000 0.000 3/55902 690.0 1.065 2.690 0.441 0.000 -0.000 0.000 3/55902 700.0 1.066 2.691 0.441 0.000 -0.000 0.000 3/55902 710.0 1.067 2.692 0.442 0.000 -0.000 0.000 3/55902 720.0 1.067 2.693 0.442 0.000 -0.000 0.000 3/55902 730.0 1.068 2.694 0.443 0.000 -0.000 0.000 3/55902 740.0 1.069 2.695 0.443 0.000 -0.000 0.000 3/55902 750.0 1.070 2.696 0.444 0.000 -0.000 0.000 3/55902 760.0 1.071 2.697 0.444 0.000 -0.000 0.000 3/55902 770.0 1.072 2.698 0.445 0.000 -0.000 0.000 3/55902 780.0 1.073 2.699 0.446 0.000 -0.000 0.000 3/55902 790.0 1.073 2.700 0.446 0.000 -0.000 0.000 3/55902 800.0 1.074 2.701 0.447 0.000 -0.000 0.000 3/55902 810.0 1.075 2.702 0.448 0.000 -0.000 0.000 3/55902 820.0 1.076 2.703 0.448 0.000 -0.000 0.000 3/55902 830.0 1.077 2.704 0.449 0.000 -0.000 0.000 3/55902 840.0 1.078 2.705 0.450 0.000 -0.000 0.000 3/55902 850.0 1.078 2.706 0.450 0.000 -0.000 0.000 3/55902 860.0 1.079 2.707 0.451 0.000 -0.000 0.000 3/55902 870.0 1.080 2.708 0.452 0.000 -0.000 0.000 3/55902 880.0 1.081 2.709 0.452 0.000 -0.000 0.000 3/55902 890.0 1.081 2.709 0.453 0.000 -0.000 0.000 3/55902 900.0 1.082 2.710 0.453 0.000 -0.000 0.000 3/55902 910.0 1.082 2.711 0.454 0.000 -0.000 0.000 3/55902 920.0 1.083 2.711 0.454 0.000 -0.000 0.000 3/55902 930.0 1.083 2.711 0.455 0.000 -0.000 0.000 3/55902 940.0 1.084 2.712 0.455 0.000 -0.000 0.000 3/55902 950.0 1.084 2.712 0.456 0.000 -0.000 0.000 3/55902 960.0 1.084 2.712 0.456 0.000 -0.000 0.000 3/55902 970.0 1.085 2.712 0.457 0.000 -0.000 0.000 3/55902 980.0 1.085 2.713 0.457 0.000 -0.000 0.000 3/55902 990.0 1.085 2.712 0.458 0.000 -0.000 0.000 3/55902 1000.0 1.085 2.712 0.458 0.000 -0.000 0.000 3/55902 Thermal conductivity related properties were written into "kappa-m111111.hdf5". Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-07 18:38:43]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|