----------------------------- ------- calculate fc2 ------- ----------------------------- _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1 -------------------------[time 2026-01-08 05:04:19]------------------------- Compiled with OpenMP support (max 128 threads). Running in phonopy.load mode. Python version 3.14.2 Spglib version 2.6.1 Crystal structure was read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". Unit of length: angstrom Settings: Supercell: [1 2 2] Primitive matrix: [0.5 0.5 0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: Cmcm (63) Number of symmetry operations in supercell: 64 ------------------------------ primitive cell ------------------------------ Lattice vectors: a 4.168105475000000 -3.586545125000000 0.000000000000000 b 4.168105475000000 3.586545125000000 0.000000000000000 c 0.000000000000000 0.000000000000000 6.538658250000002 Atomic positions (fractional): *1 Li 0.15395316081468 0.15395316081468 0.00000000000000 6.941 2 Li 0.84604683918532 0.84604683918532 0.50000000000000 6.941 *3 Li 0.88874717053179 0.40510271584182 0.25000000000000 6.941 4 Li 0.11125282946822 0.59489728415818 0.75000000000000 6.941 5 Li 0.59489728415818 0.11125282946821 0.25000000000000 6.941 6 Li 0.40510271584182 0.88874717053179 0.75000000000000 6.941 7 Li 0.15395316081468 0.15395316081468 0.50000000000000 6.941 8 Li 0.84604683918532 0.84604683918532 0.00000000000000 6.941 *9 O 0.70886610585052 0.74153353743454 0.25000000000000 15.999 10 O 0.29113389414948 0.25846646256546 0.75000000000000 15.999 *11 O 0.79278691860142 0.20721308139858 0.47753759056446 15.999 12 O 0.20721308139858 0.79278691860142 0.97753759056446 15.999 13 O 0.79278691860142 0.20721308139858 0.02246240943554 15.999 14 O 0.20721308139858 0.79278691860142 0.52246240943554 15.999 15 O 0.25846646256546 0.29113389414948 0.25000000000000 15.999 16 O 0.74153353743454 0.70886610585052 0.75000000000000 15.999 *17 Pb 0.64276062697545 0.35723937302455 0.75000000000000 207.200 18 Pb 0.35723937302455 0.64276062697545 0.25000000000000 207.200 -------------------------------- unit cell --------------------------------- Lattice vectors: a 8.336210950000000 0.000000000000000 0.000000000000000 b 0.000000000000000 7.173090250000000 0.000000000000000 c 0.000000000000000 0.000000000000000 6.538658250000002 Atomic positions (fractional): *1 Li 0.15395316081468 0.00000000000000 0.00000000000000 6.941 > 1 2 Li 0.84604683918532 0.00000000000000 0.50000000000000 6.941 > 2 *3 Li 0.64692494318680 0.75817777265502 0.25000000000000 6.941 > 3 4 Li 0.35307505681320 0.24182222734498 0.75000000000000 6.941 > 4 5 Li 0.35307505681320 0.75817777265502 0.25000000000000 6.941 > 5 6 Li 0.64692494318680 0.24182222734498 0.75000000000000 6.941 > 6 7 Li 0.15395316081468 0.00000000000000 0.50000000000000 6.941 > 7 8 Li 0.84604683918532 0.00000000000000 0.00000000000000 6.941 > 8 9 Li 0.65395316081468 0.50000000000000 0.00000000000000 6.941 > 1 10 Li 0.34604683918532 0.50000000000000 0.50000000000000 6.941 > 2 11 Li 0.14692494318680 0.25817777265502 0.25000000000000 6.941 > 3 12 Li 0.85307505681320 0.74182222734498 0.75000000000000 6.941 > 4 13 Li 0.85307505681320 0.25817777265502 0.25000000000000 6.941 > 5 14 Li 0.14692494318680 0.74182222734498 0.75000000000000 6.941 > 6 15 Li 0.65395316081468 0.50000000000000 0.50000000000000 6.941 > 7 16 Li 0.34604683918532 0.50000000000000 0.00000000000000 6.941 > 8 *17 O 0.72519982164253 0.01633371579201 0.25000000000000 15.999 > 9 18 O 0.27480017835747 0.98366628420799 0.75000000000000 15.999 > 10 *19 O 0.50000000000000 0.70721308139858 0.47753759056446 15.999 > 11 20 O 0.50000000000000 0.29278691860142 0.97753759056446 15.999 > 12 21 O 0.50000000000000 0.70721308139858 0.02246240943554 15.999 > 13 22 O 0.50000000000000 0.29278691860142 0.52246240943554 15.999 > 14 23 O 0.27480017835747 0.01633371579201 0.25000000000000 15.999 > 15 24 O 0.72519982164253 0.98366628420799 0.75000000000000 15.999 > 16 25 O 0.22519982164253 0.51633371579201 0.25000000000000 15.999 > 9 26 O 0.77480017835747 0.48366628420799 0.75000000000000 15.999 > 10 27 O 0.00000000000000 0.20721308139858 0.47753759056446 15.999 > 11 28 O 0.00000000000000 0.79278691860142 0.97753759056446 15.999 > 12 29 O 0.00000000000000 0.20721308139858 0.02246240943554 15.999 > 13 30 O 0.00000000000000 0.79278691860142 0.52246240943554 15.999 > 14 31 O 0.77480017835747 0.51633371579201 0.25000000000000 15.999 > 15 32 O 0.22519982164253 0.48366628420799 0.75000000000000 15.999 > 16 *33 Pb 0.50000000000000 0.85723937302455 0.75000000000000 207.200 > 17 34 Pb 0.50000000000000 0.14276062697545 0.25000000000000 207.200 > 18 35 Pb 0.00000000000000 0.35723937302455 0.75000000000000 207.200 > 17 36 Pb 0.00000000000000 0.64276062697545 0.25000000000000 207.200 > 18 -------------------------------- super cell -------------------------------- Lattice vectors: a 8.336210950000000 0.000000000000000 0.000000000000000 b 0.000000000000000 14.346180499999999 0.000000000000000 c 0.000000000000000 0.000000000000000 13.077316500000004 Atomic positions (fractional): *1 Li 0.15395316081468 0.00000000000000 0.00000000000000 6.941 > 1 2 Li 0.15395316081468 0.50000000000000 0.00000000000000 6.941 > 1 3 Li 0.15395316081468 0.00000000000000 0.50000000000000 6.941 > 1 4 Li 0.15395316081468 0.50000000000000 0.50000000000000 6.941 > 1 5 Li 0.84604683918532 0.00000000000000 0.25000000000000 6.941 > 2 6 Li 0.84604683918532 0.50000000000000 0.25000000000000 6.941 > 2 7 Li 0.84604683918532 0.00000000000000 0.75000000000000 6.941 > 2 8 Li 0.84604683918532 0.50000000000000 0.75000000000000 6.941 > 2 *9 Li 0.64692494318680 0.37908888632751 0.12500000000000 6.941 > 3 10 Li 0.64692494318680 0.87908888632751 0.12500000000000 6.941 > 3 11 Li 0.64692494318680 0.37908888632751 0.62500000000000 6.941 > 3 12 Li 0.64692494318680 0.87908888632751 0.62500000000000 6.941 > 3 13 Li 0.35307505681320 0.12091111367249 0.37500000000000 6.941 > 4 14 Li 0.35307505681320 0.62091111367249 0.37500000000000 6.941 > 4 15 Li 0.35307505681320 0.12091111367249 0.87500000000000 6.941 > 4 16 Li 0.35307505681320 0.62091111367249 0.87500000000000 6.941 > 4 17 Li 0.35307505681320 0.37908888632751 0.12500000000000 6.941 > 5 18 Li 0.35307505681320 0.87908888632751 0.12500000000000 6.941 > 5 19 Li 0.35307505681320 0.37908888632751 0.62500000000000 6.941 > 5 20 Li 0.35307505681320 0.87908888632751 0.62500000000000 6.941 > 5 21 Li 0.64692494318680 0.12091111367249 0.37500000000000 6.941 > 6 22 Li 0.64692494318680 0.62091111367249 0.37500000000000 6.941 > 6 23 Li 0.64692494318680 0.12091111367249 0.87500000000000 6.941 > 6 24 Li 0.64692494318680 0.62091111367249 0.87500000000000 6.941 > 6 25 Li 0.15395316081468 0.00000000000000 0.25000000000000 6.941 > 7 26 Li 0.15395316081468 0.50000000000000 0.25000000000000 6.941 > 7 27 Li 0.15395316081468 0.00000000000000 0.75000000000000 6.941 > 7 28 Li 0.15395316081468 0.50000000000000 0.75000000000000 6.941 > 7 29 Li 0.84604683918532 0.00000000000000 0.00000000000000 6.941 > 8 30 Li 0.84604683918532 0.50000000000000 0.00000000000000 6.941 > 8 31 Li 0.84604683918532 0.00000000000000 0.50000000000000 6.941 > 8 32 Li 0.84604683918532 0.50000000000000 0.50000000000000 6.941 > 8 33 Li 0.65395316081468 0.25000000000000 0.00000000000000 6.941 > 1 34 Li 0.65395316081468 0.75000000000000 0.00000000000000 6.941 > 1 35 Li 0.65395316081468 0.25000000000000 0.50000000000000 6.941 > 1 36 Li 0.65395316081468 0.75000000000000 0.50000000000000 6.941 > 1 37 Li 0.34604683918532 0.25000000000000 0.25000000000000 6.941 > 2 38 Li 0.34604683918532 0.75000000000000 0.25000000000000 6.941 > 2 39 Li 0.34604683918532 0.25000000000000 0.75000000000000 6.941 > 2 40 Li 0.34604683918532 0.75000000000000 0.75000000000000 6.941 > 2 41 Li 0.14692494318680 0.12908888632751 0.12500000000000 6.941 > 3 42 Li 0.14692494318680 0.62908888632751 0.12500000000000 6.941 > 3 43 Li 0.14692494318680 0.12908888632751 0.62500000000000 6.941 > 3 44 Li 0.14692494318680 0.62908888632751 0.62500000000000 6.941 > 3 45 Li 0.85307505681320 0.37091111367249 0.37500000000000 6.941 > 4 46 Li 0.85307505681320 0.87091111367249 0.37500000000000 6.941 > 4 47 Li 0.85307505681320 0.37091111367249 0.87500000000000 6.941 > 4 48 Li 0.85307505681320 0.87091111367249 0.87500000000000 6.941 > 4 49 Li 0.85307505681320 0.12908888632751 0.12500000000000 6.941 > 5 50 Li 0.85307505681320 0.62908888632751 0.12500000000000 6.941 > 5 51 Li 0.85307505681320 0.12908888632751 0.62500000000000 6.941 > 5 52 Li 0.85307505681320 0.62908888632751 0.62500000000000 6.941 > 5 53 Li 0.14692494318680 0.37091111367249 0.37500000000000 6.941 > 6 54 Li 0.14692494318680 0.87091111367249 0.37500000000000 6.941 > 6 55 Li 0.14692494318680 0.37091111367249 0.87500000000000 6.941 > 6 56 Li 0.14692494318680 0.87091111367249 0.87500000000000 6.941 > 6 57 Li 0.65395316081468 0.25000000000000 0.25000000000000 6.941 > 7 58 Li 0.65395316081468 0.75000000000000 0.25000000000000 6.941 > 7 59 Li 0.65395316081468 0.25000000000000 0.75000000000000 6.941 > 7 60 Li 0.65395316081468 0.75000000000000 0.75000000000000 6.941 > 7 61 Li 0.34604683918532 0.25000000000000 0.00000000000000 6.941 > 8 62 Li 0.34604683918532 0.75000000000000 0.00000000000000 6.941 > 8 63 Li 0.34604683918532 0.25000000000000 0.50000000000000 6.941 > 8 64 Li 0.34604683918532 0.75000000000000 0.50000000000000 6.941 > 8 *65 O 0.72519982164253 0.00816685789601 0.12500000000000 15.999 > 9 66 O 0.72519982164253 0.50816685789601 0.12500000000000 15.999 > 9 67 O 0.72519982164253 0.00816685789601 0.62500000000000 15.999 > 9 68 O 0.72519982164253 0.50816685789601 0.62500000000000 15.999 > 9 69 O 0.27480017835747 0.49183314210399 0.37500000000000 15.999 > 10 70 O 0.27480017835747 0.99183314210399 0.37500000000000 15.999 > 10 71 O 0.27480017835747 0.49183314210399 0.87500000000000 15.999 > 10 72 O 0.27480017835747 0.99183314210399 0.87500000000000 15.999 > 10 *73 O 0.50000000000000 0.35360654069929 0.23876879528223 15.999 > 11 74 O 0.50000000000000 0.85360654069929 0.23876879528223 15.999 > 11 75 O 0.50000000000000 0.35360654069929 0.73876879528223 15.999 > 11 76 O 0.50000000000000 0.85360654069929 0.73876879528223 15.999 > 11 77 O 0.50000000000000 0.14639345930071 0.48876879528223 15.999 > 12 78 O 0.50000000000000 0.64639345930071 0.48876879528223 15.999 > 12 79 O 0.50000000000000 0.14639345930071 0.98876879528223 15.999 > 12 80 O 0.50000000000000 0.64639345930071 0.98876879528223 15.999 > 12 81 O 0.50000000000000 0.35360654069929 0.01123120471777 15.999 > 13 82 O 0.50000000000000 0.85360654069929 0.01123120471777 15.999 > 13 83 O 0.50000000000000 0.35360654069929 0.51123120471777 15.999 > 13 84 O 0.50000000000000 0.85360654069929 0.51123120471777 15.999 > 13 85 O 0.50000000000000 0.14639345930071 0.26123120471777 15.999 > 14 86 O 0.50000000000000 0.64639345930071 0.26123120471777 15.999 > 14 87 O 0.50000000000000 0.14639345930071 0.76123120471777 15.999 > 14 88 O 0.50000000000000 0.64639345930071 0.76123120471777 15.999 > 14 89 O 0.27480017835747 0.00816685789601 0.12500000000000 15.999 > 15 90 O 0.27480017835747 0.50816685789601 0.12500000000000 15.999 > 15 91 O 0.27480017835747 0.00816685789601 0.62500000000000 15.999 > 15 92 O 0.27480017835747 0.50816685789601 0.62500000000000 15.999 > 15 93 O 0.72519982164253 0.49183314210399 0.37500000000000 15.999 > 16 94 O 0.72519982164253 0.99183314210399 0.37500000000000 15.999 > 16 95 O 0.72519982164253 0.49183314210399 0.87500000000000 15.999 > 16 96 O 0.72519982164253 0.99183314210399 0.87500000000000 15.999 > 16 97 O 0.22519982164253 0.25816685789601 0.12500000000000 15.999 > 9 98 O 0.22519982164253 0.75816685789601 0.12500000000000 15.999 > 9 99 O 0.22519982164253 0.25816685789601 0.62500000000000 15.999 > 9 100 O 0.22519982164253 0.75816685789601 0.62500000000000 15.999 > 9 101 O 0.77480017835747 0.24183314210400 0.37500000000000 15.999 > 10 102 O 0.77480017835747 0.74183314210399 0.37500000000000 15.999 > 10 103 O 0.77480017835747 0.24183314210400 0.87500000000000 15.999 > 10 104 O 0.77480017835747 0.74183314210399 0.87500000000000 15.999 > 10 105 O 0.00000000000000 0.10360654069929 0.23876879528223 15.999 > 11 106 O 0.00000000000000 0.60360654069929 0.23876879528223 15.999 > 11 107 O 0.00000000000000 0.10360654069929 0.73876879528223 15.999 > 11 108 O 0.00000000000000 0.60360654069929 0.73876879528223 15.999 > 11 109 O 0.00000000000000 0.39639345930071 0.48876879528223 15.999 > 12 110 O 0.00000000000000 0.89639345930071 0.48876879528223 15.999 > 12 111 O 0.00000000000000 0.39639345930071 0.98876879528223 15.999 > 12 112 O 0.00000000000000 0.89639345930071 0.98876879528223 15.999 > 12 113 O 0.00000000000000 0.10360654069929 0.01123120471777 15.999 > 13 114 O 0.00000000000000 0.60360654069929 0.01123120471777 15.999 > 13 115 O 0.00000000000000 0.10360654069929 0.51123120471777 15.999 > 13 116 O 0.00000000000000 0.60360654069929 0.51123120471777 15.999 > 13 117 O 0.00000000000000 0.39639345930071 0.26123120471777 15.999 > 14 118 O 0.00000000000000 0.89639345930071 0.26123120471777 15.999 > 14 119 O 0.00000000000000 0.39639345930071 0.76123120471777 15.999 > 14 120 O 0.00000000000000 0.89639345930071 0.76123120471777 15.999 > 14 121 O 0.77480017835747 0.25816685789601 0.12500000000000 15.999 > 15 122 O 0.77480017835747 0.75816685789601 0.12500000000000 15.999 > 15 123 O 0.77480017835747 0.25816685789601 0.62500000000000 15.999 > 15 124 O 0.77480017835747 0.75816685789601 0.62500000000000 15.999 > 15 125 O 0.22519982164253 0.24183314210400 0.37500000000000 15.999 > 16 126 O 0.22519982164253 0.74183314210399 0.37500000000000 15.999 > 16 127 O 0.22519982164253 0.24183314210400 0.87500000000000 15.999 > 16 128 O 0.22519982164253 0.74183314210399 0.87500000000000 15.999 > 16 *129 Pb 0.50000000000000 0.42861968651228 0.37500000000000 207.200 > 17 130 Pb 0.50000000000000 0.92861968651228 0.37500000000000 207.200 > 17 131 Pb 0.50000000000000 0.42861968651228 0.87500000000000 207.200 > 17 132 Pb 0.50000000000000 0.92861968651228 0.87500000000000 207.200 > 17 133 Pb 0.50000000000000 0.07138031348772 0.12500000000000 207.200 > 18 134 Pb 0.50000000000000 0.57138031348772 0.12500000000000 207.200 > 18 135 Pb 0.50000000000000 0.07138031348772 0.62500000000000 207.200 > 18 136 Pb 0.50000000000000 0.57138031348772 0.62500000000000 207.200 > 18 137 Pb 0.00000000000000 0.17861968651228 0.37500000000000 207.200 > 17 138 Pb 0.00000000000000 0.67861968651228 0.37500000000000 207.200 > 17 139 Pb 0.00000000000000 0.17861968651228 0.87500000000000 207.200 > 17 140 Pb 0.00000000000000 0.67861968651228 0.87500000000000 207.200 > 17 141 Pb 0.00000000000000 0.32138031348772 0.12500000000000 207.200 > 18 142 Pb 0.00000000000000 0.82138031348772 0.12500000000000 207.200 > 18 143 Pb 0.00000000000000 0.32138031348772 0.62500000000000 207.200 > 18 144 Pb 0.00000000000000 0.82138031348772 0.62500000000000 207.200 > 18 ---------------------------------------------------------------------------- NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". --------------------------- Dielectric constant ---------------------------- 4.1892043 0.0000000 0.0000000 0.0000000 3.9405095 0.0000000 0.0000000 0.0000000 4.2132616 -------------------------- Born effective charges -------------------------- 1 Li 1.1560654 0.0000000 0.0000000 0.0000000 1.0541346 0.3147626 0.0000000 -0.1876068 0.8985589 2 Li 1.1560654 0.0000000 0.0000000 0.0000000 1.0541346 -0.3147626 0.0000000 0.1876068 0.8985589 3 Li 0.9676743 -0.3324557 0.0000000 -0.0969539 0.9274191 0.0000000 0.0000000 0.0000000 1.1431877 4 Li 0.9676743 -0.3324557 0.0000000 -0.0969539 0.9274191 0.0000000 0.0000000 0.0000000 1.1431877 5 Li 0.9676743 0.3324557 0.0000000 0.0969539 0.9274191 0.0000000 0.0000000 0.0000000 1.1431877 6 Li 0.9676743 0.3324557 0.0000000 0.0969539 0.9274191 0.0000000 0.0000000 0.0000000 1.1431877 7 Li 1.1560654 0.0000000 0.0000000 0.0000000 1.0541346 -0.3147626 0.0000000 0.1876068 0.8985589 8 Li 1.1560654 0.0000000 0.0000000 0.0000000 1.0541346 0.3147626 0.0000000 -0.1876068 0.8985589 9 O -2.0760188 0.1970803 0.0000000 0.3623070 -1.6910711 0.0000000 0.0000000 0.0000000 -1.5220949 10 O -2.0760188 0.1970803 0.0000000 0.3623070 -1.6910711 0.0000000 0.0000000 0.0000000 -1.5220949 11 O -1.5918252 0.0000000 0.0000000 0.0000000 -1.8247722 -0.0975697 0.0000000 -0.3000995 -2.2108656 12 O -1.5918252 0.0000000 0.0000000 0.0000000 -1.8247722 0.0975697 0.0000000 0.3000995 -2.2108656 13 O -1.5918252 0.0000000 0.0000000 0.0000000 -1.8247722 0.0975697 0.0000000 0.3000995 -2.2108656 14 O -1.5918252 0.0000000 0.0000000 0.0000000 -1.8247722 -0.0975697 0.0000000 -0.3000995 -2.2108656 15 O -2.0760188 -0.1970803 0.0000000 -0.3623070 -1.6910711 0.0000000 0.0000000 0.0000000 -1.5220949 16 O -2.0760188 -0.1970803 0.0000000 -0.3623070 -1.6910711 0.0000000 0.0000000 0.0000000 -1.5220949 17 Pb 3.0882086 0.0000000 0.0000000 0.0000000 3.0685793 0.0000000 0.0000000 0.0000000 3.3824277 18 Pb 3.0882086 0.0000000 0.0000000 0.0000000 3.0685793 0.0000000 0.0000000 0.0000000 3.3824277 ---------------------------------------------------------------------------- Displacement-force dataset was read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". -------------------------------- Symfc start ------------------------------- Symfc version 1.5.4 (https://github.com/symfc/symfc) Citation: A. Seko and A. Togo, Phys. Rev. B, 110, 214302 (2024) Computing [2] order force constants. Permutation basis: 432/432 Permutation basis: 14256/14256 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 1612 Number of blocks in projector: 1612 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: 332 Use standard eigh solver. --- Eigsh_solver_block: 2 / 6 --- Block_size: 312 Use standard eigh solver. --- Eigsh_solver_block: 3 / 6 --- Block_size: 244 Use standard eigh solver. --- Eigsh_solver_block: 4 / 6 --- Block_size: 244 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 244 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 236 Use standard eigh solver. Tree of FC basis block matrices: - (1612, 1589), data: False |-- (236, 236), data: True |-- (244, 239), data: True |-- (244, 239), data: True |-- (244, 239), data: True |-- (312, 308), data: True |-- (332, 328), data: True ----- Solver_atoms: 1 -- 144 / 144 Time (Solver_compr_matrix_reshape): 0.009 Solver_block: 100 / 320 - Time: 2.895 Solver_block: 200 / 320 - Time: 2.938 Solver_block: 300 / 320 - Time: 2.944 Solver_block: 320 / 320 - Time: 0.684 Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 9.505 --------------------------------- Symfc end -------------------------------- Max drift of force constants: 0.00000000 (xx) 0.00000000 (xx) Permutation basis: 432/432 Permutation basis: 14256/14256 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 1612 Number of blocks in projector: 1612 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: 332 Use standard eigh solver. --- Eigsh_solver_block: 2 / 6 --- Block_size: 312 Use standard eigh solver. --- Eigsh_solver_block: 3 / 6 --- Block_size: 244 Use standard eigh solver. --- Eigsh_solver_block: 4 / 6 --- Block_size: 244 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 244 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 236 Use standard eigh solver. Tree of FC basis block matrices: - (1612, 1589), data: False |-- (236, 236), data: True |-- (244, 239), data: True |-- (244, 239), data: True |-- (244, 239), data: True |-- (312, 308), data: True |-- (332, 328), data: True Max drift after symmetrization by symfc projector: -0.00000000 (xx) -0.00000000 (xx) Force constants are written into "force_constants.hdf5". ---------------------------------------------------------------------------- One of the following run modes may be specified for phonon calculations. - Mesh sampling (MESH, --mesh) - Q-points (QPOINTS, --qpoints) - Band structure (BAND, --band) - Animation (ANIME, --anime) - Modulation (MODULATION, --modulation) - Characters of Irreps (IRREPS, --irreps) - Create displacements (CREATE_DISPLACEMENTS, -d) ---------------------------------------------------------------------------- Summary of calculation was written in "phonopy.yaml". -------------------------[time 2026-01-08 05:04:46]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate fc3 ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 05:04:47]------------------------- Compiled with OpenMP support (max 128 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: force constants HDF5 data compression filter: gzip Crystal structure was read from "phono3py_mlp_eval_fc3_disp.yaml.xz". Supercell (dim): [1 2 2] Primitive matrix: [0.5 0.5 0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: Cmcm (63) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 4.168105475000000 -3.586545125000000 0.000000000000000 b 4.168105475000000 3.586545125000000 0.000000000000000 c 0.000000000000000 0.000000000000000 6.538658250000002 Atomic positions (fractional): 1 Li 0.15395316081468 0.15395316081468 0.00000000000000 6.941 2 Li 0.84604683918532 0.84604683918532 0.50000000000000 6.941 3 Li 0.88874717053179 0.40510271584182 0.25000000000000 6.941 4 Li 0.11125282946822 0.59489728415818 0.75000000000000 6.941 5 Li 0.59489728415818 0.11125282946821 0.25000000000000 6.941 6 Li 0.40510271584182 0.88874717053179 0.75000000000000 6.941 7 Li 0.15395316081468 0.15395316081468 0.50000000000000 6.941 8 Li 0.84604683918532 0.84604683918532 0.00000000000000 6.941 9 O 0.70886610585052 0.74153353743454 0.25000000000000 15.999 10 O 0.29113389414948 0.25846646256546 0.75000000000000 15.999 11 O 0.79278691860142 0.20721308139858 0.47753759056446 15.999 12 O 0.20721308139858 0.79278691860142 0.97753759056446 15.999 13 O 0.79278691860142 0.20721308139858 0.02246240943554 15.999 14 O 0.20721308139858 0.79278691860142 0.52246240943554 15.999 15 O 0.25846646256546 0.29113389414948 0.25000000000000 15.999 16 O 0.74153353743454 0.70886610585052 0.75000000000000 15.999 17 Pb 0.64276062697545 0.35723937302455 0.75000000000000 207.200 18 Pb 0.35723937302455 0.64276062697545 0.25000000000000 207.200 -------------------------------- supercell --------------------------------- Lattice vectors: a 8.336210950000000 0.000000000000000 0.000000000000000 b 0.000000000000000 14.346180499999999 0.000000000000000 c 0.000000000000000 0.000000000000000 13.077316500000004 Atomic positions (fractional): 1 Li 0.15395316081468 0.00000000000000 0.00000000000000 6.941 > 1 2 Li 0.15395316081468 0.50000000000000 0.00000000000000 6.941 > 1 3 Li 0.15395316081468 0.00000000000000 0.50000000000000 6.941 > 1 4 Li 0.15395316081468 0.50000000000000 0.50000000000000 6.941 > 1 5 Li 0.84604683918532 0.00000000000000 0.25000000000000 6.941 > 5 6 Li 0.84604683918532 0.50000000000000 0.25000000000000 6.941 > 5 7 Li 0.84604683918532 0.00000000000000 0.75000000000000 6.941 > 5 8 Li 0.84604683918532 0.50000000000000 0.75000000000000 6.941 > 5 9 Li 0.64692494318680 0.37908888632751 0.12500000000000 6.941 > 9 10 Li 0.64692494318680 0.87908888632751 0.12500000000000 6.941 > 9 11 Li 0.64692494318680 0.37908888632751 0.62500000000000 6.941 > 9 12 Li 0.64692494318680 0.87908888632751 0.62500000000000 6.941 > 9 13 Li 0.35307505681320 0.12091111367249 0.37500000000000 6.941 > 13 14 Li 0.35307505681320 0.62091111367249 0.37500000000000 6.941 > 13 15 Li 0.35307505681320 0.12091111367249 0.87500000000000 6.941 > 13 16 Li 0.35307505681320 0.62091111367249 0.87500000000000 6.941 > 13 17 Li 0.35307505681320 0.37908888632751 0.12500000000000 6.941 > 17 18 Li 0.35307505681320 0.87908888632751 0.12500000000000 6.941 > 17 19 Li 0.35307505681320 0.37908888632751 0.62500000000000 6.941 > 17 20 Li 0.35307505681320 0.87908888632751 0.62500000000000 6.941 > 17 21 Li 0.64692494318680 0.12091111367249 0.37500000000000 6.941 > 21 22 Li 0.64692494318680 0.62091111367249 0.37500000000000 6.941 > 21 23 Li 0.64692494318680 0.12091111367249 0.87500000000000 6.941 > 21 24 Li 0.64692494318680 0.62091111367249 0.87500000000000 6.941 > 21 25 Li 0.15395316081468 0.00000000000000 0.25000000000000 6.941 > 25 26 Li 0.15395316081468 0.50000000000000 0.25000000000000 6.941 > 25 27 Li 0.15395316081468 0.00000000000000 0.75000000000000 6.941 > 25 28 Li 0.15395316081468 0.50000000000000 0.75000000000000 6.941 > 25 29 Li 0.84604683918532 0.00000000000000 0.00000000000000 6.941 > 29 30 Li 0.84604683918532 0.50000000000000 0.00000000000000 6.941 > 29 31 Li 0.84604683918532 0.00000000000000 0.50000000000000 6.941 > 29 32 Li 0.84604683918532 0.50000000000000 0.50000000000000 6.941 > 29 33 Li 0.65395316081468 0.25000000000000 0.00000000000000 6.941 > 1 34 Li 0.65395316081468 0.75000000000000 0.00000000000000 6.941 > 1 35 Li 0.65395316081468 0.25000000000000 0.50000000000000 6.941 > 1 36 Li 0.65395316081468 0.75000000000000 0.50000000000000 6.941 > 1 37 Li 0.34604683918532 0.25000000000000 0.25000000000000 6.941 > 5 38 Li 0.34604683918532 0.75000000000000 0.25000000000000 6.941 > 5 39 Li 0.34604683918532 0.25000000000000 0.75000000000000 6.941 > 5 40 Li 0.34604683918532 0.75000000000000 0.75000000000000 6.941 > 5 41 Li 0.14692494318680 0.12908888632751 0.12500000000000 6.941 > 9 42 Li 0.14692494318680 0.62908888632751 0.12500000000000 6.941 > 9 43 Li 0.14692494318680 0.12908888632751 0.62500000000000 6.941 > 9 44 Li 0.14692494318680 0.62908888632751 0.62500000000000 6.941 > 9 45 Li 0.85307505681320 0.37091111367249 0.37500000000000 6.941 > 13 46 Li 0.85307505681320 0.87091111367249 0.37500000000000 6.941 > 13 47 Li 0.85307505681320 0.37091111367249 0.87500000000000 6.941 > 13 48 Li 0.85307505681320 0.87091111367249 0.87500000000000 6.941 > 13 49 Li 0.85307505681320 0.12908888632751 0.12500000000000 6.941 > 17 50 Li 0.85307505681320 0.62908888632751 0.12500000000000 6.941 > 17 51 Li 0.85307505681320 0.12908888632751 0.62500000000000 6.941 > 17 52 Li 0.85307505681320 0.62908888632751 0.62500000000000 6.941 > 17 53 Li 0.14692494318680 0.37091111367249 0.37500000000000 6.941 > 21 54 Li 0.14692494318680 0.87091111367249 0.37500000000000 6.941 > 21 55 Li 0.14692494318680 0.37091111367249 0.87500000000000 6.941 > 21 56 Li 0.14692494318680 0.87091111367249 0.87500000000000 6.941 > 21 57 Li 0.65395316081468 0.25000000000000 0.25000000000000 6.941 > 25 58 Li 0.65395316081468 0.75000000000000 0.25000000000000 6.941 > 25 59 Li 0.65395316081468 0.25000000000000 0.75000000000000 6.941 > 25 60 Li 0.65395316081468 0.75000000000000 0.75000000000000 6.941 > 25 61 Li 0.34604683918532 0.25000000000000 0.00000000000000 6.941 > 29 62 Li 0.34604683918532 0.75000000000000 0.00000000000000 6.941 > 29 63 Li 0.34604683918532 0.25000000000000 0.50000000000000 6.941 > 29 64 Li 0.34604683918532 0.75000000000000 0.50000000000000 6.941 > 29 65 O 0.72519982164253 0.00816685789601 0.12500000000000 15.999 > 65 66 O 0.72519982164253 0.50816685789601 0.12500000000000 15.999 > 65 67 O 0.72519982164253 0.00816685789601 0.62500000000000 15.999 > 65 68 O 0.72519982164253 0.50816685789601 0.62500000000000 15.999 > 65 69 O 0.27480017835747 0.49183314210399 0.37500000000000 15.999 > 69 70 O 0.27480017835747 0.99183314210399 0.37500000000000 15.999 > 69 71 O 0.27480017835747 0.49183314210399 0.87500000000000 15.999 > 69 72 O 0.27480017835747 0.99183314210399 0.87500000000000 15.999 > 69 73 O 0.50000000000000 0.35360654069929 0.23876879528223 15.999 > 73 74 O 0.50000000000000 0.85360654069929 0.23876879528223 15.999 > 73 75 O 0.50000000000000 0.35360654069929 0.73876879528223 15.999 > 73 76 O 0.50000000000000 0.85360654069929 0.73876879528223 15.999 > 73 77 O 0.50000000000000 0.14639345930071 0.48876879528223 15.999 > 77 78 O 0.50000000000000 0.64639345930071 0.48876879528223 15.999 > 77 79 O 0.50000000000000 0.14639345930071 0.98876879528223 15.999 > 77 80 O 0.50000000000000 0.64639345930071 0.98876879528223 15.999 > 77 81 O 0.50000000000000 0.35360654069929 0.01123120471777 15.999 > 81 82 O 0.50000000000000 0.85360654069929 0.01123120471777 15.999 > 81 83 O 0.50000000000000 0.35360654069929 0.51123120471777 15.999 > 81 84 O 0.50000000000000 0.85360654069929 0.51123120471777 15.999 > 81 85 O 0.50000000000000 0.14639345930071 0.26123120471777 15.999 > 85 86 O 0.50000000000000 0.64639345930071 0.26123120471777 15.999 > 85 87 O 0.50000000000000 0.14639345930071 0.76123120471777 15.999 > 85 88 O 0.50000000000000 0.64639345930071 0.76123120471777 15.999 > 85 89 O 0.27480017835747 0.00816685789601 0.12500000000000 15.999 > 89 90 O 0.27480017835747 0.50816685789601 0.12500000000000 15.999 > 89 91 O 0.27480017835747 0.00816685789601 0.62500000000000 15.999 > 89 92 O 0.27480017835747 0.50816685789601 0.62500000000000 15.999 > 89 93 O 0.72519982164253 0.49183314210399 0.37500000000000 15.999 > 93 94 O 0.72519982164253 0.99183314210399 0.37500000000000 15.999 > 93 95 O 0.72519982164253 0.49183314210399 0.87500000000000 15.999 > 93 96 O 0.72519982164253 0.99183314210399 0.87500000000000 15.999 > 93 97 O 0.22519982164253 0.25816685789601 0.12500000000000 15.999 > 65 98 O 0.22519982164253 0.75816685789601 0.12500000000000 15.999 > 65 99 O 0.22519982164253 0.25816685789601 0.62500000000000 15.999 > 65 100 O 0.22519982164253 0.75816685789601 0.62500000000000 15.999 > 65 101 O 0.77480017835747 0.24183314210400 0.37500000000000 15.999 > 69 102 O 0.77480017835747 0.74183314210399 0.37500000000000 15.999 > 69 103 O 0.77480017835747 0.24183314210400 0.87500000000000 15.999 > 69 104 O 0.77480017835747 0.74183314210399 0.87500000000000 15.999 > 69 105 O 0.00000000000000 0.10360654069929 0.23876879528223 15.999 > 73 106 O 0.00000000000000 0.60360654069929 0.23876879528223 15.999 > 73 107 O 0.00000000000000 0.10360654069929 0.73876879528223 15.999 > 73 108 O 0.00000000000000 0.60360654069929 0.73876879528223 15.999 > 73 109 O 0.00000000000000 0.39639345930071 0.48876879528223 15.999 > 77 110 O 0.00000000000000 0.89639345930071 0.48876879528223 15.999 > 77 111 O 0.00000000000000 0.39639345930071 0.98876879528223 15.999 > 77 112 O 0.00000000000000 0.89639345930071 0.98876879528223 15.999 > 77 113 O 0.00000000000000 0.10360654069929 0.01123120471777 15.999 > 81 114 O 0.00000000000000 0.60360654069929 0.01123120471777 15.999 > 81 115 O 0.00000000000000 0.10360654069929 0.51123120471777 15.999 > 81 116 O 0.00000000000000 0.60360654069929 0.51123120471777 15.999 > 81 117 O 0.00000000000000 0.39639345930071 0.26123120471777 15.999 > 85 118 O 0.00000000000000 0.89639345930071 0.26123120471777 15.999 > 85 119 O 0.00000000000000 0.39639345930071 0.76123120471777 15.999 > 85 120 O 0.00000000000000 0.89639345930071 0.76123120471777 15.999 > 85 121 O 0.77480017835747 0.25816685789601 0.12500000000000 15.999 > 89 122 O 0.77480017835747 0.75816685789601 0.12500000000000 15.999 > 89 123 O 0.77480017835747 0.25816685789601 0.62500000000000 15.999 > 89 124 O 0.77480017835747 0.75816685789601 0.62500000000000 15.999 > 89 125 O 0.22519982164253 0.24183314210400 0.37500000000000 15.999 > 93 126 O 0.22519982164253 0.74183314210399 0.37500000000000 15.999 > 93 127 O 0.22519982164253 0.24183314210400 0.87500000000000 15.999 > 93 128 O 0.22519982164253 0.74183314210399 0.87500000000000 15.999 > 93 129 Pb 0.50000000000000 0.42861968651228 0.37500000000000 207.200 > 129 130 Pb 0.50000000000000 0.92861968651228 0.37500000000000 207.200 > 129 131 Pb 0.50000000000000 0.42861968651228 0.87500000000000 207.200 > 129 132 Pb 0.50000000000000 0.92861968651228 0.87500000000000 207.200 > 129 133 Pb 0.50000000000000 0.07138031348772 0.12500000000000 207.200 > 133 134 Pb 0.50000000000000 0.57138031348772 0.12500000000000 207.200 > 133 135 Pb 0.50000000000000 0.07138031348772 0.62500000000000 207.200 > 133 136 Pb 0.50000000000000 0.57138031348772 0.62500000000000 207.200 > 133 137 Pb 0.00000000000000 0.17861968651228 0.37500000000000 207.200 > 129 138 Pb 0.00000000000000 0.67861968651228 0.37500000000000 207.200 > 129 139 Pb 0.00000000000000 0.17861968651228 0.87500000000000 207.200 > 129 140 Pb 0.00000000000000 0.67861968651228 0.87500000000000 207.200 > 129 141 Pb 0.00000000000000 0.32138031348772 0.12500000000000 207.200 > 133 142 Pb 0.00000000000000 0.82138031348772 0.12500000000000 207.200 > 133 143 Pb 0.00000000000000 0.32138031348772 0.62500000000000 207.200 > 133 144 Pb 0.00000000000000 0.82138031348772 0.62500000000000 207.200 > 133 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz". --------------------------- Dielectric constant ---------------------------- 4.1892043 0.0000000 0.0000000 0.0000000 3.9405095 0.0000000 0.0000000 0.0000000 4.2132616 -------------------------- Born effective charges -------------------------- 1 Li 1.1560654 0.0000000 0.0000000 0.0000000 1.0541346 0.3147626 0.0000000 -0.1876068 0.8985589 2 Li 1.1560654 0.0000000 0.0000000 0.0000000 1.0541346 -0.3147626 0.0000000 0.1876068 0.8985589 3 Li 0.9676743 -0.3324557 0.0000000 -0.0969539 0.9274191 0.0000000 0.0000000 0.0000000 1.1431877 4 Li 0.9676743 -0.3324557 0.0000000 -0.0969539 0.9274191 0.0000000 0.0000000 0.0000000 1.1431877 5 Li 0.9676743 0.3324557 0.0000000 0.0969539 0.9274191 0.0000000 0.0000000 0.0000000 1.1431877 6 Li 0.9676743 0.3324557 0.0000000 0.0969539 0.9274191 0.0000000 0.0000000 0.0000000 1.1431877 7 Li 1.1560654 0.0000000 0.0000000 0.0000000 1.0541346 -0.3147626 0.0000000 0.1876068 0.8985589 8 Li 1.1560654 0.0000000 0.0000000 0.0000000 1.0541346 0.3147626 0.0000000 -0.1876068 0.8985589 9 O -2.0760188 0.1970803 0.0000000 0.3623070 -1.6910711 0.0000000 0.0000000 0.0000000 -1.5220949 10 O -2.0760188 0.1970803 0.0000000 0.3623070 -1.6910711 0.0000000 0.0000000 0.0000000 -1.5220949 11 O -1.5918252 0.0000000 0.0000000 0.0000000 -1.8247722 -0.0975697 0.0000000 -0.3000995 -2.2108656 12 O -1.5918252 0.0000000 0.0000000 0.0000000 -1.8247722 0.0975697 0.0000000 0.3000995 -2.2108656 13 O -1.5918252 0.0000000 0.0000000 0.0000000 -1.8247722 0.0975697 0.0000000 0.3000995 -2.2108656 14 O -1.5918252 0.0000000 0.0000000 0.0000000 -1.8247722 -0.0975697 0.0000000 -0.3000995 -2.2108656 15 O -2.0760188 -0.1970803 0.0000000 -0.3623070 -1.6910711 0.0000000 0.0000000 0.0000000 -1.5220949 16 O -2.0760188 -0.1970803 0.0000000 -0.3623070 -1.6910711 0.0000000 0.0000000 0.0000000 -1.5220949 17 Pb 3.0882086 0.0000000 0.0000000 0.0000000 3.0685793 0.0000000 0.0000000 0.0000000 3.3824277 18 Pb 3.0882086 0.0000000 0.0000000 0.0000000 3.0685793 0.0000000 0.0000000 0.0000000 3.3824277 ---------------------------------------------------------------------------- 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[ 9, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100] Computing fc3[ 65, 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[ 73, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [ 0.0000 0.0000 0.0100] [ 0.0000 0.0000 -0.0100] Computing fc3[ 129, 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: 0.00000001 (yyz) 0.00000001 (yyz) 0.00000001 (yzy) fc3 was written into "fc3.hdf5". Max drift of fc2: -0.00000000 (yz) -0.00000000 (yz) fc2 was written into "fc2.hdf5". --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperatures: 0.0 300.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 ----------- None of ph-ph interaction calculation was performed. ----------- Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-08 05:05:12]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate LTC ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 05:05:12]------------------------- Compiled with OpenMP support (max 128 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: conductivity-RTA HDF5 data compression filter: gzip Crystal structure was read from "phono3py.yaml". Supercell (dim): [1 2 2] Primitive matrix: [0.5 0.5 0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: Cmcm (63) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 4.168105475000000 -3.586545125000000 0.000000000000000 b 4.168105475000000 3.586545125000000 0.000000000000000 c 0.000000000000000 0.000000000000000 6.538658250000002 Atomic positions (fractional): 1 Li 0.15395316081468 0.15395316081468 0.00000000000000 6.941 2 Li 0.84604683918532 0.84604683918532 0.50000000000000 6.941 3 Li 0.88874717053179 0.40510271584182 0.25000000000000 6.941 4 Li 0.11125282946822 0.59489728415818 0.75000000000000 6.941 5 Li 0.59489728415818 0.11125282946821 0.25000000000000 6.941 6 Li 0.40510271584182 0.88874717053179 0.75000000000000 6.941 7 Li 0.15395316081468 0.15395316081468 0.50000000000000 6.941 8 Li 0.84604683918532 0.84604683918532 0.00000000000000 6.941 9 O 0.70886610585052 0.74153353743454 0.25000000000000 15.999 10 O 0.29113389414948 0.25846646256546 0.75000000000000 15.999 11 O 0.79278691860142 0.20721308139858 0.47753759056446 15.999 12 O 0.20721308139858 0.79278691860142 0.97753759056446 15.999 13 O 0.79278691860142 0.20721308139858 0.02246240943554 15.999 14 O 0.20721308139858 0.79278691860142 0.52246240943554 15.999 15 O 0.25846646256546 0.29113389414948 0.25000000000000 15.999 16 O 0.74153353743454 0.70886610585052 0.75000000000000 15.999 17 Pb 0.64276062697545 0.35723937302455 0.75000000000000 207.200 18 Pb 0.35723937302455 0.64276062697545 0.25000000000000 207.200 -------------------------------- supercell --------------------------------- Lattice vectors: a 8.336210950000000 0.000000000000000 0.000000000000000 b 0.000000000000000 14.346180499999999 0.000000000000000 c 0.000000000000000 0.000000000000000 13.077316500000004 Atomic positions (fractional): 1 Li 0.15395316081468 0.00000000000000 0.00000000000000 6.941 > 1 2 Li 0.15395316081468 0.50000000000000 0.00000000000000 6.941 > 1 3 Li 0.15395316081468 0.00000000000000 0.50000000000000 6.941 > 1 4 Li 0.15395316081468 0.50000000000000 0.50000000000000 6.941 > 1 5 Li 0.84604683918532 0.00000000000000 0.25000000000000 6.941 > 5 6 Li 0.84604683918532 0.50000000000000 0.25000000000000 6.941 > 5 7 Li 0.84604683918532 0.00000000000000 0.75000000000000 6.941 > 5 8 Li 0.84604683918532 0.50000000000000 0.75000000000000 6.941 > 5 9 Li 0.64692494318680 0.37908888632751 0.12500000000000 6.941 > 9 10 Li 0.64692494318680 0.87908888632751 0.12500000000000 6.941 > 9 11 Li 0.64692494318680 0.37908888632751 0.62500000000000 6.941 > 9 12 Li 0.64692494318680 0.87908888632751 0.62500000000000 6.941 > 9 13 Li 0.35307505681320 0.12091111367249 0.37500000000000 6.941 > 13 14 Li 0.35307505681320 0.62091111367249 0.37500000000000 6.941 > 13 15 Li 0.35307505681320 0.12091111367249 0.87500000000000 6.941 > 13 16 Li 0.35307505681320 0.62091111367249 0.87500000000000 6.941 > 13 17 Li 0.35307505681320 0.37908888632751 0.12500000000000 6.941 > 17 18 Li 0.35307505681320 0.87908888632751 0.12500000000000 6.941 > 17 19 Li 0.35307505681320 0.37908888632751 0.62500000000000 6.941 > 17 20 Li 0.35307505681320 0.87908888632751 0.62500000000000 6.941 > 17 21 Li 0.64692494318680 0.12091111367249 0.37500000000000 6.941 > 21 22 Li 0.64692494318680 0.62091111367249 0.37500000000000 6.941 > 21 23 Li 0.64692494318680 0.12091111367249 0.87500000000000 6.941 > 21 24 Li 0.64692494318680 0.62091111367249 0.87500000000000 6.941 > 21 25 Li 0.15395316081468 0.00000000000000 0.25000000000000 6.941 > 25 26 Li 0.15395316081468 0.50000000000000 0.25000000000000 6.941 > 25 27 Li 0.15395316081468 0.00000000000000 0.75000000000000 6.941 > 25 28 Li 0.15395316081468 0.50000000000000 0.75000000000000 6.941 > 25 29 Li 0.84604683918532 0.00000000000000 0.00000000000000 6.941 > 29 30 Li 0.84604683918532 0.50000000000000 0.00000000000000 6.941 > 29 31 Li 0.84604683918532 0.00000000000000 0.50000000000000 6.941 > 29 32 Li 0.84604683918532 0.50000000000000 0.50000000000000 6.941 > 29 33 Li 0.65395316081468 0.25000000000000 0.00000000000000 6.941 > 1 34 Li 0.65395316081468 0.75000000000000 0.00000000000000 6.941 > 1 35 Li 0.65395316081468 0.25000000000000 0.50000000000000 6.941 > 1 36 Li 0.65395316081468 0.75000000000000 0.50000000000000 6.941 > 1 37 Li 0.34604683918532 0.25000000000000 0.25000000000000 6.941 > 5 38 Li 0.34604683918532 0.75000000000000 0.25000000000000 6.941 > 5 39 Li 0.34604683918532 0.25000000000000 0.75000000000000 6.941 > 5 40 Li 0.34604683918532 0.75000000000000 0.75000000000000 6.941 > 5 41 Li 0.14692494318680 0.12908888632751 0.12500000000000 6.941 > 9 42 Li 0.14692494318680 0.62908888632751 0.12500000000000 6.941 > 9 43 Li 0.14692494318680 0.12908888632751 0.62500000000000 6.941 > 9 44 Li 0.14692494318680 0.62908888632751 0.62500000000000 6.941 > 9 45 Li 0.85307505681320 0.37091111367249 0.37500000000000 6.941 > 13 46 Li 0.85307505681320 0.87091111367249 0.37500000000000 6.941 > 13 47 Li 0.85307505681320 0.37091111367249 0.87500000000000 6.941 > 13 48 Li 0.85307505681320 0.87091111367249 0.87500000000000 6.941 > 13 49 Li 0.85307505681320 0.12908888632751 0.12500000000000 6.941 > 17 50 Li 0.85307505681320 0.62908888632751 0.12500000000000 6.941 > 17 51 Li 0.85307505681320 0.12908888632751 0.62500000000000 6.941 > 17 52 Li 0.85307505681320 0.62908888632751 0.62500000000000 6.941 > 17 53 Li 0.14692494318680 0.37091111367249 0.37500000000000 6.941 > 21 54 Li 0.14692494318680 0.87091111367249 0.37500000000000 6.941 > 21 55 Li 0.14692494318680 0.37091111367249 0.87500000000000 6.941 > 21 56 Li 0.14692494318680 0.87091111367249 0.87500000000000 6.941 > 21 57 Li 0.65395316081468 0.25000000000000 0.25000000000000 6.941 > 25 58 Li 0.65395316081468 0.75000000000000 0.25000000000000 6.941 > 25 59 Li 0.65395316081468 0.25000000000000 0.75000000000000 6.941 > 25 60 Li 0.65395316081468 0.75000000000000 0.75000000000000 6.941 > 25 61 Li 0.34604683918532 0.25000000000000 0.00000000000000 6.941 > 29 62 Li 0.34604683918532 0.75000000000000 0.00000000000000 6.941 > 29 63 Li 0.34604683918532 0.25000000000000 0.50000000000000 6.941 > 29 64 Li 0.34604683918532 0.75000000000000 0.50000000000000 6.941 > 29 65 O 0.72519982164253 0.00816685789601 0.12500000000000 15.999 > 65 66 O 0.72519982164253 0.50816685789601 0.12500000000000 15.999 > 65 67 O 0.72519982164253 0.00816685789601 0.62500000000000 15.999 > 65 68 O 0.72519982164253 0.50816685789601 0.62500000000000 15.999 > 65 69 O 0.27480017835747 0.49183314210399 0.37500000000000 15.999 > 69 70 O 0.27480017835747 0.99183314210399 0.37500000000000 15.999 > 69 71 O 0.27480017835747 0.49183314210399 0.87500000000000 15.999 > 69 72 O 0.27480017835747 0.99183314210399 0.87500000000000 15.999 > 69 73 O 0.50000000000000 0.35360654069929 0.23876879528223 15.999 > 73 74 O 0.50000000000000 0.85360654069929 0.23876879528223 15.999 > 73 75 O 0.50000000000000 0.35360654069929 0.73876879528223 15.999 > 73 76 O 0.50000000000000 0.85360654069929 0.73876879528223 15.999 > 73 77 O 0.50000000000000 0.14639345930071 0.48876879528223 15.999 > 77 78 O 0.50000000000000 0.64639345930071 0.48876879528223 15.999 > 77 79 O 0.50000000000000 0.14639345930071 0.98876879528223 15.999 > 77 80 O 0.50000000000000 0.64639345930071 0.98876879528223 15.999 > 77 81 O 0.50000000000000 0.35360654069929 0.01123120471777 15.999 > 81 82 O 0.50000000000000 0.85360654069929 0.01123120471777 15.999 > 81 83 O 0.50000000000000 0.35360654069929 0.51123120471777 15.999 > 81 84 O 0.50000000000000 0.85360654069929 0.51123120471777 15.999 > 81 85 O 0.50000000000000 0.14639345930071 0.26123120471777 15.999 > 85 86 O 0.50000000000000 0.64639345930071 0.26123120471777 15.999 > 85 87 O 0.50000000000000 0.14639345930071 0.76123120471777 15.999 > 85 88 O 0.50000000000000 0.64639345930071 0.76123120471777 15.999 > 85 89 O 0.27480017835747 0.00816685789601 0.12500000000000 15.999 > 89 90 O 0.27480017835747 0.50816685789601 0.12500000000000 15.999 > 89 91 O 0.27480017835747 0.00816685789601 0.62500000000000 15.999 > 89 92 O 0.27480017835747 0.50816685789601 0.62500000000000 15.999 > 89 93 O 0.72519982164253 0.49183314210399 0.37500000000000 15.999 > 93 94 O 0.72519982164253 0.99183314210399 0.37500000000000 15.999 > 93 95 O 0.72519982164253 0.49183314210399 0.87500000000000 15.999 > 93 96 O 0.72519982164253 0.99183314210399 0.87500000000000 15.999 > 93 97 O 0.22519982164253 0.25816685789601 0.12500000000000 15.999 > 65 98 O 0.22519982164253 0.75816685789601 0.12500000000000 15.999 > 65 99 O 0.22519982164253 0.25816685789601 0.62500000000000 15.999 > 65 100 O 0.22519982164253 0.75816685789601 0.62500000000000 15.999 > 65 101 O 0.77480017835747 0.24183314210400 0.37500000000000 15.999 > 69 102 O 0.77480017835747 0.74183314210399 0.37500000000000 15.999 > 69 103 O 0.77480017835747 0.24183314210400 0.87500000000000 15.999 > 69 104 O 0.77480017835747 0.74183314210399 0.87500000000000 15.999 > 69 105 O 0.00000000000000 0.10360654069929 0.23876879528223 15.999 > 73 106 O 0.00000000000000 0.60360654069929 0.23876879528223 15.999 > 73 107 O 0.00000000000000 0.10360654069929 0.73876879528223 15.999 > 73 108 O 0.00000000000000 0.60360654069929 0.73876879528223 15.999 > 73 109 O 0.00000000000000 0.39639345930071 0.48876879528223 15.999 > 77 110 O 0.00000000000000 0.89639345930071 0.48876879528223 15.999 > 77 111 O 0.00000000000000 0.39639345930071 0.98876879528223 15.999 > 77 112 O 0.00000000000000 0.89639345930071 0.98876879528223 15.999 > 77 113 O 0.00000000000000 0.10360654069929 0.01123120471777 15.999 > 81 114 O 0.00000000000000 0.60360654069929 0.01123120471777 15.999 > 81 115 O 0.00000000000000 0.10360654069929 0.51123120471777 15.999 > 81 116 O 0.00000000000000 0.60360654069929 0.51123120471777 15.999 > 81 117 O 0.00000000000000 0.39639345930071 0.26123120471777 15.999 > 85 118 O 0.00000000000000 0.89639345930071 0.26123120471777 15.999 > 85 119 O 0.00000000000000 0.39639345930071 0.76123120471777 15.999 > 85 120 O 0.00000000000000 0.89639345930071 0.76123120471777 15.999 > 85 121 O 0.77480017835747 0.25816685789601 0.12500000000000 15.999 > 89 122 O 0.77480017835747 0.75816685789601 0.12500000000000 15.999 > 89 123 O 0.77480017835747 0.25816685789601 0.62500000000000 15.999 > 89 124 O 0.77480017835747 0.75816685789601 0.62500000000000 15.999 > 89 125 O 0.22519982164253 0.24183314210400 0.37500000000000 15.999 > 93 126 O 0.22519982164253 0.74183314210399 0.37500000000000 15.999 > 93 127 O 0.22519982164253 0.24183314210400 0.87500000000000 15.999 > 93 128 O 0.22519982164253 0.74183314210399 0.87500000000000 15.999 > 93 129 Pb 0.50000000000000 0.42861968651228 0.37500000000000 207.200 > 129 130 Pb 0.50000000000000 0.92861968651228 0.37500000000000 207.200 > 129 131 Pb 0.50000000000000 0.42861968651228 0.87500000000000 207.200 > 129 132 Pb 0.50000000000000 0.92861968651228 0.87500000000000 207.200 > 129 133 Pb 0.50000000000000 0.07138031348772 0.12500000000000 207.200 > 133 134 Pb 0.50000000000000 0.57138031348772 0.12500000000000 207.200 > 133 135 Pb 0.50000000000000 0.07138031348772 0.62500000000000 207.200 > 133 136 Pb 0.50000000000000 0.57138031348772 0.62500000000000 207.200 > 133 137 Pb 0.00000000000000 0.17861968651228 0.37500000000000 207.200 > 129 138 Pb 0.00000000000000 0.67861968651228 0.37500000000000 207.200 > 129 139 Pb 0.00000000000000 0.17861968651228 0.87500000000000 207.200 > 129 140 Pb 0.00000000000000 0.67861968651228 0.87500000000000 207.200 > 129 141 Pb 0.00000000000000 0.32138031348772 0.12500000000000 207.200 > 133 142 Pb 0.00000000000000 0.82138031348772 0.12500000000000 207.200 > 133 143 Pb 0.00000000000000 0.32138031348772 0.62500000000000 207.200 > 133 144 Pb 0.00000000000000 0.82138031348772 0.62500000000000 207.200 > 133 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py.yaml". --------------------------- Dielectric constant ---------------------------- 4.1892043 0.0000000 0.0000000 0.0000000 3.9405095 0.0000000 0.0000000 0.0000000 4.2132616 -------------------------- Born effective charges -------------------------- 1 Li 1.1560654 0.0000000 0.0000000 0.0000000 1.0541346 0.3147626 0.0000000 -0.1876068 0.8985589 2 Li 1.1560654 0.0000000 0.0000000 0.0000000 1.0541346 -0.3147626 0.0000000 0.1876068 0.8985589 3 Li 0.9676743 -0.3324557 0.0000000 -0.0969539 0.9274191 0.0000000 0.0000000 0.0000000 1.1431877 4 Li 0.9676743 -0.3324557 0.0000000 -0.0969539 0.9274191 0.0000000 0.0000000 0.0000000 1.1431877 5 Li 0.9676743 0.3324557 0.0000000 0.0969539 0.9274191 0.0000000 0.0000000 0.0000000 1.1431877 6 Li 0.9676743 0.3324557 0.0000000 0.0969539 0.9274191 0.0000000 0.0000000 0.0000000 1.1431877 7 Li 1.1560654 0.0000000 0.0000000 0.0000000 1.0541346 -0.3147626 0.0000000 0.1876068 0.8985589 8 Li 1.1560654 0.0000000 0.0000000 0.0000000 1.0541346 0.3147626 0.0000000 -0.1876068 0.8985589 9 O -2.0760188 0.1970803 0.0000000 0.3623070 -1.6910711 0.0000000 0.0000000 0.0000000 -1.5220949 10 O -2.0760188 0.1970803 0.0000000 0.3623070 -1.6910711 0.0000000 0.0000000 0.0000000 -1.5220949 11 O -1.5918252 0.0000000 0.0000000 0.0000000 -1.8247722 -0.0975697 0.0000000 -0.3000995 -2.2108656 12 O -1.5918252 0.0000000 0.0000000 0.0000000 -1.8247722 0.0975697 0.0000000 0.3000995 -2.2108656 13 O -1.5918252 0.0000000 0.0000000 0.0000000 -1.8247722 0.0975697 0.0000000 0.3000995 -2.2108656 14 O -1.5918252 0.0000000 0.0000000 0.0000000 -1.8247722 -0.0975697 0.0000000 -0.3000995 -2.2108656 15 O -2.0760188 -0.1970803 0.0000000 -0.3623070 -1.6910711 0.0000000 0.0000000 0.0000000 -1.5220949 16 O -2.0760188 -0.1970803 0.0000000 -0.3623070 -1.6910711 0.0000000 0.0000000 0.0000000 -1.5220949 17 Pb 3.0882086 0.0000000 0.0000000 0.0000000 3.0685793 0.0000000 0.0000000 0.0000000 3.3824277 18 Pb 3.0882086 0.0000000 0.0000000 0.0000000 3.0685793 0.0000000 0.0000000 0.0000000 3.3824277 ---------------------------------------------------------------------------- fc3 was read from "fc3.hdf5". fc2 was read from "fc2.hdf5". ----------------------------- Force constants ------------------------------ Max drift of fc3: 0.00000001 (yyz) 0.00000001 (yyz) 0.00000001 (yzy) Max drift of fc2: -0.00000000 (xx) -0.00000000 (xx) --------------------------- Calculation settings --------------------------- Non-analytical term correction (NAC): True NAC unit conversion factor: 14.39965 BZ integration: Tetrahedron-method Temperature: 0.0 10.0 20.0 30.0 40.0 ... 1000.0 Cutoff frequency: 0.01 Frequency conversion factor to THz: 15.63330 Length for sampling mesh generation: 50.00 Generating grid system ... [ 9 9 8 ] fc3-r2q-transformation over three atoms: True --------------------------- Phonon calculations ---------------------------- Use NAC by Gonze et al. (no real space sum in current implementation) PRB 50, 13035(R) (1994), PRB 55, 10355 (1997) G-cutoff distance: 0.72, Number of G-points: 281, Lambda: 0.15 Running harmonic phonon calculations... -------------------- Lattice thermal conductivity (RTA) -------------------- ======================= Grid point 0 (1/125) ======================= q-point: ( 0.00 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 125 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| -0.000 ( 0.000 0.000 0.000) 0.000 -0.000 ( 0.000 0.000 0.000) 0.000 0.000 ( 0.000 0.000 0.000) 0.000 2.277 ( 0.000 0.000 0.000) 0.000 2.457 ( 0.000 0.000 0.000) 0.000 2.973 ( 0.000 0.000 0.000) 0.000 4.539 ( 0.000 0.000 0.000) 0.000 4.886 ( 0.000 0.000 0.000) 0.000 5.114 ( 0.000 0.000 0.000) 0.000 6.039 ( 0.000 0.000 0.000) 0.000 6.800 ( 0.000 0.000 0.000) 0.000 6.907 ( 0.000 0.000 0.000) 0.000 7.336 ( 0.000 0.000 0.000) 0.000 7.762 ( 0.000 0.000 0.000) 0.000 8.178 ( 0.000 0.000 0.000) 0.000 9.293 ( 0.000 0.000 0.000) 0.000 9.645 ( 0.000 0.000 0.000) 0.000 9.818 ( 0.000 0.000 0.000) 0.000 10.234 ( 0.000 0.000 0.000) 0.000 10.246 ( 0.000 0.000 0.000) 0.000 10.325 ( 0.000 0.000 0.000) 0.000 10.551 ( 0.000 0.000 0.000) 0.000 10.632 ( 0.000 0.000 0.000) 0.000 11.311 ( 0.000 0.000 0.000) 0.000 11.761 ( 0.000 0.000 0.000) 0.000 11.817 ( 0.000 0.000 0.000) 0.000 12.050 ( 0.000 0.000 0.000) 0.000 12.400 ( 0.000 0.000 0.000) 0.000 13.111 ( 0.000 0.000 0.000) 0.000 13.229 ( 0.000 0.000 0.000) 0.000 13.299 ( 0.000 0.000 0.000) 0.000 13.493 ( 0.000 0.000 0.000) 0.000 13.653 ( 0.000 0.000 0.000) 0.000 13.680 ( 0.000 0.000 0.000) 0.000 13.752 ( 0.000 0.000 0.000) 0.000 14.223 ( 0.000 0.000 0.000) 0.000 14.318 ( 0.000 0.000 0.000) 0.000 14.376 ( 0.000 0.000 0.000) 0.000 14.510 ( 0.000 0.000 0.000) 0.000 15.008 ( 0.000 0.000 0.000) 0.000 15.149 ( 0.000 0.000 0.000) 0.000 15.273 ( 0.000 0.000 0.000) 0.000 15.870 ( 0.000 0.000 0.000) 0.000 16.021 ( 0.000 0.000 0.000) 0.000 16.090 ( 0.000 0.000 0.000) 0.000 16.096 ( 0.000 0.000 0.000) 0.000 16.117 ( 0.000 0.000 0.000) 0.000 16.218 ( 0.000 0.000 0.000) 0.000 16.419 ( 0.000 0.000 0.000) 0.000 16.652 ( 0.000 0.000 0.000) 0.000 16.918 ( 0.000 0.000 0.000) 0.000 17.078 ( 0.000 0.000 0.000) 0.000 17.517 ( 0.000 0.000 0.000) 0.000 18.830 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 1 (2/125) ======================= q-point: ( 0.11 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 205 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.531 ( 16.462 -19.138 0.000) 25.244 0.553 ( 17.167 -20.149 0.000) 26.471 0.950 ( 38.243 -25.510 0.000) 45.970 2.246 ( -0.968 3.082 0.000) 3.230 2.440 ( 0.599 2.721 0.000) 2.786 2.947 ( -4.115 -0.237 0.000) 4.122 4.652 ( 11.480 -3.751 0.000) 12.077 4.882 ( -2.322 -1.015 0.000) 2.534 5.493 ( -21.877 -17.179 0.000) 27.816 6.027 ( 1.878 3.313 0.000) 3.808 6.943 ( 5.900 2.947 0.000) 6.595 7.004 ( 0.447 -4.073 0.000) 4.098 7.137 ( -12.927 14.132 0.000) 19.153 7.590 ( -14.988 -3.267 0.000) 15.340 8.360 ( 9.113 -4.319 0.000) 10.084 9.232 ( -0.787 15.635 0.000) 15.655 9.514 ( 1.444 2.946 0.000) 3.280 9.723 ( -15.634 3.315 0.000) 15.981 10.173 ( -7.565 1.384 0.000) 7.690 10.228 ( -2.004 -12.547 0.000) 12.706 10.498 ( -1.791 10.081 0.000) 10.239 10.606 ( 14.821 -14.605 0.000) 20.808 10.737 ( 8.468 -1.892 0.000) 8.677 11.270 ( -1.820 4.051 0.000) 4.441 11.767 ( 0.045 -0.486 0.000) 0.488 11.810 ( 0.688 1.121 0.000) 1.315 12.035 ( -1.089 0.953 0.000) 1.447 12.452 ( 0.264 -6.257 0.000) 6.263 13.074 ( -3.983 4.170 0.000) 5.767 13.189 ( -6.902 1.566 0.000) 7.078 13.456 ( -3.303 3.350 0.000) 4.705 13.576 ( -1.218 9.058 0.000) 9.139 13.596 ( -8.534 -0.772 0.000) 8.569 13.744 ( 3.445 2.176 0.000) 4.075 14.032 ( -3.439 -1.426 0.000) 3.722 14.390 ( 3.426 1.775 0.000) 3.859 14.512 ( 4.544 -16.158 0.000) 16.785 14.550 ( -2.290 -6.489 0.000) 6.882 15.004 ( 1.637 2.517 0.000) 3.003 15.140 ( 8.373 7.380 0.000) 11.161 15.251 ( -1.314 1.828 0.000) 2.251 15.338 ( -10.129 -13.954 0.000) 17.243 15.898 ( 2.027 -1.675 0.000) 2.629 15.933 ( -12.920 -3.394 0.000) 13.358 16.113 ( 1.880 -1.149 0.000) 2.204 16.114 ( 0.088 0.304 0.000) 0.316 16.230 ( 4.429 -3.787 0.000) 5.827 16.407 ( -0.848 0.599 0.000) 1.038 16.696 ( 2.179 -3.297 0.000) 3.952 16.780 ( -12.175 0.146 0.000) 12.176 17.245 ( 18.682 1.474 0.000) 18.740 17.595 ( 3.399 -7.094 0.000) 7.866 18.726 ( 5.145 6.044 0.000) 7.937 19.274 ( 21.125 21.038 0.000) 29.814 ======================= Grid point 2 (3/125) ======================= q-point: ( 0.22 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 205 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.012 ( 13.008 -16.814 0.000) 21.258 1.070 ( 15.143 -18.483 0.000) 23.894 1.756 ( 31.664 -16.246 0.000) 35.589 2.168 ( -1.688 3.605 0.000) 3.980 2.388 ( 0.265 4.815 0.000) 4.822 2.874 ( -7.043 -0.196 0.000) 7.046 4.830 ( -6.367 1.153 0.000) 6.470 4.901 ( 15.851 -1.909 0.000) 15.965 5.519 ( -1.130 -8.831 0.000) 8.903 5.977 ( 2.145 7.091 0.000) 7.408 6.718 ( -15.103 10.638 0.000) 18.473 6.949 ( 3.352 2.556 0.000) 4.216 7.181 ( -1.365 -18.755 0.000) 18.805 7.497 ( -9.647 -4.315 0.000) 10.569 8.450 ( -1.991 -1.133 0.000) 2.291 8.884 ( -2.506 19.604 0.000) 19.764 9.298 ( -26.916 11.583 0.000) 29.303 9.606 ( 5.320 -3.858 0.000) 6.571 10.115 ( -16.899 -2.518 0.000) 17.086 10.249 ( 4.343 14.514 0.000) 15.150 10.502 ( 10.861 -13.174 0.000) 17.074 10.809 ( 6.217 5.308 0.000) 8.175 11.005 ( 8.290 -15.758 0.000) 17.806 11.160 ( -3.205 5.329 0.000) 6.219 11.766 ( -0.991 0.228 0.000) 1.016 11.823 ( 2.597 -0.406 0.000) 2.628 12.000 ( -1.285 1.115 0.000) 1.701 12.585 ( -0.497 -10.231 0.000) 10.243 12.908 ( 0.477 11.237 0.000) 11.247 13.111 ( -12.851 -7.770 0.000) 15.018 13.267 ( -4.640 11.154 0.000) 12.081 13.462 ( -5.330 5.078 0.000) 7.361 13.466 ( -0.817 4.632 0.000) 4.703 13.801 ( 6.138 -0.048 0.000) 6.138 14.015 ( 5.650 5.074 0.000) 7.594 14.407 ( 3.790 2.171 0.000) 4.368 14.624 ( -2.398 -6.551 0.000) 6.976 14.802 ( -0.361 -12.834 0.000) 12.839 14.979 ( 4.233 2.632 0.000) 4.985 15.156 ( 11.192 7.584 0.000) 13.519 15.180 ( -2.760 3.673 0.000) 4.594 15.437 ( -4.583 -10.372 0.000) 11.340 15.833 ( -9.045 -3.790 0.000) 9.807 15.964 ( 2.959 -1.996 0.000) 3.570 16.113 ( -0.220 -0.291 0.000) 0.365 16.156 ( 1.365 -0.918 0.000) 1.645 16.338 ( 4.118 -2.596 0.000) 4.868 16.387 ( -0.530 0.501 0.000) 0.729 16.638 ( -9.203 -0.289 0.000) 9.208 16.794 ( 2.905 -4.493 0.000) 5.350 17.479 ( 19.281 0.925 0.000) 19.303 17.807 ( 6.468 -10.604 0.000) 12.421 18.688 ( -5.701 -1.769 0.000) 5.969 19.204 ( 8.601 13.695 0.000) 16.172 ======================= Grid point 3 (4/125) ======================= q-point: ( 0.33 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 205 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.365 ( 6.571 -10.512 0.000) 12.397 1.519 ( 12.028 -15.811 0.000) 19.866 2.068 ( 4.560 4.105 0.000) 6.135 2.293 ( -1.499 6.699 0.000) 6.864 2.312 ( 14.705 -8.703 0.000) 17.087 2.781 ( -6.130 0.121 0.000) 6.131 4.677 ( -9.015 4.131 0.000) 9.916 5.046 ( 8.316 4.134 0.000) 9.287 5.808 ( 13.334 -17.182 0.000) 21.749 5.861 ( 0.034 8.834 0.000) 8.834 6.480 ( -6.005 2.313 0.000) 6.435 6.956 ( 2.044 2.074 0.000) 2.912 7.451 ( -6.869 -3.870 0.000) 7.884 7.548 ( 6.739 -23.491 0.000) 24.439 8.360 ( -8.330 1.956 0.000) 8.557 8.642 ( 2.656 11.744 0.000) 12.041 8.728 ( -29.484 10.933 0.000) 31.446 9.651 ( -16.589 24.058 0.000) 29.223 9.729 ( 4.206 -3.435 0.000) 5.430 10.274 ( -0.095 -4.784 0.000) 4.785 10.767 ( 3.734 7.542 0.000) 8.415 10.862 ( 13.634 -10.381 0.000) 17.136 11.038 ( -2.890 4.481 0.000) 5.332 11.289 ( 1.531 -11.843 0.000) 11.942 11.722 ( -2.323 2.409 0.000) 3.347 11.878 ( 2.906 -1.109 0.000) 3.110 11.975 ( -0.799 0.262 0.000) 0.841 12.710 ( -2.954 -5.995 0.000) 6.683 12.798 ( 5.870 6.588 0.000) 8.824 13.066 ( -1.277 8.548 0.000) 8.643 13.086 ( -17.622 -15.812 0.000) 23.676 13.328 ( 4.011 10.546 0.000) 11.283 13.380 ( -2.308 3.797 0.000) 4.444 13.851 ( 4.830 3.951 0.000) 6.240 14.046 ( 6.096 1.128 0.000) 6.199 14.425 ( 2.926 1.385 0.000) 3.237 14.689 ( -0.844 -4.910 0.000) 4.982 14.813 ( -3.981 1.349 0.000) 4.203 15.070 ( -3.658 4.650 0.000) 5.916 15.109 ( 7.505 -3.517 0.000) 8.289 15.203 ( 8.366 3.116 0.000) 8.927 15.477 ( -9.651 -6.003 0.000) 11.366 15.855 ( 1.054 -5.925 0.000) 6.018 16.029 ( 2.948 -1.212 0.000) 3.187 16.114 ( -1.044 -0.759 0.000) 1.291 16.163 ( 0.562 1.831 0.000) 1.915 16.379 ( -0.006 0.177 0.000) 0.177 16.416 ( 2.753 -1.503 0.000) 3.137 16.546 ( -6.156 -1.116 0.000) 6.256 16.896 ( 2.408 -3.682 0.000) 4.399 17.726 ( 17.715 -0.445 0.000) 17.721 18.050 ( 5.383 -8.841 0.000) 10.350 18.640 ( -9.849 -6.200 0.000) 11.638 19.080 ( 3.538 12.654 0.000) 13.139 ======================= Grid point 4 (5/125) ======================= q-point: ( 0.44 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 205 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.502 ( 0.886 -2.231 0.000) 2.401 1.874 ( 8.211 -12.350 0.000) 14.830 2.096 ( 2.605 -0.472 0.000) 2.647 2.132 ( -4.476 9.083 0.000) 10.126 2.502 ( 3.186 -1.415 0.000) 3.486 2.732 ( -0.836 0.128 0.000) 0.846 4.522 ( -4.394 2.383 0.000) 4.999 5.052 ( 2.060 2.383 0.000) 3.150 5.752 ( -0.282 3.787 0.000) 3.797 6.280 ( 12.319 -14.743 0.000) 19.212 6.430 ( -1.001 -0.050 0.000) 1.002 6.902 ( -0.969 5.793 0.000) 5.874 7.432 ( -2.615 -1.803 0.000) 3.176 7.969 ( 5.814 -8.101 0.000) 9.972 8.244 ( -3.418 1.394 0.000) 3.691 8.347 ( -12.052 -9.640 0.000) 15.433 8.553 ( 1.147 3.720 0.000) 3.893 9.043 ( -12.152 24.527 0.000) 27.372 9.810 ( 1.745 -1.454 0.000) 2.272 10.332 ( -0.717 -2.840 0.000) 2.929 10.708 ( 1.478 3.685 0.000) 3.970 10.960 ( -1.167 1.720 0.000) 2.079 11.142 ( 8.809 -4.602 0.000) 9.939 11.393 ( -3.969 -3.913 0.000) 5.573 11.661 ( -0.587 1.700 0.000) 1.798 11.917 ( 1.050 -0.354 0.000) 1.108 11.965 ( -0.442 0.003 0.000) 0.442 12.708 ( 1.069 1.450 0.000) 1.801 12.815 ( 0.197 -0.451 0.000) 0.492 12.978 ( 0.603 2.724 0.000) 2.790 13.137 ( -14.766 -17.540 0.000) 22.928 13.240 ( 10.295 13.448 0.000) 16.936 13.304 ( -1.590 1.793 0.000) 2.397 13.832 ( 1.942 3.041 0.000) 3.609 14.104 ( 2.290 -0.323 0.000) 2.313 14.438 ( 1.079 0.425 0.000) 1.159 14.751 ( -1.590 0.993 0.000) 1.874 14.754 ( 0.774 -2.881 0.000) 2.983 14.959 ( -2.511 3.183 0.000) 4.054 15.232 ( 14.689 6.649 0.000) 16.124 15.264 ( -5.225 -7.044 0.000) 8.770 15.402 ( -8.142 -1.628 0.000) 8.303 15.980 ( 2.066 -5.232 0.000) 5.625 16.077 ( 2.488 -0.258 0.000) 2.501 16.105 ( -1.852 -0.481 0.000) 1.914 16.119 ( -0.075 3.647 0.000) 3.647 16.379 ( 0.082 0.005 0.000) 0.082 16.457 ( 1.572 -0.036 0.000) 1.572 16.505 ( -2.857 -1.173 0.000) 3.088 16.960 ( 0.932 -1.405 0.000) 1.686 17.935 ( 10.572 -0.355 0.000) 10.578 18.169 ( -1.433 -2.734 0.000) 3.087 18.654 ( -4.601 -7.839 0.000) 9.090 18.927 ( 1.046 9.303 0.000) 9.362 ======================= Grid point 10 (6/125) ======================= q-point: ( 0.11 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 125 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.719 ( 26.171 0.000 0.000) 26.171 0.749 ( 26.435 0.000 0.000) 26.435 1.362 ( 47.044 0.000 0.000) 47.044 2.274 ( 0.087 0.000 0.000) 0.087 2.476 ( 1.342 0.000 0.000) 1.342 2.833 ( -9.507 -0.000 0.000) 9.507 4.839 ( -3.194 -0.000 0.000) 3.194 4.864 ( 23.553 0.000 0.000) 23.553 5.254 ( 9.750 0.000 0.000) 9.750 6.091 ( 3.607 0.000 0.000) 3.607 6.825 ( -7.559 -0.000 0.000) 7.559 7.099 ( -1.071 -0.000 0.000) 1.071 7.129 ( -30.972 -0.000 0.000) 30.972 7.142 ( -13.214 -0.000 0.000) 13.214 8.430 ( 0.824 0.000 0.000) 0.824 9.437 ( 3.290 0.000 0.000) 3.290 9.552 ( -0.146 -0.000 0.000) 0.146 9.558 ( -16.779 -0.000 0.000) 16.779 9.901 ( -23.433 -0.000 0.000) 23.433 10.041 ( 6.210 0.000 0.000) 6.210 10.701 ( 1.622 0.000 0.000) 1.622 10.740 ( 6.267 0.000 0.000) 6.267 10.801 ( 22.831 0.000 0.000) 22.831 11.254 ( -4.802 -0.000 0.000) 4.802 11.767 ( 0.330 0.000 0.000) 0.330 11.837 ( 2.165 0.000 0.000) 2.165 12.017 ( -2.514 -0.000 0.000) 2.514 12.406 ( 0.182 0.000 0.000) 0.182 12.881 ( -14.239 -0.000 0.000) 14.239 13.254 ( 2.771 0.000 0.000) 2.771 13.436 ( -4.074 -0.000 0.000) 4.074 13.499 ( -6.309 -0.000 0.000) 6.309 13.611 ( -3.939 -0.000 0.000) 3.939 13.952 ( 11.602 0.000 0.000) 11.602 14.096 ( 11.736 0.000 0.000) 11.736 14.219 ( -6.375 -0.000 0.000) 6.375 14.428 ( -6.125 -0.000 0.000) 6.125 14.479 ( 6.051 0.000 0.000) 6.051 15.061 ( 3.219 0.000 0.000) 3.219 15.180 ( 3.045 0.000 0.000) 3.045 15.241 ( -2.401 -0.000 0.000) 2.401 15.326 ( 9.246 0.000 0.000) 9.246 15.756 ( -9.744 -0.000 0.000) 9.744 15.929 ( 4.240 0.000 0.000) 4.240 16.121 ( 0.289 0.000 0.000) 0.289 16.134 ( 2.972 0.000 0.000) 2.972 16.277 ( 3.465 0.000 0.000) 3.465 16.390 ( -1.918 -0.000 0.000) 1.918 16.644 ( -7.738 -0.000 0.000) 7.738 16.718 ( 4.657 0.000 0.000) 4.657 17.540 ( 22.460 0.000 0.000) 22.460 17.592 ( 5.348 0.000 0.000) 5.348 18.674 ( -11.326 -0.000 0.000) 11.326 19.671 ( 0.429 0.000 0.000) 0.429 ======================= Grid point 11 (7/125) ======================= q-point: ( 0.22 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 205 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.108 ( 20.921 -4.165 0.000) 21.332 1.122 ( 22.405 -7.959 0.000) 23.777 1.993 ( 30.814 -8.133 0.000) 31.869 2.251 ( 4.529 4.864 0.000) 6.646 2.468 ( 1.405 3.585 0.000) 3.850 2.725 ( -9.713 -3.014 0.000) 10.170 4.777 ( -4.890 1.903 0.000) 5.248 5.220 ( 29.181 3.314 0.000) 29.369 5.438 ( 8.903 -5.194 0.000) 10.308 6.107 ( 3.147 4.834 0.000) 5.768 6.627 ( -21.601 7.382 0.000) 22.828 6.834 ( -7.204 -16.059 0.000) 17.601 7.072 ( 4.044 3.465 0.000) 5.325 7.079 ( -21.457 -13.535 0.000) 25.369 8.361 ( -10.350 -0.609 0.000) 10.368 9.148 ( -25.462 14.582 0.000) 29.342 9.206 ( -3.423 16.599 0.000) 16.948 9.667 ( 11.048 0.422 0.000) 11.056 9.724 ( -21.407 -13.331 0.000) 25.218 10.370 ( 13.491 -16.943 0.000) 21.658 10.508 ( -2.703 15.927 0.000) 16.155 10.881 ( 1.635 -3.494 0.000) 3.857 11.116 ( 21.335 -1.263 0.000) 21.373 11.161 ( -5.328 2.806 0.000) 6.022 11.766 ( -0.143 0.614 0.000) 0.631 11.876 ( 4.754 0.665 0.000) 4.800 11.976 ( -3.320 -0.128 0.000) 3.322 12.448 ( -1.666 -6.150 0.000) 6.372 12.735 ( -15.651 -5.920 0.000) 16.733 13.164 ( 4.463 13.395 0.000) 14.119 13.335 ( -5.017 5.186 0.000) 7.216 13.445 ( -4.585 -1.372 0.000) 4.786 13.512 ( -3.249 4.992 0.000) 5.957 14.001 ( 11.303 6.023 0.000) 12.807 14.164 ( 3.946 2.086 0.000) 4.464 14.369 ( -7.661 -4.387 0.000) 8.828 14.438 ( -3.337 -20.580 0.000) 20.849 14.568 ( 5.001 -1.485 0.000) 5.217 15.073 ( 2.700 2.848 0.000) 3.924 15.184 ( -3.527 2.177 0.000) 4.145 15.274 ( 1.869 -5.089 0.000) 5.421 15.429 ( 12.458 5.312 0.000) 13.543 15.679 ( -4.946 -3.443 0.000) 6.026 16.000 ( 5.200 -0.546 0.000) 5.229 16.119 ( 0.306 0.660 0.000) 0.728 16.168 ( 1.391 0.836 0.000) 1.623 16.314 ( -1.749 -4.409 0.000) 4.743 16.367 ( -1.922 -0.627 0.000) 2.021 16.582 ( -0.314 1.380 0.000) 1.415 16.805 ( 5.854 -1.745 0.000) 6.109 17.689 ( 8.893 -1.606 0.000) 9.037 17.868 ( 21.079 -2.409 0.000) 21.216 18.507 ( -14.996 -1.939 0.000) 15.121 19.557 ( 3.944 13.887 0.000) 14.437 ======================= Grid point 12 (8/125) ======================= q-point: ( 0.33 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 205 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.399 ( 12.466 -3.563 0.000) 12.965 1.525 ( 17.438 -9.152 0.000) 19.694 2.152 ( 0.337 2.604 0.000) 2.626 2.398 ( 0.519 7.226 0.000) 7.244 2.436 ( 12.709 -0.860 0.000) 12.738 2.702 ( 0.450 -3.167 0.000) 3.198 4.643 ( -6.104 4.936 0.000) 7.850 5.330 ( 10.920 14.173 0.000) 17.892 5.809 ( 23.926 -12.551 0.000) 27.018 5.987 ( -3.349 9.405 0.000) 9.984 6.404 ( -6.990 -1.968 0.000) 7.262 7.007 ( -23.641 -16.794 0.000) 28.999 7.043 ( 5.264 -1.278 0.000) 5.417 7.232 ( 6.398 -24.348 0.000) 25.175 8.228 ( -11.074 -2.314 0.000) 11.313 8.535 ( -28.708 15.082 0.000) 32.428 8.943 ( 0.056 14.252 0.000) 14.252 9.597 ( -20.404 -1.668 0.000) 20.472 9.799 ( 10.872 1.744 0.000) 11.012 10.226 ( -6.836 7.929 0.000) 10.469 10.796 ( 11.812 -14.467 0.000) 18.677 10.886 ( -0.484 2.902 0.000) 2.942 11.043 ( -4.642 3.259 0.000) 5.672 11.377 ( 17.117 1.599 0.000) 17.192 11.736 ( -0.627 2.186 0.000) 2.274 11.930 ( 4.621 1.264 0.000) 4.791 11.945 ( -2.626 -1.257 0.000) 2.912 12.544 ( -6.421 -12.936 0.000) 14.442 12.639 ( -11.881 -5.481 0.000) 13.084 13.045 ( 7.280 11.218 0.000) 13.373 13.177 ( -2.146 7.710 0.000) 8.003 13.387 ( -4.738 4.127 0.000) 6.283 13.417 ( -2.398 -1.395 0.000) 2.774 14.058 ( 11.255 8.825 0.000) 14.302 14.173 ( 3.283 1.736 0.000) 3.714 14.348 ( -8.140 -6.149 0.000) 10.201 14.623 ( -7.363 -12.471 0.000) 14.482 14.658 ( 4.121 -2.268 0.000) 4.704 15.064 ( -1.147 -0.322 0.000) 1.191 15.084 ( -4.182 3.829 0.000) 5.670 15.347 ( 1.188 -2.117 0.000) 2.428 15.495 ( 13.391 8.199 0.000) 15.701 15.738 ( -0.028 -7.352 0.000) 7.352 16.073 ( 4.823 -0.036 0.000) 4.823 16.110 ( 0.079 0.799 0.000) 0.803 16.135 ( -6.319 -1.461 0.000) 6.486 16.359 ( -1.570 -1.159 0.000) 1.951 16.376 ( 1.937 -2.767 0.000) 3.378 16.581 ( 4.051 2.305 0.000) 4.661 16.912 ( 5.704 -1.505 0.000) 5.899 17.847 ( 6.218 -4.221 0.000) 7.515 18.158 ( 18.509 1.006 0.000) 18.536 18.363 ( -14.197 -7.105 0.000) 15.876 19.383 ( 4.460 15.681 0.000) 16.302 ======================= Grid point 13 (9/125) ======================= q-point: ( 0.44 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 205 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.540 ( 5.704 0.296 0.000) 5.712 1.858 ( 12.400 -7.842 0.000) 14.672 2.131 ( 0.907 1.345 0.000) 1.622 2.253 ( -1.252 11.027 0.000) 11.098 2.508 ( 0.473 -0.660 0.000) 0.812 2.756 ( 2.568 1.601 0.000) 3.026 4.519 ( -1.375 2.654 0.000) 2.989 5.210 ( 4.314 12.226 0.000) 12.965 5.802 ( -4.465 6.291 0.000) 7.714 6.335 ( 24.214 -9.757 0.000) 26.106 6.401 ( -1.262 -2.695 0.000) 2.976 6.991 ( -22.823 -21.446 0.000) 31.318 7.014 ( -1.423 10.603 0.000) 10.698 7.838 ( 15.170 -28.929 0.000) 32.666 8.048 ( -16.920 0.434 0.000) 16.926 8.171 ( -5.020 -4.573 0.000) 6.791 8.762 ( 1.580 10.594 0.000) 10.711 9.202 ( -16.071 17.236 0.000) 23.566 9.886 ( 8.409 4.199 0.000) 9.399 10.138 ( -9.722 -8.753 0.000) 13.082 10.807 ( -0.989 5.246 0.000) 5.339 10.954 ( -2.889 1.324 0.000) 3.178 11.085 ( 4.575 -6.770 0.000) 8.171 11.502 ( 8.706 3.359 0.000) 9.331 11.717 ( 5.171 3.837 0.000) 6.439 11.945 ( -0.507 -1.482 0.000) 1.566 11.948 ( 1.688 1.763 0.000) 2.441 12.558 ( -14.849 -8.764 0.000) 17.242 12.698 ( -1.562 -11.811 0.000) 11.914 13.007 ( 8.119 7.681 0.000) 11.177 13.051 ( -0.705 6.537 0.000) 6.575 13.278 ( -4.662 0.633 0.000) 4.705 13.434 ( 0.865 -2.233 0.000) 2.394 13.992 ( 6.310 13.776 0.000) 15.152 14.199 ( 3.910 2.651 0.000) 4.724 14.335 ( -8.331 -6.173 0.000) 10.369 14.669 ( -4.817 -5.591 0.000) 7.380 14.749 ( 3.673 -2.548 0.000) 4.471 14.971 ( -3.314 3.407 0.000) 4.753 15.034 ( -8.472 -3.698 0.000) 9.244 15.385 ( 2.231 0.837 0.000) 2.383 15.547 ( 13.194 7.313 0.000) 15.085 15.858 ( -0.887 -7.571 0.000) 7.623 16.061 ( -9.280 -3.136 0.000) 9.795 16.094 ( -0.304 0.943 0.000) 0.991 16.127 ( 3.987 0.746 0.000) 4.056 16.358 ( -1.445 -1.240 0.000) 1.904 16.438 ( 5.346 1.108 0.000) 5.460 16.608 ( 4.908 2.319 0.000) 5.428 16.989 ( 4.304 0.420 0.000) 4.324 17.899 ( -8.208 -1.921 0.000) 8.429 18.246 ( 2.193 -1.311 0.000) 2.555 18.477 ( 8.474 -6.384 0.000) 10.610 19.197 ( 4.701 15.603 0.000) 16.295 ======================= Grid point 14 (10/125) ======================= q-point: (-0.44 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 205 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.576 ( 4.324 3.074 0.000) 5.305 2.017 ( -3.152 15.334 0.000) 15.655 2.096 ( -1.982 3.539 0.000) 4.056 2.096 ( 7.168 -5.723 0.000) 9.173 2.466 ( -6.422 2.443 0.000) 6.871 2.760 ( 2.891 0.015 0.000) 2.891 4.558 ( 6.964 -2.634 0.000) 7.445 5.097 ( 2.551 8.195 0.000) 8.582 5.698 ( -3.642 -0.417 0.000) 3.666 6.431 ( 0.536 -1.931 0.000) 2.004 6.448 ( -6.391 21.828 0.000) 22.744 6.864 ( 4.526 -3.467 0.000) 5.701 7.057 ( -20.154 -23.613 0.000) 31.044 7.972 ( -1.834 -0.534 0.000) 1.910 8.235 ( 1.873 -6.040 0.000) 6.324 8.524 ( 17.837 -17.611 0.000) 25.065 8.660 ( 3.034 6.435 0.000) 7.114 8.876 ( 1.422 -4.377 0.000) 4.603 9.882 ( 4.188 7.145 0.000) 8.282 10.174 ( -10.311 -11.846 0.000) 15.705 10.714 ( -1.577 4.202 0.000) 4.489 10.932 ( -0.888 -1.879 0.000) 2.078 11.080 ( -5.752 5.378 0.000) 7.875 11.597 ( 7.464 -2.266 0.000) 7.800 11.707 ( 6.120 8.483 0.000) 10.460 11.929 ( -0.124 1.933 0.000) 1.937 11.972 ( 2.449 0.540 0.000) 2.508 12.513 ( -11.174 -8.726 0.000) 14.177 12.865 ( -1.285 -11.184 0.000) 11.258 12.952 ( -2.782 2.144 0.000) 3.513 12.999 ( 5.449 5.472 0.000) 7.723 13.264 ( -1.251 -3.416 0.000) 3.638 13.503 ( 4.829 -1.323 0.000) 5.007 13.837 ( 3.746 13.500 0.000) 14.010 14.170 ( 1.197 5.617 0.000) 5.743 14.315 ( -8.259 -5.641 0.000) 10.002 14.701 ( -1.564 -4.459 0.000) 4.725 14.800 ( 1.199 1.540 0.000) 1.952 14.938 ( 0.994 -2.623 0.000) 2.805 14.965 ( -10.231 -4.296 0.000) 11.096 15.349 ( -2.322 4.363 0.000) 4.942 15.620 ( 9.224 3.711 0.000) 9.943 15.890 ( -7.623 -3.867 0.000) 8.548 16.048 ( -0.002 -4.238 0.000) 4.238 16.069 ( -0.765 1.409 0.000) 1.603 16.158 ( 3.255 1.578 0.000) 3.617 16.356 ( -1.609 -1.153 0.000) 1.980 16.480 ( 6.204 3.825 0.000) 7.288 16.635 ( 5.085 2.574 0.000) 5.700 17.006 ( 2.250 3.084 0.000) 3.817 17.730 ( -17.083 -0.152 0.000) 17.083 18.282 ( 1.037 2.423 0.000) 2.635 18.664 ( 6.422 -3.972 0.000) 7.551 19.055 ( 7.010 11.586 0.000) 13.542 ======================= Grid point 15 (11/125) ======================= q-point: (-0.33 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 205 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.530 ( 2.763 11.337 0.000) 11.669 1.686 ( -5.332 19.797 0.000) 20.503 1.960 ( -9.213 4.088 0.000) 10.079 2.241 ( 3.251 -4.103 0.000) 5.235 2.288 ( -7.604 6.084 0.000) 9.738 2.835 ( 4.337 -2.143 0.000) 4.838 4.743 ( 10.250 -4.198 0.000) 11.077 5.008 ( 0.109 6.587 0.000) 6.588 5.724 ( -1.865 -7.195 0.000) 7.433 5.933 ( -12.354 19.892 0.000) 23.416 6.502 ( 4.696 -4.201 0.000) 6.301 6.970 ( 5.327 1.646 0.000) 5.575 7.171 ( -17.030 -22.740 0.000) 28.410 7.748 ( -8.023 15.266 0.000) 17.246 8.392 ( 6.053 -6.411 0.000) 8.817 8.645 ( 4.557 1.830 0.000) 4.911 8.938 ( 24.534 -10.502 0.000) 26.687 9.415 ( 14.451 -30.720 0.000) 33.950 9.788 ( 0.638 8.600 0.000) 8.624 10.200 ( -10.123 -8.440 0.000) 13.180 10.647 ( -3.211 0.072 0.000) 3.212 10.830 ( -10.654 11.129 0.000) 15.406 10.984 ( 0.447 -4.922 0.000) 4.942 11.596 ( 4.768 15.942 0.000) 16.640 11.730 ( 6.318 -1.832 0.000) 6.578 11.883 ( -1.195 2.790 0.000) 3.035 11.972 ( -0.261 0.993 0.000) 1.027 12.553 ( -5.943 -11.631 0.000) 13.061 12.923 ( 5.182 9.152 0.000) 10.517 12.958 ( -0.276 -6.328 0.000) 6.334 13.027 ( -5.112 -9.450 0.000) 10.744 13.323 ( -0.456 -4.923 0.000) 4.944 13.589 ( 9.368 2.591 0.000) 9.720 13.734 ( 4.668 5.014 0.000) 6.850 14.064 ( -1.336 7.244 0.000) 7.366 14.296 ( -6.804 -5.089 0.000) 8.497 14.763 ( -0.915 -5.336 0.000) 5.414 14.771 ( 1.042 3.012 0.000) 3.187 14.916 ( -7.414 -5.070 0.000) 8.982 15.035 ( 2.447 -5.276 0.000) 5.816 15.176 ( -11.685 6.153 0.000) 13.206 15.624 ( -1.695 2.128 0.000) 2.720 15.895 ( 4.471 -1.004 0.000) 4.582 16.030 ( -1.056 2.099 0.000) 2.349 16.124 ( 1.856 -2.391 0.000) 3.027 16.164 ( 2.265 2.522 0.000) 3.390 16.354 ( -1.490 -1.452 0.000) 2.080 16.469 ( 3.656 6.157 0.000) 7.161 16.683 ( 8.078 2.022 0.000) 8.327 16.957 ( 0.399 5.400 0.000) 5.415 17.482 ( -18.781 0.701 0.000) 18.794 18.164 ( -3.523 9.805 0.000) 10.419 18.752 ( 2.414 0.463 0.000) 2.458 19.039 ( 6.869 3.432 0.000) 7.679 ======================= Grid point 16 (12/125) ======================= q-point: (-0.22 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 205 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.270 ( 0.441 23.281 0.000) 23.285 1.273 ( -5.321 23.748 0.000) 24.337 1.660 ( -17.635 13.618 0.000) 22.281 2.176 ( 1.031 1.532 0.000) 1.847 2.324 ( 0.670 -3.708 0.000) 3.768 2.915 ( 2.260 -2.099 0.000) 3.084 4.860 ( -3.932 9.261 0.000) 10.062 4.896 ( 5.383 -1.031 0.000) 5.481 5.631 ( -1.437 5.518 0.000) 5.702 5.836 ( -0.940 -8.399 0.000) 8.451 6.721 ( 10.425 -10.675 0.000) 14.921 6.958 ( 1.552 5.194 0.000) 5.421 7.311 ( -11.712 -20.667 0.000) 23.755 7.435 ( -2.446 14.961 0.000) 15.160 8.518 ( 3.356 1.029 0.000) 3.510 8.760 ( 6.277 -8.306 0.000) 10.411 9.455 ( 22.153 -13.888 0.000) 26.146 9.647 ( -1.401 8.478 0.000) 8.593 9.947 ( -1.037 -15.555 0.000) 15.589 10.222 ( 1.820 -10.876 0.000) 11.027 10.507 ( -9.416 10.975 0.000) 14.460 10.618 ( -6.365 -3.620 0.000) 7.322 11.085 ( 0.601 -6.799 0.000) 6.826 11.326 ( 1.712 24.319 0.000) 24.380 11.793 ( 2.375 1.366 0.000) 2.739 11.823 ( -1.021 2.496 0.000) 2.697 11.974 ( -0.727 -2.763 0.000) 2.857 12.697 ( -1.253 -7.889 0.000) 7.988 12.812 ( 3.902 6.768 0.000) 7.812 13.071 ( -6.320 -6.189 0.000) 8.846 13.130 ( 2.692 -12.603 0.000) 12.887 13.390 ( -1.048 -4.736 0.000) 4.851 13.663 ( 3.218 -0.466 0.000) 3.251 13.810 ( 11.281 4.145 0.000) 12.018 13.971 ( 5.699 2.413 0.000) 6.189 14.298 ( -3.752 -4.330 0.000) 5.730 14.735 ( 1.247 3.989 0.000) 4.180 14.825 ( -5.258 -0.919 0.000) 5.338 14.861 ( -16.495 2.103 0.000) 16.629 14.924 ( -3.996 -5.080 0.000) 6.463 15.143 ( 1.506 -4.899 0.000) 5.125 15.566 ( -0.232 2.613 0.000) 2.623 15.978 ( -0.922 2.821 0.000) 2.967 16.002 ( 8.240 -0.551 0.000) 8.258 16.142 ( 0.763 2.583 0.000) 2.693 16.148 ( -0.587 0.554 0.000) 0.808 16.366 ( -0.563 -1.891 0.000) 1.973 16.397 ( 1.793 7.398 0.000) 7.612 16.792 ( 11.646 0.966 0.000) 11.686 16.860 ( -0.506 6.510 0.000) 6.529 17.225 ( -17.708 0.540 0.000) 17.716 17.930 ( -3.827 12.619 0.000) 13.187 18.718 ( -2.175 3.790 0.000) 4.369 19.083 ( 2.519 0.122 0.000) 2.522 ======================= Grid point 17 (13/125) ======================= q-point: (-0.11 0.11 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 125 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.837 ( 0.000 26.395 0.000) 26.395 0.878 ( 0.000 27.235 0.000) 27.235 1.150 ( 0.000 30.434 0.000) 30.434 2.208 ( -0.000 -2.996 0.000) 2.996 2.384 ( -0.000 -3.761 0.000) 3.761 2.955 ( -0.000 -1.270 0.000) 1.270 4.677 ( 0.000 8.514 0.000) 8.514 4.922 ( 0.000 1.408 0.000) 1.408 5.674 ( -0.000 -7.092 0.000) 7.092 5.942 ( -0.000 -6.068 0.000) 6.068 6.877 ( 0.000 4.980 0.000) 4.980 7.014 ( -0.000 -14.215 0.000) 14.215 7.203 ( 0.000 14.043 0.000) 14.043 7.525 ( -0.000 -16.204 0.000) 16.204 8.448 ( 0.000 9.696 0.000) 9.696 9.005 ( -0.000 -15.627 0.000) 15.627 9.516 ( 0.000 5.466 0.000) 5.466 9.875 ( 0.000 1.979 0.000) 1.979 9.944 ( -0.000 -18.499 0.000) 18.499 10.309 ( 0.000 5.485 0.000) 5.485 10.546 ( -0.000 -12.451 0.000) 12.451 10.557 ( 0.000 0.347 0.000) 0.347 10.917 ( 0.000 28.204 0.000) 28.204 11.196 ( -0.000 -6.456 0.000) 6.456 11.781 ( 0.000 1.275 0.000) 1.275 11.794 ( 0.000 0.170 0.000) 0.170 12.015 ( -0.000 -2.371 0.000) 2.371 12.585 ( 0.000 10.607 0.000) 10.607 13.006 ( -0.000 -15.122 0.000) 15.122 13.077 ( -0.000 -2.960 0.000) 2.960 13.374 ( -0.000 -14.770 0.000) 14.770 13.441 ( -0.000 -3.270 0.000) 3.270 13.686 ( 0.000 0.719 0.000) 0.719 13.774 ( 0.000 4.645 0.000) 4.645 14.180 ( -0.000 -6.827 0.000) 6.827 14.330 ( -0.000 -3.008 0.000) 3.008 14.492 ( 0.000 11.005 0.000) 11.005 14.668 ( 0.000 6.053 0.000) 6.053 14.925 ( -0.000 -7.094 0.000) 7.094 14.964 ( -0.000 -4.217 0.000) 4.217 15.219 ( -0.000 -3.471 0.000) 3.471 15.533 ( 0.000 2.946 0.000) 2.946 15.924 ( 0.000 2.991 0.000) 2.991 16.090 ( 0.000 3.514 0.000) 3.514 16.100 ( -0.000 -1.010 0.000) 1.010 16.117 ( 0.000 0.950 0.000) 0.950 16.305 ( 0.000 5.798 0.000) 5.798 16.392 ( -0.000 -1.658 0.000) 1.658 16.757 ( 0.000 5.915 0.000) 5.915 16.922 ( 0.000 0.247 0.000) 0.247 17.043 ( -0.000 -0.524 0.000) 0.524 17.712 ( 0.000 11.167 0.000) 11.167 18.604 ( 0.000 5.803 0.000) 5.803 19.091 ( 0.000 0.245 0.000) 0.245 ======================= Grid point 20 (14/125) ======================= q-point: ( 0.22 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 125 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.328 ( 15.258 0.000 0.000) 15.258 1.371 ( 22.222 0.000 0.000) 22.222 2.184 ( 4.729 0.000 0.000) 4.729 2.497 ( 24.309 0.000 0.000) 24.309 2.521 ( 1.864 0.000 0.000) 1.864 2.578 ( -7.056 -0.000 0.000) 7.056 4.747 ( -2.942 -0.000 0.000) 2.942 5.571 ( 17.114 0.000 0.000) 17.114 5.734 ( 36.371 0.000 0.000) 36.371 6.194 ( 2.340 0.000 0.000) 2.340 6.312 ( -29.251 -0.000 0.000) 29.251 6.559 ( -9.245 -0.000 0.000) 9.245 6.723 ( -15.829 -0.000 0.000) 15.829 7.154 ( 4.936 0.000 0.000) 4.936 8.176 ( -15.242 -0.000 0.000) 15.242 9.021 ( -22.657 -0.000 0.000) 22.657 9.178 ( -13.482 -0.000 0.000) 13.482 9.216 ( -26.422 -0.000 0.000) 26.422 9.898 ( 16.724 0.000 0.000) 16.724 10.482 ( 22.026 0.000 0.000) 22.026 10.580 ( -11.482 -0.000 0.000) 11.482 10.811 ( -1.160 -0.000 0.000) 1.160 11.116 ( -4.809 -0.000 0.000) 4.809 11.412 ( 22.427 0.000 0.000) 22.427 11.776 ( 0.561 0.000 0.000) 0.561 11.914 ( -5.219 -0.000 0.000) 5.219 11.960 ( 6.610 0.000 0.000) 6.610 12.316 ( -11.013 -0.000 0.000) 11.013 12.555 ( -4.942 -0.000 0.000) 4.942 13.295 ( -6.141 -0.000 0.000) 6.141 13.342 ( -5.952 -0.000 0.000) 5.952 13.388 ( 7.630 0.000 0.000) 7.630 13.522 ( -2.370 -0.000 0.000) 2.370 13.984 ( -8.751 -0.000 0.000) 8.751 14.190 ( -11.502 -0.000 0.000) 11.502 14.261 ( 10.224 0.000 0.000) 10.224 14.379 ( 7.106 0.000 0.000) 7.106 14.625 ( 4.254 0.000 0.000) 4.254 15.116 ( 0.278 0.000 0.000) 0.278 15.150 ( -4.186 -0.000 0.000) 4.186 15.292 ( 5.447 0.000 0.000) 5.447 15.619 ( 0.379 0.000 0.000) 0.379 15.641 ( 12.443 0.000 0.000) 12.443 16.073 ( 5.851 0.000 0.000) 5.851 16.132 ( 0.509 0.000 0.000) 0.509 16.160 ( -9.663 -0.000 0.000) 9.663 16.271 ( 7.946 0.000 0.000) 7.946 16.332 ( -2.169 -0.000 0.000) 2.169 16.618 ( 2.961 0.000 0.000) 2.961 16.885 ( 7.537 0.000 0.000) 7.537 17.766 ( 6.790 0.000 0.000) 6.790 18.162 ( 20.789 0.000 0.000) 20.789 18.268 ( -15.873 -0.000 0.000) 15.873 19.682 ( 0.321 0.000 0.000) 0.321 ======================= Grid point 21 (15/125) ======================= q-point: ( 0.33 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 205 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.501 ( 8.018 -2.167 0.000) 8.305 1.673 ( 18.132 -3.397 0.000) 18.448 2.191 ( 0.486 1.988 0.000) 2.047 2.509 ( -0.947 0.746 0.000) 1.206 2.509 ( 1.628 4.638 0.000) 4.915 2.777 ( 12.260 -0.366 0.000) 12.265 4.672 ( -1.886 5.383 0.000) 5.704 5.703 ( 11.368 13.943 0.000) 17.990 5.975 ( -16.958 -0.802 0.000) 16.977 6.115 ( 32.607 2.636 0.000) 32.713 6.189 ( -12.076 -4.938 0.000) 13.047 6.582 ( -9.875 -3.559 0.000) 10.497 6.813 ( 10.033 -29.526 0.000) 31.184 7.228 ( 7.724 1.122 0.000) 7.805 8.006 ( -13.494 -4.277 0.000) 14.155 8.442 ( -26.119 20.014 0.000) 32.905 8.975 ( -11.498 2.965 0.000) 11.874 9.130 ( -22.377 -18.393 0.000) 28.966 10.072 ( 16.885 5.907 0.000) 17.888 10.265 ( -15.505 12.252 0.000) 19.761 10.823 ( -5.034 -3.989 0.000) 6.423 10.835 ( 18.823 -6.847 0.000) 20.029 11.034 ( -4.230 2.421 0.000) 4.873 11.638 ( 9.985 4.358 0.000) 10.895 11.801 ( 8.918 1.355 0.000) 9.021 11.867 ( -3.667 -3.111 0.000) 4.809 12.021 ( 2.667 2.114 0.000) 3.404 12.209 ( -11.175 -7.526 0.000) 13.473 12.546 ( -0.383 -2.022 0.000) 2.058 13.202 ( -4.978 1.439 0.000) 5.181 13.261 ( -3.127 1.604 0.000) 3.514 13.394 ( 6.261 8.223 0.000) 10.335 13.426 ( -3.039 7.663 0.000) 8.244 14.026 ( -5.652 -13.743 0.000) 14.860 14.092 ( -12.365 -7.646 0.000) 14.538 14.326 ( 7.695 5.815 0.000) 9.646 14.477 ( 2.793 -3.052 0.000) 4.138 14.682 ( 3.030 -1.266 0.000) 3.284 15.074 ( -4.453 2.218 0.000) 4.975 15.081 ( -1.144 3.871 0.000) 4.037 15.382 ( 6.115 -0.821 0.000) 6.170 15.667 ( 2.835 -1.817 0.000) 3.368 15.768 ( 10.840 2.786 0.000) 11.192 16.008 ( -10.390 1.051 0.000) 10.443 16.130 ( 0.503 1.015 0.000) 1.133 16.144 ( 4.815 0.263 0.000) 4.822 16.315 ( -1.646 -1.113 0.000) 1.987 16.422 ( 10.188 -1.989 0.000) 10.380 16.653 ( 3.182 0.749 0.000) 3.269 16.990 ( 7.529 -0.159 0.000) 7.530 17.852 ( 1.089 -0.592 0.000) 1.240 18.052 ( -15.268 -5.898 0.000) 16.368 18.462 ( 21.126 1.167 0.000) 21.158 19.615 ( 1.216 8.708 0.000) 8.793 ======================= Grid point 22 (16/125) ======================= q-point: ( 0.44 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 205 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.612 ( 4.881 -1.184 0.000) 5.023 1.940 ( 12.844 -4.010 0.000) 13.455 2.164 ( 0.719 1.962 0.000) 2.090 2.417 ( 0.931 9.563 0.000) 9.608 2.501 ( -0.897 0.118 0.000) 0.905 2.829 ( 1.085 3.435 0.000) 3.603 4.580 ( 2.419 4.613 0.000) 5.209 5.542 ( 8.634 19.581 0.000) 21.400 5.805 ( -8.641 4.160 0.000) 9.590 6.123 ( -21.101 -18.957 0.000) 28.366 6.553 ( -3.815 -3.342 0.000) 5.072 6.584 ( 28.618 -6.378 0.000) 29.320 7.192 ( -0.075 13.798 0.000) 13.798 7.544 ( 17.355 -32.484 0.000) 36.829 7.914 ( -12.158 5.311 0.000) 13.268 7.974 ( -7.376 -9.618 0.000) 12.120 8.800 ( -8.289 2.323 0.000) 8.608 9.059 ( -19.394 -6.080 0.000) 20.324 9.909 ( -16.287 2.521 0.000) 16.481 10.163 ( 14.095 9.542 0.000) 17.021 10.791 ( -5.181 -1.124 0.000) 5.301 10.942 ( -3.696 2.205 0.000) 4.303 11.132 ( 12.637 -2.821 0.000) 12.948 11.584 ( -1.897 3.563 0.000) 4.036 11.829 ( -2.264 -0.544 0.000) 2.328 11.977 ( -4.037 -0.071 0.000) 4.038 12.020 ( 17.812 1.696 0.000) 17.893 12.227 ( -6.431 -7.000 0.000) 9.506 12.599 ( 1.027 -4.567 0.000) 4.681 13.131 ( -1.953 2.929 0.000) 3.520 13.213 ( 0.886 2.678 0.000) 2.821 13.233 ( -6.578 6.486 0.000) 9.238 13.377 ( 3.652 2.125 0.000) 4.225 14.075 ( -11.065 -9.622 0.000) 14.663 14.137 ( -3.126 -6.190 0.000) 6.934 14.317 ( 6.821 7.349 0.000) 10.027 14.549 ( 0.447 -3.876 0.000) 3.901 14.749 ( 2.380 -2.755 0.000) 3.641 14.973 ( -3.500 5.362 0.000) 6.403 14.975 ( -3.636 3.016 0.000) 4.724 15.451 ( 3.976 2.131 0.000) 4.511 15.713 ( 1.374 -0.613 0.000) 1.504 15.797 ( -4.071 3.096 0.000) 5.115 15.942 ( 3.702 -2.726 0.000) 4.597 16.116 ( 0.380 1.502 0.000) 1.550 16.191 ( 3.317 0.503 0.000) 3.355 16.317 ( -1.103 -1.207 0.000) 1.635 16.572 ( 10.438 1.141 0.000) 10.500 16.684 ( 3.655 0.907 0.000) 3.765 17.075 ( 5.916 1.275 0.000) 6.051 17.722 ( -15.605 0.044 0.000) 15.605 18.107 ( -1.148 -9.550 0.000) 9.618 18.688 ( 16.907 2.750 0.000) 17.129 19.471 ( 2.608 12.487 0.000) 12.757 ======================= Grid point 23 (17/125) ======================= q-point: (-0.44 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 205 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.674 ( 4.507 1.140 0.000) 4.649 2.128 ( 6.658 -2.478 0.000) 7.104 2.145 ( 1.077 3.174 0.000) 3.352 2.239 ( 0.691 14.089 0.000) 14.106 2.418 ( -7.741 3.988 0.000) 8.708 2.792 ( 0.726 0.439 0.000) 0.849 4.636 ( 9.633 -1.185 0.000) 9.706 5.375 ( 9.246 17.219 0.000) 19.544 5.626 ( -9.249 1.143 0.000) 9.320 6.217 ( -14.692 -22.258 0.000) 26.670 6.570 ( -3.907 -5.533 0.000) 6.773 6.688 ( -18.112 25.551 0.000) 31.319 6.976 ( 20.155 -0.449 0.000) 20.160 7.930 ( 2.653 -4.200 0.000) 4.968 8.095 ( -1.009 -12.574 0.000) 12.615 8.336 ( 19.988 -33.970 0.000) 39.414 8.688 ( -5.056 0.553 0.000) 5.086 8.854 ( -8.444 1.024 0.000) 8.506 9.797 ( -14.680 -12.743 0.000) 19.439 10.140 ( 8.708 12.920 0.000) 15.580 10.723 ( -4.290 1.727 0.000) 4.624 10.888 ( -2.230 -0.972 0.000) 2.433 11.188 ( 2.926 9.942 0.000) 10.363 11.584 ( 2.031 -4.148 0.000) 4.618 11.801 ( -2.907 -0.817 0.000) 3.019 11.945 ( -1.965 -0.712 0.000) 2.090 12.194 ( 17.674 7.886 0.000) 19.353 12.230 ( -7.609 -6.539 0.000) 10.032 12.713 ( 1.134 -7.765 0.000) 7.847 12.963 ( -6.668 7.212 0.000) 9.822 13.175 ( -2.713 -4.170 0.000) 4.975 13.199 ( 4.926 4.470 0.000) 6.652 13.408 ( -1.136 -3.063 0.000) 3.267 14.084 ( -8.697 -8.653 0.000) 12.268 14.130 ( 2.815 5.528 0.000) 6.203 14.278 ( 3.898 7.434 0.000) 8.394 14.613 ( -0.234 -4.178 0.000) 4.184 14.817 ( 1.188 -1.550 0.000) 1.953 14.852 ( -4.277 2.447 0.000) 4.928 14.910 ( -1.096 -0.385 0.000) 1.162 15.363 ( -7.237 6.959 0.000) 10.040 15.680 ( -2.741 2.701 0.000) 3.848 15.774 ( -0.095 -5.143 0.000) 5.143 16.070 ( 7.874 -1.558 0.000) 8.027 16.093 ( 0.156 1.950 0.000) 1.956 16.221 ( 2.567 0.631 0.000) 2.643 16.317 ( -1.319 -0.659 0.000) 1.474 16.642 ( 5.557 3.649 0.000) 6.648 16.740 ( 8.158 1.840 0.000) 8.363 17.100 ( 3.458 3.576 0.000) 4.975 17.500 ( -16.864 0.347 0.000) 16.867 18.215 ( -2.699 -6.238 0.000) 6.797 18.820 ( 11.195 4.441 0.000) 12.044 19.320 ( 4.069 12.094 0.000) 12.760 ======================= Grid point 24 (18/125) ======================= q-point: (-0.33 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 205 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.696 ( 3.632 3.047 0.000) 4.741 1.954 ( -1.264 19.206 0.000) 19.247 2.002 ( -4.931 13.978 0.000) 14.822 2.243 ( 3.084 -1.513 0.000) 3.435 2.274 ( -3.761 1.516 0.000) 4.055 2.832 ( 1.314 -2.773 0.000) 3.068 4.817 ( 9.197 -3.089 0.000) 9.702 5.235 ( 6.428 15.572 0.000) 16.846 5.575 ( -4.658 -7.153 0.000) 8.536 6.088 ( -12.556 22.252 0.000) 25.550 6.408 ( -3.189 -18.794 0.000) 19.062 6.624 ( -7.847 -11.620 0.000) 14.022 7.137 ( 9.926 5.249 0.000) 11.228 7.836 ( -6.309 9.944 0.000) 11.776 8.309 ( 2.705 -12.444 0.000) 12.734 8.650 ( -2.192 -1.849 0.000) 2.867 8.977 ( 7.642 -14.517 0.000) 16.405 9.123 ( 17.045 -34.136 0.000) 38.155 9.832 ( -13.583 -14.015 0.000) 19.517 10.008 ( 3.642 14.116 0.000) 14.578 10.637 ( -2.818 2.551 0.000) 3.801 10.912 ( -0.539 -4.021 0.000) 4.057 10.967 ( -2.386 16.878 0.000) 17.046 11.679 ( 1.321 -1.806 0.000) 2.238 11.805 ( 0.194 -3.460 0.000) 3.465 11.921 ( -0.257 2.590 0.000) 2.602 12.180 ( 8.697 18.131 0.000) 20.109 12.281 ( -4.795 -12.034 0.000) 12.954 12.845 ( -0.345 -7.870 0.000) 7.878 12.856 ( -3.344 -3.984 0.000) 5.201 13.176 ( 6.211 9.984 0.000) 11.758 13.227 ( -1.341 -5.474 0.000) 5.636 13.441 ( -5.193 -7.963 0.000) 9.506 14.083 ( 6.468 8.349 0.000) 10.561 14.117 ( -4.737 -7.380 0.000) 8.770 14.195 ( 4.419 9.135 0.000) 10.148 14.669 ( -0.987 -4.209 0.000) 4.323 14.807 ( -1.467 -1.520 0.000) 2.113 14.811 ( 0.059 1.590 0.000) 1.591 14.972 ( 0.881 -5.515 0.000) 5.585 15.084 ( -14.200 8.769 0.000) 16.689 15.621 ( -0.850 2.046 0.000) 2.216 15.874 ( 1.223 -6.224 0.000) 6.343 16.059 ( -0.116 2.465 0.000) 2.468 16.168 ( 4.434 0.161 0.000) 4.437 16.237 ( 2.431 2.232 0.000) 3.300 16.306 ( -1.920 -1.396 0.000) 2.374 16.626 ( 3.316 5.826 0.000) 6.704 16.834 ( 10.340 1.846 0.000) 10.504 17.058 ( 1.185 5.723 0.000) 5.845 17.266 ( -15.560 1.740 0.000) 15.658 18.205 ( -3.589 2.094 0.000) 4.155 18.850 ( 4.731 5.217 0.000) 7.042 19.215 ( 3.665 8.313 0.000) 9.086 ======================= Grid point 25 (19/125) ======================= q-point: (-0.22 0.22 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 125 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.612 ( 0.000 23.079 0.000) 23.079 1.651 ( 0.000 22.021 0.000) 22.021 1.680 ( 0.000 4.868 0.000) 4.868 2.223 ( 0.000 3.176 0.000) 3.176 2.287 ( -0.000 -2.039 0.000) 2.039 2.889 ( -0.000 -2.950 0.000) 2.950 4.917 ( -0.000 -1.829 0.000) 1.829 5.038 ( 0.000 14.574 0.000) 14.574 5.690 ( -0.000 -9.573 0.000) 9.573 5.734 ( 0.000 12.467 0.000) 12.467 6.662 ( -0.000 -7.467 0.000) 7.467 6.804 ( -0.000 -27.557 0.000) 27.557 7.090 ( 0.000 8.058 0.000) 8.058 7.613 ( 0.000 11.884 0.000) 11.884 8.497 ( -0.000 -7.309 0.000) 7.309 8.691 ( -0.000 -5.234 0.000) 5.234 9.327 ( -0.000 -20.155 0.000) 20.155 9.809 ( -0.000 -32.533 0.000) 32.533 9.818 ( 0.000 12.932 0.000) 12.932 9.844 ( -0.000 -5.645 0.000) 5.645 10.584 ( 0.000 1.752 0.000) 1.752 10.668 ( 0.000 17.096 0.000) 17.096 10.987 ( -0.000 -5.906 0.000) 5.906 11.634 ( 0.000 10.090 0.000) 10.090 11.866 ( 0.000 3.657 0.000) 3.657 11.895 ( -0.000 -5.361 0.000) 5.361 11.933 ( 0.000 15.339 0.000) 15.339 12.471 ( -0.000 -15.518 0.000) 15.518 12.944 ( -0.000 -5.820 0.000) 5.820 12.963 ( -0.000 -10.375 0.000) 10.375 13.026 ( 0.000 13.526 0.000) 13.526 13.303 ( -0.000 -5.382 0.000) 5.382 13.547 ( -0.000 -9.373 0.000) 9.373 13.997 ( 0.000 8.277 0.000) 8.277 14.143 ( 0.000 5.517 0.000) 5.517 14.190 ( -0.000 -6.031 0.000) 6.031 14.731 ( -0.000 -4.941 0.000) 4.941 14.786 ( 0.000 2.003 0.000) 2.003 14.800 ( 0.000 9.813 0.000) 9.813 14.844 ( -0.000 -3.488 0.000) 3.488 15.069 ( -0.000 -5.806 0.000) 5.806 15.589 ( 0.000 1.476 0.000) 1.476 15.983 ( -0.000 -6.100 0.000) 6.100 16.017 ( 0.000 2.779 0.000) 2.779 16.179 ( 0.000 1.865 0.000) 1.865 16.202 ( 0.000 3.826 0.000) 3.826 16.326 ( -0.000 -2.450 0.000) 2.450 16.543 ( 0.000 8.003 0.000) 8.003 16.930 ( 0.000 0.304 0.000) 0.304 16.965 ( 0.000 6.859 0.000) 6.859 17.080 ( 0.000 2.675 0.000) 2.675 18.080 ( 0.000 9.742 0.000) 9.742 18.793 ( 0.000 5.720 0.000) 5.720 19.145 ( 0.000 4.337 0.000) 4.337 ======================= Grid point 30 (20/125) ======================= q-point: ( 0.33 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 125 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.562 ( 4.912 0.000 0.000) 4.912 1.873 ( 14.853 0.000 0.000) 14.853 2.214 ( 0.394 0.000 0.000) 0.394 2.503 ( -0.467 -0.000 0.000) 0.467 2.570 ( 1.789 0.000 0.000) 1.789 2.891 ( 3.063 0.000 0.000) 3.063 4.730 ( 2.519 0.000 0.000) 2.519 5.617 ( -21.989 -0.000 0.000) 21.989 5.995 ( -17.149 -0.000 0.000) 17.149 6.068 ( 21.454 0.000 0.000) 21.454 6.457 ( 1.948 0.000 0.000) 1.948 6.535 ( 1.862 0.000 0.000) 1.862 6.797 ( 39.657 0.000 0.000) 39.657 7.353 ( 9.593 0.000 0.000) 9.593 7.785 ( -12.463 -0.000 0.000) 12.463 8.387 ( -23.570 -0.000 0.000) 23.570 8.564 ( -21.354 -0.000 0.000) 21.354 8.831 ( -11.444 -0.000 0.000) 11.444 10.100 ( -23.938 -0.000 0.000) 23.938 10.344 ( 15.941 0.000 0.000) 15.941 10.721 ( -4.024 -0.000 0.000) 4.024 10.986 ( -5.619 -0.000 0.000) 5.619 11.045 ( 18.479 0.000 0.000) 18.479 11.733 ( 0.053 0.000 0.000) 0.053 11.741 ( -7.573 -0.000 0.000) 7.573 11.922 ( -12.513 -0.000 0.000) 12.513 12.046 ( 21.027 0.000 0.000) 21.027 12.168 ( 5.638 0.000 0.000) 5.638 12.533 ( 0.554 0.000 0.000) 0.554 13.132 ( -5.592 -0.000 0.000) 5.592 13.173 ( -6.328 -0.000 0.000) 6.328 13.485 ( -0.590 -0.000 0.000) 0.590 13.669 ( 13.170 0.000 0.000) 13.170 13.787 ( -5.672 -0.000 0.000) 5.672 13.829 ( -15.180 -0.000 0.000) 15.180 14.437 ( 2.702 0.000 0.000) 2.702 14.487 ( 1.765 0.000 0.000) 1.765 14.701 ( 1.695 0.000 0.000) 1.695 15.032 ( -4.289 -0.000 0.000) 4.289 15.111 ( -0.963 -0.000 0.000) 0.963 15.464 ( 6.769 0.000 0.000) 6.769 15.716 ( 4.948 0.000 0.000) 4.948 15.885 ( 5.273 0.000 0.000) 5.273 15.898 ( -8.082 -0.000 0.000) 8.082 16.146 ( 0.508 0.000 0.000) 0.508 16.195 ( 2.310 0.000 0.000) 2.310 16.295 ( 0.141 0.000 0.000) 0.141 16.577 ( 14.018 0.000 0.000) 14.018 16.695 ( 2.470 0.000 0.000) 2.470 17.092 ( 7.331 0.000 0.000) 7.331 17.746 ( -18.628 -0.000 0.000) 18.628 17.905 ( 2.883 0.000 0.000) 2.883 18.735 ( 17.803 0.000 0.000) 17.803 19.688 ( 0.190 0.000 0.000) 0.190 ======================= Grid point 31 (21/125) ======================= q-point: ( 0.44 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 205 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.645 ( 4.957 -1.912 0.000) 5.313 2.052 ( 9.806 -1.599 0.000) 9.935 2.206 ( 0.774 1.585 0.000) 1.764 2.486 ( -2.187 0.556 0.000) 2.256 2.552 ( 1.443 5.266 0.000) 5.460 2.859 ( -3.582 2.210 0.000) 4.209 4.726 ( 6.362 6.044 0.000) 8.775 5.513 ( -16.307 -17.396 0.000) 23.844 5.726 ( -16.980 3.192 0.000) 17.278 6.044 ( 14.440 24.729 0.000) 28.637 6.559 ( 2.424 1.442 0.000) 2.820 6.752 ( 15.390 -13.497 0.000) 20.470 7.385 ( 8.520 -7.734 0.000) 11.506 7.448 ( 19.062 -0.900 0.000) 19.083 7.716 ( -7.610 -8.877 0.000) 11.692 7.900 ( -6.371 11.572 0.000) 13.210 8.580 ( -17.106 -19.875 0.000) 26.223 8.697 ( -8.138 0.127 0.000) 8.139 9.708 ( -25.159 4.370 0.000) 25.536 10.483 ( 12.813 7.273 0.000) 14.733 10.696 ( -3.345 -2.136 0.000) 3.969 10.901 ( -5.709 0.649 0.000) 5.746 11.283 ( 13.698 -2.130 0.000) 13.862 11.600 ( -5.019 3.886 0.000) 6.347 11.747 ( -3.703 -2.069 0.000) 4.242 11.807 ( -9.293 -4.196 0.000) 10.196 12.219 ( 3.381 1.942 0.000) 3.899 12.314 ( 20.080 1.184 0.000) 20.115 12.558 ( 0.753 -2.278 0.000) 2.399 13.077 ( -3.966 -1.480 0.000) 4.233 13.123 ( -4.792 -3.371 0.000) 5.859 13.326 ( -5.776 13.111 0.000) 14.326 13.598 ( 4.554 10.222 0.000) 11.190 13.764 ( -10.394 -11.595 0.000) 15.572 13.982 ( 4.699 -10.340 0.000) 11.357 14.436 ( 1.041 2.137 0.000) 2.377 14.521 ( 0.756 -1.899 0.000) 2.044 14.733 ( 1.054 -1.885 0.000) 2.159 14.966 ( -3.228 1.730 0.000) 3.663 15.031 ( -4.123 5.250 0.000) 6.676 15.546 ( 5.332 1.177 0.000) 5.461 15.724 ( -1.275 4.594 0.000) 4.768 15.788 ( -2.081 3.135 0.000) 3.763 15.983 ( 5.217 -4.139 0.000) 6.659 16.143 ( 0.437 1.070 0.000) 1.156 16.213 ( 0.148 -0.567 0.000) 0.586 16.310 ( 1.339 -0.047 0.000) 1.340 16.709 ( 4.100 1.592 0.000) 4.398 16.769 ( 10.724 -0.468 0.000) 10.734 17.171 ( 5.347 1.066 0.000) 5.452 17.512 ( -15.387 0.503 0.000) 15.395 17.976 ( -0.159 -6.124 0.000) 6.126 18.926 ( 12.684 1.787 0.000) 12.809 19.640 ( 0.714 6.390 0.000) 6.430 ======================= Grid point 32 (22/125) ======================= q-point: (-0.44 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 205 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.728 ( 3.419 -0.736 0.000) 3.498 2.175 ( 4.387 -1.626 0.000) 4.679 2.202 ( 1.969 0.870 0.000) 2.152 2.398 ( -5.375 4.996 0.000) 7.339 2.445 ( 0.875 10.477 0.000) 10.514 2.789 ( -1.895 0.510 0.000) 1.963 4.784 ( 11.501 1.847 0.000) 11.648 5.425 ( -19.099 -4.305 0.000) 19.578 5.710 ( -4.876 -17.936 0.000) 18.587 5.843 ( 11.404 23.475 0.000) 26.099 6.554 ( 0.812 1.551 0.000) 1.750 6.789 ( -12.726 17.700 0.000) 21.800 7.266 ( 11.023 3.508 0.000) 11.567 7.845 ( -2.339 -15.281 0.000) 15.459 7.969 ( 9.842 -0.575 0.000) 9.858 8.057 ( 13.622 -30.652 0.000) 33.543 8.617 ( -4.100 -0.438 0.000) 4.123 8.628 ( -10.198 -10.898 0.000) 14.925 9.436 ( -15.519 -7.921 0.000) 17.423 10.451 ( 6.194 13.061 0.000) 14.456 10.679 ( -2.486 -0.370 0.000) 2.513 10.839 ( -2.978 -0.923 0.000) 3.118 11.407 ( 5.588 8.632 0.000) 10.283 11.543 ( 1.823 -4.144 0.000) 4.527 11.709 ( -5.635 -2.093 0.000) 6.011 11.806 ( -4.536 -7.487 0.000) 8.754 12.193 ( 0.333 4.043 0.000) 4.057 12.537 ( 17.942 3.074 0.000) 18.204 12.628 ( 0.766 -5.237 0.000) 5.293 13.000 ( -10.600 13.239 0.000) 16.960 13.079 ( -2.213 -3.492 0.000) 4.135 13.151 ( -2.072 -6.137 0.000) 6.478 13.514 ( 2.773 7.931 0.000) 8.402 13.838 ( -5.187 -10.692 0.000) 11.884 14.146 ( 3.486 -3.388 0.000) 4.861 14.407 ( 0.563 3.127 0.000) 3.177 14.564 ( 0.168 -2.709 0.000) 2.714 14.787 ( 0.630 -3.357 0.000) 3.416 14.886 ( -3.123 5.448 0.000) 6.279 14.905 ( -1.423 1.724 0.000) 2.235 15.445 ( -2.843 13.562 0.000) 13.857 15.689 ( 0.337 -2.452 0.000) 2.475 15.734 ( 0.109 2.752 0.000) 2.754 16.118 ( 4.265 -3.877 0.000) 5.764 16.126 ( 0.290 1.733 0.000) 1.757 16.226 ( -0.113 -1.310 0.000) 1.315 16.319 ( 0.714 0.808 0.000) 1.079 16.725 ( 2.363 1.495 0.000) 2.797 16.896 ( 8.680 1.258 0.000) 8.770 17.194 ( 2.513 2.908 0.000) 3.844 17.318 ( -11.514 1.538 0.000) 11.616 18.075 ( -1.503 -7.572 0.000) 7.720 19.011 ( 6.501 3.882 0.000) 7.572 19.525 ( 1.214 9.671 0.000) 9.747 ======================= Grid point 33 (23/125) ======================= q-point: (-0.33 0.33 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 125 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.747 ( 0.000 1.144 0.000) 1.144 2.189 ( 0.000 7.530 0.000) 7.530 2.201 ( 0.000 12.767 0.000) 12.767 2.238 ( -0.000 -1.534 0.000) 1.534 2.281 ( 0.000 7.033 0.000) 7.033 2.797 ( -0.000 -2.282 0.000) 2.282 4.872 ( 0.000 0.209 0.000) 0.209 5.391 ( -0.000 -9.060 0.000) 9.060 5.584 ( 0.000 20.864 0.000) 20.864 5.988 ( -0.000 -22.972 0.000) 22.972 6.339 ( 0.000 23.103 0.000) 23.103 6.548 ( -0.000 -0.456 0.000) 0.456 7.306 ( 0.000 4.665 0.000) 4.665 7.939 ( 0.000 8.819 0.000) 8.819 8.089 ( -0.000 -16.743 0.000) 16.743 8.603 ( -0.000 -1.282 0.000) 1.282 8.690 ( -0.000 -35.069 0.000) 35.069 8.771 ( -0.000 -17.021 0.000) 17.021 9.519 ( -0.000 -13.546 0.000) 13.546 10.266 ( 0.000 15.109 0.000) 15.109 10.648 ( 0.000 1.574 0.000) 1.574 10.853 ( -0.000 -2.868 0.000) 2.868 11.227 ( 0.000 16.395 0.000) 16.395 11.655 ( -0.000 -3.544 0.000) 3.544 11.713 ( -0.000 -5.437 0.000) 5.437 11.898 ( -0.000 -6.299 0.000) 6.299 12.145 ( -0.000 -0.071 0.000) 0.071 12.577 ( 0.000 20.788 0.000) 20.788 12.731 ( -0.000 -7.035 0.000) 7.035 12.749 ( -0.000 -3.958 0.000) 3.958 13.133 ( -0.000 -5.042 0.000) 5.042 13.255 ( -0.000 -8.425 0.000) 8.425 13.397 ( 0.000 9.781 0.000) 9.781 13.956 ( -0.000 -9.103 0.000) 9.103 14.178 ( 0.000 1.981 0.000) 1.981 14.351 ( 0.000 5.199 0.000) 5.199 14.608 ( -0.000 -3.144 0.000) 3.144 14.809 ( 0.000 2.165 0.000) 2.165 14.826 ( -0.000 -0.098 0.000) 0.098 14.902 ( -0.000 -3.307 0.000) 3.307 15.179 ( 0.000 15.084 0.000) 15.084 15.662 ( 0.000 3.492 0.000) 3.492 15.783 ( -0.000 -5.844 0.000) 5.844 16.097 ( 0.000 2.301 0.000) 2.301 16.191 ( -0.000 -1.491 0.000) 1.491 16.253 ( -0.000 -2.086 0.000) 2.086 16.300 ( 0.000 2.134 0.000) 2.134 16.714 ( 0.000 2.711 0.000) 2.711 16.952 ( 0.000 1.014 0.000) 1.014 17.150 ( 0.000 4.725 0.000) 4.725 17.180 ( 0.000 3.381 0.000) 3.381 18.160 ( -0.000 -4.430 0.000) 4.430 18.978 ( 0.000 5.828 0.000) 5.828 19.381 ( 0.000 9.958 0.000) 9.958 ======================= Grid point 40 (24/125) ======================= q-point: ( 0.44 0.44 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 125 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.696 ( 4.417 0.000 0.000) 4.417 2.141 ( 5.044 0.000 0.000) 5.044 2.225 ( 0.346 0.000 0.000) 0.346 2.461 ( -2.290 -0.000 0.000) 2.290 2.609 ( 0.917 0.000 0.000) 0.917 2.816 ( -4.205 -0.000 0.000) 4.205 4.886 ( 7.566 0.000 0.000) 7.566 5.195 ( -8.581 -0.000 0.000) 8.581 5.530 ( -14.106 -0.000 0.000) 14.106 6.567 ( 3.701 0.000 0.000) 3.701 6.609 ( 1.958 0.000 0.000) 1.958 6.711 ( 26.050 0.000 0.000) 26.050 7.343 ( -13.657 -0.000 0.000) 13.657 7.555 ( -4.452 -0.000 0.000) 4.452 7.594 ( 6.229 0.000 0.000) 6.229 8.140 ( -9.075 -0.000 0.000) 9.075 8.184 ( 20.076 0.000 0.000) 20.076 8.612 ( -4.436 -0.000 0.000) 4.436 9.368 ( -27.463 -0.000 0.000) 27.463 10.657 ( -0.452 -0.000 0.000) 0.452 10.693 ( 8.506 0.000 0.000) 8.506 10.828 ( -4.888 -0.000 0.000) 4.888 11.406 ( 7.689 0.000 0.000) 7.689 11.546 ( -5.519 -0.000 0.000) 5.519 11.677 ( -4.904 -0.000 0.000) 4.904 11.712 ( -0.988 -0.000 0.000) 0.988 12.280 ( 2.185 0.000 0.000) 2.185 12.548 ( 0.345 0.000 0.000) 0.345 12.562 ( 14.920 0.000 0.000) 14.920 13.019 ( -2.435 -0.000 0.000) 2.435 13.043 ( -2.790 -0.000 0.000) 2.790 13.428 ( -12.649 -0.000 0.000) 12.649 13.479 ( -0.007 -0.000 0.000) 0.007 13.684 ( -1.983 -0.000 0.000) 1.983 14.027 ( 10.837 0.000 0.000) 10.837 14.452 ( -0.457 -0.000 0.000) 0.457 14.510 ( 0.321 0.000 0.000) 0.321 14.727 ( 0.394 0.000 0.000) 0.394 14.945 ( -1.884 -0.000 0.000) 1.884 14.989 ( -6.607 -0.000 0.000) 6.607 15.608 ( 3.229 0.000 0.000) 3.229 15.806 ( 0.974 0.000 0.000) 0.974 15.817 ( 1.359 0.000 0.000) 1.359 15.955 ( 0.789 0.000 0.000) 0.789 16.156 ( 0.215 0.000 0.000) 0.215 16.203 ( -0.400 -0.000 0.000) 0.400 16.329 ( 1.145 0.000 0.000) 1.145 16.753 ( 1.765 0.000 0.000) 1.765 16.904 ( 7.959 0.000 0.000) 7.959 17.238 ( 3.032 0.000 0.000) 3.032 17.349 ( -9.242 -0.000 0.000) 9.242 17.920 ( -0.817 -0.000 0.000) 0.817 19.070 ( 6.660 0.000 0.000) 6.660 19.693 ( 0.155 0.000 0.000) 0.155 ======================= Grid point 41 (25/125) ======================= q-point: (-0.44 -0.56 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 125 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.739 ( -0.000 -1.111 0.000) 1.111 2.183 ( -0.000 -1.120 0.000) 1.120 2.222 ( 0.000 0.526 0.000) 0.526 2.425 ( 0.000 2.505 0.000) 2.505 2.574 ( 0.000 5.348 0.000) 5.348 2.779 ( 0.000 0.651 0.000) 0.651 4.930 ( 0.000 2.192 0.000) 2.192 5.172 ( -0.000 -4.298 0.000) 4.298 5.486 ( -0.000 -8.342 0.000) 8.342 6.319 ( 0.000 24.996 0.000) 24.996 6.598 ( 0.000 2.583 0.000) 2.583 6.962 ( 0.000 13.708 0.000) 13.708 7.249 ( -0.000 -13.789 0.000) 13.789 7.614 ( -0.000 -10.763 0.000) 10.763 7.745 ( -0.000 -16.333 0.000) 16.333 8.085 ( 0.000 0.078 0.000) 0.078 8.434 ( -0.000 -5.637 0.000) 5.637 8.583 ( -0.000 -0.208 0.000) 0.208 9.178 ( -0.000 -5.949 0.000) 5.949 10.660 ( -0.000 -0.368 0.000) 0.368 10.676 ( 0.000 9.220 0.000) 9.220 10.798 ( -0.000 -0.814 0.000) 0.814 11.502 ( -0.000 -4.804 0.000) 4.804 11.509 ( 0.000 0.441 0.000) 0.441 11.670 ( 0.000 3.576 0.000) 3.576 11.678 ( -0.000 -4.364 0.000) 4.364 12.265 ( 0.000 3.544 0.000) 3.544 12.571 ( -0.000 -2.699 0.000) 2.699 12.681 ( -0.000 -0.859 0.000) 0.859 13.019 ( -0.000 -1.994 0.000) 1.994 13.054 ( -0.000 -3.845 0.000) 3.845 13.152 ( 0.000 15.861 0.000) 15.861 13.627 ( -0.000 -11.893 0.000) 11.893 13.630 ( 0.000 4.916 0.000) 4.916 14.134 ( -0.000 -2.956 0.000) 2.956 14.436 ( 0.000 1.320 0.000) 1.320 14.529 ( -0.000 -1.871 0.000) 1.871 14.746 ( -0.000 -2.119 0.000) 2.119 14.916 ( 0.000 2.641 0.000) 2.641 14.920 ( 0.000 1.384 0.000) 1.384 15.647 ( -0.000 -2.193 0.000) 2.193 15.664 ( 0.000 14.224 0.000) 14.224 15.797 ( 0.000 3.484 0.000) 3.484 16.057 ( -0.000 -7.307 0.000) 7.307 16.150 ( 0.000 0.971 0.000) 0.971 16.206 ( -0.000 -0.812 0.000) 0.812 16.335 ( 0.000 0.346 0.000) 0.346 16.760 ( 0.000 0.829 0.000) 0.829 16.963 ( -0.000 -0.332 0.000) 0.332 17.247 ( 0.000 1.518 0.000) 1.518 17.269 ( 0.000 1.943 0.000) 1.943 17.959 ( -0.000 -5.501 0.000) 5.501 19.100 ( 0.000 1.906 0.000) 1.906 19.651 ( 0.000 5.484 0.000) 5.484 ======================= Grid point 83 (26/125) ======================= q-point: ( 0.00 0.00 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.509 ( 0.000 0.000 26.695) 26.695 0.523 ( 0.000 0.000 27.221) 27.221 1.005 ( 0.000 0.000 49.838) 49.838 2.274 ( 0.000 0.000 -0.119) 0.119 2.532 ( 0.000 0.000 7.044) 7.044 2.905 ( 0.000 0.000 -7.079) 7.079 4.630 ( 0.000 0.000 9.438) 9.438 5.060 ( 0.000 0.000 -6.607) 6.607 5.098 ( 0.000 0.000 -1.673) 1.673 6.208 ( 0.000 0.000 15.384) 15.384 6.771 ( 0.000 0.000 -1.424) 1.424 6.833 ( 0.000 0.000 -3.270) 3.270 7.611 ( 0.000 0.000 22.114) 22.114 7.798 ( 0.000 0.000 3.683) 3.683 8.094 ( 0.000 0.000 -8.538) 8.538 9.329 ( 0.000 0.000 2.923) 2.923 9.461 ( 0.000 0.000 -14.742) 14.742 9.830 ( 0.000 0.000 0.785) 0.785 10.145 ( 0.000 0.000 -9.113) 9.113 10.221 ( 0.000 0.000 -2.386) 2.386 10.436 ( 0.000 0.000 8.399) 8.399 10.533 ( 0.000 0.000 -1.810) 1.810 10.606 ( 0.000 0.000 -3.198) 3.198 11.407 ( 0.000 0.000 9.879) 9.879 11.421 ( 0.000 0.000 -20.035) 20.035 12.112 ( 0.000 0.000 15.980) 15.980 12.446 ( 0.000 0.000 4.543) 4.543 12.529 ( 0.000 0.000 1.720) 1.720 13.082 ( 0.000 0.000 -3.027) 3.027 13.260 ( 0.000 0.000 -3.911) 3.911 13.274 ( 0.000 0.000 4.664) 4.664 13.313 ( 0.000 0.000 -13.882) 13.882 13.645 ( 0.000 0.000 -0.691) 0.691 13.895 ( 0.000 0.000 10.126) 10.126 13.995 ( 0.000 0.000 0.791) 0.791 14.112 ( 0.000 0.000 -10.569) 10.569 14.316 ( 0.000 0.000 -0.121) 0.121 14.393 ( 0.000 0.000 0.987) 0.987 14.458 ( 0.000 0.000 -5.475) 5.475 15.017 ( 0.000 0.000 0.548) 0.548 15.171 ( 0.000 0.000 2.177) 2.177 15.217 ( 0.000 0.000 -5.579) 5.579 15.808 ( 0.000 0.000 -13.628) 13.628 16.026 ( 0.000 0.000 -6.882) 6.882 16.033 ( 0.000 0.000 1.149) 1.149 16.204 ( 0.000 0.000 -1.214) 1.214 16.399 ( 0.000 0.000 14.048) 14.048 16.485 ( 0.000 0.000 6.231) 6.231 16.639 ( 0.000 0.000 2.399) 2.399 16.926 ( 0.000 0.000 0.747) 0.747 17.089 ( 0.000 0.000 1.345) 1.345 17.515 ( 0.000 0.000 -0.261) 0.261 18.913 ( 0.000 0.000 8.336) 8.336 20.005 ( 0.000 0.000 -2.176) 2.176 ======================= Grid point 84 (27/125) ======================= q-point: ( 0.11 0.00 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.686 ( 14.750 -9.696 16.526) 24.181 0.760 ( 11.271 -16.353 17.905) 26.740 1.370 ( 23.756 -16.182 34.313) 44.761 2.236 ( -1.842 2.483 -0.371) 3.114 2.532 ( -0.802 0.861 7.846) 7.934 2.880 ( -3.747 -0.673 -6.731) 7.734 4.731 ( 10.771 -2.922 8.292) 13.903 4.895 ( -2.802 2.626 -0.339) 3.855 5.338 ( -6.543 -14.170 -10.893) 19.033 6.212 ( 2.981 3.106 16.624) 17.173 6.803 ( 1.514 2.482 -7.739) 8.267 6.880 ( 0.105 -7.563 -5.069) 9.105 7.345 ( -17.887 13.948 12.417) 25.858 7.692 ( -7.722 -4.288 12.011) 14.909 8.307 ( 9.451 -5.504 -5.272) 12.141 9.203 ( -1.197 19.001 -5.505) 19.819 9.456 ( 3.508 -2.049 -2.525) 4.784 9.743 ( -14.527 2.724 1.569) 14.863 10.111 ( -6.053 -9.792 -6.800) 13.371 10.281 ( -4.796 -0.357 4.135) 6.342 10.465 ( -0.723 10.754 -2.202) 11.001 10.541 ( 15.425 -12.590 -7.007) 21.107 10.735 ( 7.087 -2.451 -0.216) 7.502 11.352 ( -2.961 3.815 8.501) 9.777 11.416 ( -0.068 0.053 -20.481) 20.481 12.110 ( 0.472 0.776 16.090) 16.116 12.207 ( -6.800 8.937 12.021) 16.451 12.501 ( 0.373 -6.305 4.697) 7.871 13.037 ( -9.031 -0.256 -5.538) 10.597 13.158 ( -1.513 8.841 -2.109) 9.215 13.295 ( 3.650 4.699 -9.515) 11.222 13.417 ( 2.593 -0.683 -8.400) 8.817 13.739 ( -4.926 4.832 5.309) 8.706 13.835 ( -0.868 3.586 6.431) 7.414 13.969 ( -3.301 -3.539 -5.456) 7.292 14.395 ( 0.858 -4.005 -1.295) 4.296 14.453 ( 0.354 -14.763 -5.519) 15.765 14.524 ( -0.963 -10.271 -4.108) 11.104 14.641 ( 27.546 -15.577 -27.254) 41.764 15.017 ( 2.426 1.938 0.785) 3.202 15.136 ( 3.471 6.643 -2.582) 7.928 15.220 ( 1.199 0.907 -1.427) 2.073 15.746 ( -5.476 0.468 -9.125) 10.652 15.862 ( -15.202 -4.107 -6.314) 16.965 16.049 ( -0.429 -2.503 -0.543) 2.597 16.350 ( 10.008 2.045 3.550) 10.814 16.441 ( 3.638 -0.434 12.823) 13.336 16.471 ( -1.285 -0.145 6.491) 6.619 16.697 ( 4.394 -2.231 0.820) 4.996 16.791 ( -12.216 -0.064 1.121) 12.267 17.260 ( 18.812 0.786 1.600) 18.896 17.595 ( 3.814 -6.857 -0.100) 7.847 18.871 ( -5.425 0.039 9.870) 11.263 19.607 ( -3.475 24.403 16.925) 29.901 ======================= Grid point 85 (28/125) ======================= q-point: ( 0.22 0.00 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.073 ( 14.366 -12.079 7.657) 20.271 1.212 ( 12.804 -19.025 11.444) 25.629 1.922 ( 23.756 -8.379 14.074) 28.855 2.174 ( -1.242 -0.017 2.613) 2.893 2.487 ( -0.627 3.158 8.988) 9.547 2.829 ( -5.819 -1.078 -4.465) 7.413 4.822 ( -5.285 1.351 -0.936) 5.534 4.953 ( 14.803 -0.515 5.601) 15.835 5.446 ( 0.889 -8.603 -6.197) 10.640 6.180 ( 2.604 6.136 18.940) 20.078 6.711 ( -7.380 4.845 -4.240) 9.794 6.917 ( -6.996 6.511 1.418) 9.661 7.113 ( -2.131 -16.679 -4.305) 17.357 7.679 ( -5.329 -4.417 16.524) 17.915 8.427 ( -0.329 -2.522 -2.514) 3.576 8.860 ( -2.782 18.432 -2.919) 18.868 9.288 ( -25.125 11.464 -0.519) 27.621 9.617 ( 3.951 -3.938 1.123) 5.691 10.097 ( -17.491 3.289 -2.544) 17.978 10.268 ( 5.701 9.296 2.581) 11.206 10.436 ( 9.109 -12.879 -6.858) 17.201 10.781 ( 5.428 5.990 -2.341) 8.416 10.937 ( 10.239 -14.254 -7.268) 18.996 11.234 ( -4.129 4.688 7.763) 9.965 11.439 ( 0.707 -2.241 -20.820) 20.952 12.053 ( -3.246 3.985 7.282) 8.913 12.109 ( 0.745 1.202 14.138) 14.209 12.630 ( -0.619 -9.628 4.176) 10.513 12.889 ( -1.856 7.938 -3.426) 8.843 13.016 ( -8.080 0.669 -5.620) 9.865 13.254 ( 4.122 6.546 -3.249) 8.390 13.418 ( -1.966 4.283 -3.557) 5.905 13.515 ( -10.851 2.572 4.602) 12.064 13.830 ( 4.810 2.215 2.362) 5.799 13.971 ( 5.057 4.013 -4.233) 7.720 14.425 ( 3.341 1.270 1.113) 3.744 14.592 ( -1.624 -7.216 -3.224) 8.069 14.747 ( -2.340 -12.843 -5.641) 14.221 14.965 ( 4.941 2.336 -3.592) 6.540 15.092 ( 3.204 3.686 -5.696) 7.503 15.156 ( 11.320 -9.263 -17.123) 22.520 15.220 ( 4.321 3.170 0.672) 5.401 15.721 ( -3.699 -3.347 -8.488) 9.845 15.752 ( -9.431 -3.813 -7.083) 12.396 16.099 ( -0.397 -4.643 -0.852) 4.738 16.409 ( 3.877 2.155 6.287) 7.694 16.441 ( -0.519 -0.032 5.097) 5.123 16.493 ( 3.623 1.847 13.802) 14.389 16.640 ( -9.591 -0.778 0.496) 9.635 16.803 ( 3.537 -2.948 1.500) 4.843 17.515 ( 20.033 -0.055 3.378) 20.316 17.808 ( 6.924 -10.346 -0.009) 12.449 18.789 ( -9.492 -2.532 9.084) 13.380 19.310 ( 1.364 15.092 8.906) 17.576 ======================= Grid point 86 (29/125) ======================= q-point: ( 0.33 0.00 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.384 ( 7.413 -7.871 2.945) 11.207 1.640 ( 9.982 -15.506 9.476) 20.733 2.063 ( 4.756 2.757 -0.166) 5.500 2.333 ( 5.205 -0.392 6.125) 8.047 2.458 ( 4.515 -0.756 11.642) 12.510 2.775 ( -3.948 -1.162 -0.084) 4.116 4.694 ( -7.617 3.438 1.854) 8.560 5.063 ( 7.625 5.383 2.077) 9.561 5.691 ( 10.132 -10.399 -6.253) 15.808 6.101 ( -0.772 2.664 17.807) 18.022 6.562 ( -4.066 0.967 6.682) 7.881 6.812 ( 1.457 3.180 -9.503) 10.126 7.482 ( 7.319 -23.911 -4.587) 25.423 7.665 ( -6.076 -2.481 17.294) 18.497 8.395 ( -6.693 -0.313 2.951) 7.322 8.610 ( 1.670 14.098 -3.135) 14.538 8.738 ( -27.261 8.992 1.307) 28.736 9.605 ( -14.536 22.442 -3.962) 27.031 9.755 ( 1.481 -3.213 2.039) 4.083 10.290 ( 0.353 -2.822 1.693) 3.310 10.722 ( 2.900 5.711 -4.239) 7.680 10.790 ( 13.053 -9.456 -7.277) 17.685 11.109 ( -2.652 4.170 7.200) 8.733 11.240 ( 3.421 -11.427 -5.593) 13.175 11.471 ( -0.274 -0.667 -19.099) 19.113 11.958 ( -2.728 3.214 3.312) 5.361 12.103 ( 0.528 0.883 11.236) 11.283 12.730 ( -3.099 -3.926 1.427) 5.201 12.794 ( 4.085 4.857 -1.058) 6.435 12.944 ( -4.196 -3.032 -4.773) 7.041 13.193 ( -10.977 -1.953 3.930) 11.821 13.251 ( 3.122 8.919 -5.800) 11.087 13.435 ( -1.894 1.807 4.669) 5.353 13.845 ( 5.322 5.283 -0.779) 7.540 14.007 ( 4.914 0.168 -3.524) 6.049 14.451 ( 2.901 0.878 1.730) 3.490 14.668 ( -0.878 -4.949 -2.216) 5.493 14.773 ( -4.480 -0.128 -4.594) 6.418 14.968 ( 1.135 3.483 -4.358) 5.693 15.146 ( 2.423 -3.840 -4.612) 6.472 15.223 ( 7.934 4.271 4.844) 10.230 15.390 ( 2.150 -6.515 -10.897) 12.877 15.662 ( -5.127 -1.526 -9.448) 10.857 15.793 ( 0.728 -3.894 -10.505) 11.227 16.180 ( -0.499 -6.415 1.010) 6.513 16.394 ( -1.409 1.037 4.794) 5.104 16.431 ( 0.890 2.800 7.772) 8.309 16.499 ( 5.289 4.392 4.273) 8.094 16.571 ( -6.556 -4.070 6.744) 10.248 16.883 ( 2.219 -2.257 0.398) 3.190 17.786 ( 18.735 -1.098 5.323) 19.507 18.058 ( 6.087 -9.077 0.674) 10.950 18.705 ( -11.910 -5.773 6.553) 14.769 19.113 ( 0.469 12.735 3.250) 13.152 ======================= Grid point 87 (30/125) ======================= q-point: ( 0.44 0.00 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.503 ( 1.120 -1.560 0.536) 1.994 1.932 ( 5.764 -7.354 2.753) 9.741 2.126 ( 1.989 -3.232 6.414) 7.452 2.267 ( -1.296 5.648 10.444) 11.944 2.535 ( 1.301 -0.320 3.363) 3.620 2.773 ( 0.533 -0.609 4.982) 5.047 4.560 ( -3.903 2.068 4.282) 6.152 5.050 ( 1.901 2.857 0.040) 3.432 5.828 ( 2.579 2.249 5.645) 6.601 6.195 ( 1.068 -8.482 -7.200) 11.177 6.557 ( 0.363 -1.525 11.690) 11.795 6.855 ( 8.822 0.731 -2.121) 9.103 7.549 ( -9.170 3.134 9.483) 13.559 7.960 ( 9.070 -17.137 -0.615) 19.399 8.290 ( -7.852 7.242 -0.056) 10.681 8.326 ( -4.802 -2.202 4.200) 6.749 8.577 ( -0.818 -3.169 1.871) 3.770 9.015 ( -12.360 23.853 -2.629) 26.994 9.832 ( 1.533 -1.687 2.028) 3.051 10.332 ( -0.490 -2.110 0.104) 2.169 10.666 ( 1.278 3.400 -3.799) 5.256 11.017 ( 0.570 0.500 2.933) 3.030 11.089 ( 6.819 -4.297 -2.709) 8.503 11.352 ( -4.454 -2.882 -7.591) 9.261 11.473 ( 1.632 0.026 -14.262) 14.355 11.891 ( -1.251 1.417 0.196) 1.900 12.097 ( 0.103 0.279 8.403) 8.408 12.710 ( 0.060 1.453 -0.894) 1.707 12.814 ( 1.840 -0.790 -0.096) 2.004 12.942 ( -0.492 1.799 -1.929) 2.683 13.109 ( -9.816 -7.784 -2.919) 12.863 13.213 ( 5.020 5.424 -1.550) 7.551 13.390 ( -0.645 1.300 7.275) 7.418 13.825 ( 2.311 3.046 -0.711) 3.889 14.061 ( 1.831 -0.505 -3.781) 4.232 14.470 ( 1.129 0.265 2.082) 2.384 14.712 ( -0.824 0.070 -3.856) 3.944 14.728 ( -0.817 -1.666 -3.045) 3.565 14.917 ( -0.634 2.185 -1.909) 2.970 15.194 ( 2.375 0.878 -5.863) 6.386 15.303 ( 5.266 -0.934 4.309) 6.868 15.418 ( -5.551 -2.144 0.625) 5.983 15.660 ( 0.768 -0.494 -17.704) 17.727 15.848 ( 0.646 -1.447 -10.410) 10.530 16.272 ( -1.265 -6.420 2.718) 7.086 16.342 ( 0.237 4.176 4.162) 5.900 16.408 ( 0.301 0.878 7.168) 7.228 16.499 ( 2.786 2.575 -1.034) 3.932 16.563 ( -2.770 -2.357 11.471) 12.034 16.927 ( 0.759 -0.842 -0.838) 1.409 18.022 ( 12.895 -0.551 7.392) 14.874 18.188 ( -2.354 -3.111 2.008) 4.388 18.688 ( -5.816 -7.723 3.633) 10.328 18.932 ( -0.026 9.576 0.705) 9.602 ======================= Grid point 93 (31/125) ======================= q-point: ( 0.11 0.11 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.853 ( 22.162 0.000 12.813) 25.600 0.889 ( 20.968 0.000 13.426) 24.899 1.666 ( 35.021 0.000 27.366) 44.445 2.241 ( -0.638 -0.000 -2.247) 2.336 2.537 ( 0.575 0.000 5.710) 5.739 2.777 ( -8.639 -0.000 -5.722) 10.362 4.862 ( -5.723 -0.000 0.280) 5.730 4.934 ( 21.752 0.000 7.081) 22.875 5.234 ( 9.671 0.000 -1.837) 9.844 6.278 ( 3.432 0.000 16.923) 17.268 6.769 ( -6.535 -0.000 -5.089) 8.283 6.852 ( -0.450 -0.000 -8.669) 8.680 7.160 ( -29.852 -0.000 2.989) 30.001 7.456 ( -9.594 -0.000 20.724) 22.837 8.383 ( 2.203 0.000 -4.868) 5.343 9.370 ( -8.732 -0.000 -10.618) 13.747 9.532 ( 11.802 0.000 3.748) 12.383 9.569 ( -17.275 -0.000 1.072) 17.308 9.947 ( 4.260 0.000 -9.634) 10.534 10.022 ( -20.138 -0.000 7.625) 21.533 10.687 ( 4.157 0.000 -1.856) 4.552 10.714 ( 5.096 0.000 -1.504) 5.313 10.742 ( 20.308 0.000 -5.915) 21.152 11.322 ( -5.668 -0.000 7.972) 9.782 11.419 ( 0.601 0.000 -21.357) 21.366 12.130 ( 1.476 0.000 16.177) 16.244 12.155 ( -8.526 -0.000 10.705) 13.685 12.456 ( 0.395 0.000 4.769) 4.786 12.807 ( -14.806 -0.000 -7.198) 16.463 13.306 ( 2.995 0.000 5.336) 6.119 13.391 ( -2.368 -0.000 -7.688) 8.044 13.408 ( 0.826 0.000 -3.026) 3.136 13.700 ( -7.410 -0.000 5.441) 9.193 13.957 ( 4.900 0.000 0.041) 4.901 14.018 ( 14.793 0.000 -7.645) 16.652 14.110 ( -5.675 -0.000 -8.977) 10.620 14.405 ( -3.363 -0.000 -2.072) 3.950 14.511 ( 6.266 0.000 2.200) 6.641 14.891 ( 21.539 0.000 -19.841) 29.285 15.071 ( 2.907 0.000 0.546) 2.958 15.189 ( -1.997 -0.000 -4.663) 5.073 15.322 ( 10.148 0.000 0.687) 10.171 15.653 ( -6.401 -0.000 -9.724) 11.642 15.677 ( -6.517 -0.000 -8.442) 10.665 16.023 ( -0.529 -0.000 -2.005) 2.074 16.432 ( -2.963 -0.000 3.975) 4.958 16.471 ( 4.377 0.000 9.943) 10.864 16.479 ( 0.937 0.000 12.940) 12.974 16.655 ( -6.688 -0.000 1.093) 6.776 16.751 ( 4.725 0.000 3.595) 5.937 17.550 ( 22.660 0.000 1.073) 22.685 17.606 ( 6.454 0.000 1.334) 6.590 18.754 ( -11.594 -0.000 7.977) 14.074 19.717 ( -7.450 -0.000 2.382) 7.822 ======================= Grid point 94 (32/125) ======================= q-point: ( 0.22 0.11 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.187 ( 17.986 -3.419 7.932) 19.953 1.229 ( 21.342 -8.263 9.342) 24.719 2.141 ( 17.219 -5.285 13.199) 22.330 2.227 ( 10.976 3.844 -0.696) 11.650 2.532 ( 0.777 2.122 5.678) 6.111 2.688 ( -8.058 -3.572 -3.543) 9.500 4.784 ( -4.297 1.985 0.417) 4.752 5.265 ( 27.360 2.210 4.376) 27.795 5.395 ( 8.236 -2.443 -3.637) 9.328 6.297 ( 2.701 4.215 18.031) 18.713 6.645 ( -16.328 3.504 -2.112) 16.833 6.800 ( -10.138 -8.731 -0.604) 13.393 6.886 ( -4.268 -5.329 -3.249) 7.562 7.389 ( -11.305 -7.536 18.847) 23.234 8.344 ( -8.723 -1.722 -2.018) 9.117 9.074 ( -16.596 12.948 -5.356) 21.720 9.226 ( -12.787 14.485 0.288) 19.324 9.653 ( 6.528 -0.264 0.921) 6.598 9.819 ( -14.107 -5.332 5.648) 16.104 10.271 ( 10.461 -17.538 -9.044) 22.334 10.505 ( -1.659 14.296 -0.409) 14.398 10.848 ( 0.827 -3.216 -2.949) 4.441 11.049 ( 20.357 -2.053 -7.253) 21.707 11.219 ( -6.036 2.439 6.473) 9.181 11.443 ( 2.610 -0.473 -21.321) 21.485 12.044 ( -5.333 1.992 6.892) 8.939 12.146 ( 1.969 1.267 15.305) 15.483 12.495 ( -2.630 -6.092 4.195) 7.850 12.660 ( -13.868 -5.318 -6.802) 16.336 13.203 ( 3.573 13.579 3.998) 14.599 13.334 ( -2.316 2.874 -2.789) 4.627 13.421 ( -1.906 -1.853 0.398) 2.688 13.524 ( -5.508 9.555 -0.044) 11.028 13.951 ( 5.049 1.203 -4.691) 6.996 14.125 ( 5.323 2.930 -3.553) 7.039 14.309 ( -4.608 -14.766 -7.372) 17.136 14.423 ( -0.319 -8.597 0.437) 8.614 14.594 ( 4.469 -1.159 1.871) 4.982 15.058 ( 1.416 2.675 -3.594) 4.699 15.137 ( 0.650 2.695 -3.172) 4.212 15.185 ( 8.586 -5.436 -8.218) 13.069 15.422 ( 10.290 4.091 -0.741) 11.099 15.617 ( -2.346 -0.752 -8.495) 8.845 15.678 ( 4.514 -2.293 -11.488) 12.554 16.034 ( -0.607 -2.528 -2.569) 3.655 16.390 ( -3.424 -0.127 3.366) 4.803 16.440 ( -7.154 -2.374 6.819) 10.164 16.510 ( 2.177 0.563 12.279) 12.483 16.622 ( 3.168 2.494 5.203) 6.582 16.815 ( 3.153 -1.614 2.621) 4.406 17.727 ( 10.010 -2.386 3.563) 10.890 17.878 ( 21.737 -1.965 1.047) 21.850 18.582 ( -15.561 -1.875 7.581) 17.410 19.553 ( -0.351 11.789 -0.660) 11.813 ======================= Grid point 95 (33/125) ======================= q-point: ( 0.33 0.11 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.433 ( 10.631 -2.661 3.569) 11.525 1.625 ( 16.475 -9.276 8.236) 20.623 2.143 ( 0.644 2.893 -0.097) 2.965 2.441 ( 5.945 3.455 4.290) 8.104 2.511 ( 2.026 0.731 5.903) 6.284 2.716 ( 3.839 -3.903 2.498) 6.018 4.669 ( -4.976 4.411 2.665) 7.164 5.345 ( 9.342 14.407 1.594) 17.244 5.710 ( 18.589 -10.015 -7.756) 22.495 6.157 ( -5.236 8.471 13.898) 17.098 6.496 ( -4.725 -2.821 9.058) 10.599 6.816 ( -1.719 -5.519 -8.605) 10.366 7.176 ( 5.485 -24.660 2.324) 25.369 7.375 ( -9.816 -9.510 16.184) 21.183 8.247 ( -10.708 -3.491 1.768) 11.400 8.541 ( -27.158 13.274 1.171) 30.251 8.930 ( 0.629 14.383 -1.580) 14.484 9.589 ( -19.283 1.982 -1.005) 19.411 9.811 ( 10.452 2.959 0.859) 10.897 10.241 ( -7.123 5.576 1.711) 9.206 10.691 ( 9.137 -13.043 -9.290) 18.436 10.855 ( 0.943 1.037 -3.735) 3.989 11.099 ( -4.989 2.226 5.840) 7.997 11.316 ( 15.068 0.220 -7.999) 17.061 11.491 ( 4.153 0.164 -17.745) 18.225 11.950 ( -4.282 1.634 3.438) 5.729 12.133 ( 0.222 2.312 11.162) 11.401 12.544 ( -13.741 -13.121 -2.021) 19.107 12.619 ( -2.266 -4.215 0.868) 4.863 13.069 ( 5.095 10.265 3.208) 11.900 13.211 ( -2.781 9.314 0.804) 9.754 13.359 ( -2.037 3.188 -4.490) 5.871 13.413 ( -2.236 -1.086 2.444) 3.486 14.016 ( 5.778 1.867 -4.587) 7.610 14.115 ( 3.904 5.449 -3.752) 7.682 14.379 ( -4.768 -6.729 0.478) 8.261 14.583 ( -2.727 -10.016 -2.984) 10.801 14.659 ( 2.174 -1.501 0.375) 2.668 14.995 ( -3.720 2.317 -4.513) 6.291 15.100 ( -0.808 1.036 -0.722) 1.499 15.344 ( 3.994 -2.911 -1.077) 5.059 15.488 ( 12.081 6.419 -0.687) 13.698 15.636 ( 2.433 -0.835 -11.867) 12.143 15.780 ( 5.107 -1.425 -9.782) 11.126 16.085 ( 0.134 -4.313 -0.639) 4.362 16.349 ( -4.322 -1.555 2.779) 5.368 16.397 ( -5.931 -3.389 3.223) 7.553 16.516 ( 1.797 2.183 12.186) 12.510 16.637 ( 5.054 2.832 5.432) 7.942 16.881 ( 2.365 -1.847 -0.775) 3.099 17.915 ( 7.879 -5.146 6.021) 11.172 18.168 ( 18.158 1.103 0.994) 18.219 18.426 ( -14.247 -6.196 6.635) 16.893 19.365 ( 2.442 14.331 -1.875) 14.658 ======================= Grid point 96 (34/125) ======================= q-point: ( 0.44 0.11 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.544 ( 4.831 0.905 0.651) 4.958 1.927 ( 9.437 -6.002 3.701) 11.780 2.134 ( 1.872 0.481 4.178) 4.604 2.372 ( 0.608 7.673 9.148) 11.955 2.528 ( -0.486 -0.761 2.068) 2.256 2.795 ( 2.285 0.809 4.484) 5.097 4.561 ( -0.928 2.507 4.561) 5.287 5.206 ( 3.225 12.450 -0.114) 12.862 5.887 ( -3.002 4.875 6.546) 8.696 6.169 ( 10.861 -8.259 -13.562) 19.238 6.516 ( -0.138 -2.546 11.359) 11.641 6.960 ( 7.050 -3.847 1.015) 8.095 7.229 ( -19.928 -4.786 15.902) 25.940 7.799 ( 15.352 -25.567 -3.656) 30.046 8.072 ( -16.122 -3.045 3.019) 16.682 8.239 ( -5.731 -4.560 6.454) 9.761 8.765 ( 3.447 10.576 0.271) 11.127 9.168 ( -15.772 17.575 -3.247) 23.836 9.898 ( 8.372 3.489 0.977) 9.122 10.155 ( -9.931 -7.690 1.794) 12.688 10.746 ( -0.985 4.292 -5.743) 7.237 10.969 ( -1.538 -3.342 -0.941) 3.797 11.070 ( 2.639 -3.699 1.020) 4.657 11.403 ( 3.586 2.315 -14.420) 15.038 11.572 ( 10.869 3.699 -8.492) 14.280 11.890 ( -1.408 0.729 -0.500) 1.663 12.098 ( -1.454 0.547 7.191) 7.356 12.532 ( -13.160 -9.244 -1.511) 16.154 12.714 ( -0.979 -9.412 1.314) 9.553 13.012 ( -0.202 5.181 -0.734) 5.237 13.037 ( 3.385 9.250 -0.255) 9.853 13.319 ( -1.624 -0.296 1.366) 2.143 13.424 ( 1.102 -1.670 1.500) 2.500 13.981 ( 5.197 11.811 -1.236) 12.963 14.105 ( 0.287 -0.095 -6.575) 6.582 14.408 ( -3.319 -3.504 3.860) 6.180 14.642 ( -3.511 -4.546 -2.352) 6.207 14.722 ( 3.083 -1.935 -2.363) 4.340 14.910 ( -4.253 1.323 -3.012) 5.377 15.068 ( -5.391 -1.922 0.296) 5.731 15.394 ( 1.463 1.018 0.483) 1.847 15.554 ( 13.132 6.796 0.607) 14.799 15.665 ( 0.420 0.039 -15.351) 15.357 15.850 ( 2.331 -1.216 -7.782) 8.214 16.163 ( 0.511 -4.935 3.344) 5.984 16.332 ( -2.730 -2.266 1.580) 3.885 16.373 ( -5.421 -2.759 3.977) 7.267 16.501 ( 3.809 3.902 8.519) 10.115 16.663 ( 4.715 2.517 4.512) 6.995 16.927 ( 1.297 -0.731 -3.602) 3.897 17.997 ( -8.175 -1.759 8.541) 11.953 18.254 ( 2.773 -1.396 0.938) 3.243 18.525 ( 9.029 -6.096 4.995) 11.985 19.181 ( 4.204 14.564 -1.621) 15.245 ======================= Grid point 97 (35/125) ======================= q-point: (-0.44 0.11 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.562 ( 3.192 3.483 -0.884) 4.806 1.980 ( -1.858 5.035 -2.234) 5.813 2.182 ( 0.689 3.905 9.462) 10.259 2.257 ( 1.440 2.767 10.665) 11.111 2.504 ( -3.762 0.629 4.379) 5.808 2.789 ( 0.856 0.563 3.606) 3.749 4.598 ( 6.629 -2.051 4.494) 8.267 5.080 ( 1.410 7.396 -1.076) 7.606 5.778 ( -3.593 1.541 6.155) 7.291 6.377 ( 6.775 3.498 -10.830) 13.245 6.552 ( 1.571 -1.153 12.039) 12.195 6.700 ( -20.205 6.715 -2.100) 21.395 7.332 ( -4.879 -17.758 17.781) 25.599 7.967 ( -5.165 0.429 -0.031) 5.182 8.297 ( 1.427 -6.025 6.378) 8.889 8.403 ( 14.808 -9.169 -9.324) 19.756 8.751 ( 6.773 1.315 6.429) 9.431 8.852 ( 3.038 -6.431 -2.208) 7.447 9.904 ( 4.368 6.720 2.004) 8.261 10.173 ( -10.542 -11.146 0.038) 15.341 10.658 ( -2.392 3.481 -5.215) 6.711 10.961 ( -3.073 -1.019 0.502) 3.277 11.064 ( -4.194 3.798 0.311) 5.667 11.446 ( 2.325 -1.775 -16.869) 17.120 11.618 ( 11.164 9.083 -5.452) 15.390 11.891 ( 1.827 0.071 -2.412) 3.027 12.084 ( -1.059 -0.798 7.267) 7.387 12.504 ( -11.048 -8.859 -0.179) 14.163 12.839 ( -1.446 -5.123 -4.152) 6.751 12.911 ( -1.922 -1.732 -1.698) 3.095 13.022 ( 4.086 3.809 2.089) 5.964 13.322 ( -0.574 -2.025 3.793) 4.338 13.488 ( 4.600 -1.225 -0.141) 4.762 13.841 ( 3.796 12.491 0.412) 13.061 14.089 ( -1.199 1.697 -5.887) 6.243 14.392 ( -4.588 -1.504 5.144) 7.054 14.676 ( -0.817 -3.978 -2.841) 4.956 14.772 ( 1.809 0.681 -2.890) 3.477 14.861 ( -3.416 -2.207 -2.356) 4.700 15.028 ( -5.796 -3.379 1.288) 6.831 15.347 ( -3.001 3.975 -0.335) 4.992 15.568 ( 0.658 5.105 -11.013) 12.156 15.697 ( 7.041 0.694 -4.779) 8.538 15.879 ( 2.557 1.443 -8.093) 8.609 16.252 ( 0.747 -5.401 7.165) 9.004 16.320 ( -3.168 1.264 0.647) 3.471 16.341 ( -3.647 -3.327 6.111) 7.856 16.506 ( 6.050 4.221 3.658) 8.234 16.679 ( 3.866 2.623 3.803) 6.024 16.934 ( 0.026 0.972 -4.666) 4.766 17.814 ( -17.357 0.547 7.140) 18.776 18.294 ( 0.677 2.727 1.081) 3.011 18.728 ( 8.195 -4.357 6.372) 11.258 19.057 ( 7.728 10.472 0.440) 13.023 ======================= Grid point 98 (36/125) ======================= q-point: (-0.33 0.11 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.484 ( -0.660 10.928 -1.594) 11.063 1.802 ( -3.291 14.693 7.220) 16.699 1.974 ( -9.329 5.370 1.687) 10.895 2.306 ( -0.457 0.144 6.839) 6.856 2.434 ( -1.505 1.481 13.556) 13.719 2.820 ( 2.368 -1.133 -1.142) 2.863 4.757 ( 8.961 -2.912 1.699) 9.574 5.003 ( -0.357 4.502 0.293) 4.526 5.718 ( -3.156 4.185 -1.864) 5.564 6.098 ( -9.910 9.102 17.118) 21.773 6.619 ( 7.338 -1.250 9.949) 12.425 6.694 ( -1.103 -10.675 -16.605) 19.771 7.451 ( -13.202 -13.322 18.723) 26.501 7.697 ( -7.371 16.434 -4.671) 18.607 8.437 ( 4.668 -5.177 4.375) 8.230 8.613 ( 8.479 0.274 -3.110) 9.036 8.935 ( 21.444 -9.497 -0.115) 23.453 9.405 ( 15.363 -28.296 -0.745) 32.206 9.822 ( 1.284 7.742 3.308) 8.517 10.188 ( -10.610 -8.484 -1.075) 13.627 10.590 ( -4.920 -1.074 -5.206) 7.243 10.781 ( -9.342 10.794 -5.574) 15.325 11.052 ( -0.143 -4.722 6.591) 8.109 11.426 ( -1.178 6.638 -14.439) 15.935 11.599 ( 9.646 11.859 -12.180) 19.546 11.931 ( 1.111 -3.107 1.516) 3.631 12.086 ( -0.465 -0.536 10.631) 10.655 12.534 ( -7.488 -11.539 -1.433) 13.830 12.862 ( 2.129 -1.694 -6.045) 6.629 12.969 ( 1.748 2.082 1.097) 2.931 13.025 ( -3.386 -6.025 0.084) 6.912 13.359 ( -0.038 -2.801 2.934) 4.056 13.573 ( 5.382 -0.867 -1.228) 5.588 13.752 ( 7.962 6.977 2.003) 10.774 14.019 ( -1.554 4.709 -3.876) 6.294 14.349 ( -5.598 -2.310 4.311) 7.434 14.740 ( -0.081 -4.442 -2.780) 5.241 14.757 ( 0.750 2.315 -1.743) 2.994 14.870 ( -3.340 -4.162 -2.871) 6.060 15.027 ( -3.916 -2.846 -1.240) 4.997 15.187 ( -10.877 3.189 -0.072) 11.335 15.460 ( -1.766 6.754 -15.543) 17.038 15.779 ( 4.198 0.192 -3.507) 5.474 15.894 ( 8.189 4.530 -7.034) 11.707 16.241 ( -2.881 3.042 0.691) 4.246 16.343 ( 0.671 -3.942 6.908) 7.982 16.348 ( -2.665 -3.081 6.817) 7.941 16.511 ( 3.950 4.181 3.716) 6.847 16.702 ( 6.074 2.241 1.737) 6.703 16.898 ( -0.914 2.735 -3.765) 4.742 17.552 ( -18.585 1.821 6.065) 19.634 18.164 ( -3.834 10.200 -0.365) 10.903 18.859 ( 5.253 -0.663 10.069) 11.377 19.070 ( 7.569 1.876 3.341) 8.484 ======================= Grid point 99 (37/125) ======================= q-point: (-0.22 0.11 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.203 ( -4.160 19.359 0.842) 19.819 1.417 ( -7.152 22.354 8.508) 24.965 1.817 ( -8.500 5.586 11.354) 15.244 2.223 ( -0.112 4.797 6.597) 8.158 2.457 ( 1.387 -2.408 12.442) 12.749 2.867 ( 1.273 -1.447 -4.862) 5.230 4.873 ( 3.195 0.983 -1.218) 3.558 4.895 ( -2.385 5.375 3.224) 6.706 5.558 ( -0.752 6.819 -5.923) 9.064 6.041 ( -3.123 -6.752 18.539) 19.976 6.777 ( 8.543 -0.819 -5.230) 10.050 6.865 ( 4.841 -9.843 3.767) 11.599 7.353 ( -3.607 7.882 -2.119) 8.923 7.497 ( -11.516 -7.709 11.395) 17.941 8.519 ( 3.294 3.012 0.103) 4.465 8.747 ( 5.678 -7.199 -1.192) 9.246 9.424 ( 19.436 -11.934 -2.298) 22.923 9.686 ( 2.725 6.392 3.251) 7.672 9.956 ( -0.660 -15.871 1.102) 15.923 10.208 ( 1.249 -10.733 -1.498) 10.909 10.457 ( -8.973 9.226 -5.566) 14.022 10.580 ( -6.861 -3.232 -3.638) 8.411 11.108 ( -1.152 3.759 -2.658) 4.745 11.246 ( 1.174 9.208 -1.827) 9.460 11.514 ( 1.847 7.807 -18.406) 20.079 12.014 ( 1.262 -4.961 5.338) 7.396 12.087 ( -0.438 -0.533 14.115) 14.131 12.661 ( -2.798 -11.922 -3.795) 12.820 12.834 ( 3.311 9.215 2.136) 10.022 13.034 ( 1.923 -7.701 -6.993) 10.578 13.069 ( -4.546 -6.939 -1.440) 8.419 13.394 ( -0.755 -2.062 0.330) 2.220 13.644 ( 0.178 -3.478 -2.169) 4.102 13.840 ( 9.729 4.260 2.653) 10.947 13.961 ( 9.460 2.141 -0.814) 9.733 14.327 ( -4.353 -3.372 2.648) 6.110 14.713 ( 0.861 5.024 -2.724) 5.779 14.784 ( -10.151 3.986 -4.442) 11.775 14.836 ( -8.908 -3.441 -2.298) 9.822 14.914 ( -3.905 -4.766 -0.967) 6.237 15.135 ( -1.398 -4.123 -1.529) 4.614 15.313 ( 0.234 11.641 -19.432) 22.653 15.794 ( 1.468 1.579 -5.393) 5.808 15.969 ( 10.825 3.362 -5.476) 12.589 16.157 ( -2.093 3.314 -1.041) 4.055 16.337 ( -1.664 0.740 0.963) 2.060 16.393 ( -2.714 -3.510 12.685) 13.438 16.490 ( 1.368 2.507 6.406) 7.014 16.769 ( 5.002 1.665 -2.969) 6.051 16.847 ( 4.065 3.411 0.470) 5.328 17.277 ( -17.230 2.232 4.860) 18.041 17.926 ( -3.565 12.716 -0.773) 13.229 18.899 ( 2.690 1.609 14.582) 14.915 19.163 ( 2.724 -4.327 8.300) 9.748 ======================= Grid point 100 (38/125) ======================= q-point: (-0.11 0.11 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.840 ( 0.000 20.725 7.354) 21.991 1.006 ( 0.000 22.725 12.441) 25.908 1.530 ( 0.000 20.078 28.405) 34.784 2.212 ( -0.000 -1.800 1.199) 2.163 2.511 ( -0.000 -2.793 11.030) 11.378 2.894 ( -0.000 -0.893 -6.437) 6.499 4.741 ( 0.000 6.836 6.936) 9.738 4.902 ( 0.000 0.441 -2.271) 2.314 5.517 ( 0.000 1.870 -12.744) 12.881 6.119 ( -0.000 -5.584 16.696) 17.605 6.811 ( 0.000 2.350 -5.636) 6.106 6.975 ( 0.000 3.082 -3.926) 4.991 7.331 ( -0.000 -3.362 14.585) 14.967 7.573 ( -0.000 -14.996 4.628) 15.693 8.426 ( 0.000 11.274 -1.919) 11.437 8.958 ( -0.000 -14.315 -4.888) 15.126 9.496 ( 0.000 6.089 -0.643) 6.123 9.887 ( 0.000 1.476 1.479) 2.090 9.983 ( -0.000 -17.681 2.856) 17.911 10.280 ( 0.000 4.744 -4.381) 6.457 10.510 ( -0.000 -0.253 -3.734) 3.743 10.529 ( -0.000 -9.873 -2.003) 10.074 10.817 ( 0.000 21.911 -8.892) 23.647 11.292 ( -0.000 -5.771 8.916) 10.620 11.436 ( 0.000 3.229 -20.290) 20.545 12.094 ( -0.000 -0.859 15.888) 15.911 12.112 ( -0.000 -6.664 8.547) 10.839 12.627 ( 0.000 9.459 3.797) 10.193 12.931 ( -0.000 -13.654 -7.282) 15.475 13.078 ( -0.000 -2.745 0.323) 2.764 13.223 ( -0.000 -9.413 -12.102) 15.332 13.398 ( 0.000 0.595 -3.790) 3.836 13.698 ( -0.000 -3.495 -0.079) 3.496 13.815 ( 0.000 1.369 2.884) 3.192 14.182 ( -0.000 -3.705 0.336) 3.720 14.313 ( -0.000 -0.573 -1.972) 2.054 14.458 ( 0.000 9.621 -2.888) 10.045 14.633 ( 0.000 7.103 -3.793) 8.053 14.877 ( 0.000 2.827 -10.070) 10.459 14.959 ( -0.000 -3.422 -0.134) 3.424 15.092 ( 0.000 12.422 -19.379) 23.019 15.187 ( -0.000 -2.653 -2.253) 3.481 15.785 ( 0.000 1.042 -6.571) 6.653 16.041 ( 0.000 0.272 -6.091) 6.097 16.088 ( 0.000 2.859 0.030) 2.859 16.272 ( 0.000 4.042 -2.018) 4.518 16.404 ( -0.000 -1.356 14.112) 14.177 16.480 ( 0.000 0.147 7.211) 7.213 16.722 ( 0.000 4.233 -2.068) 4.711 16.929 ( 0.000 0.159 0.637) 0.656 17.080 ( 0.000 1.189 3.832) 4.012 17.711 ( 0.000 11.147 -0.569) 11.162 18.901 ( 0.000 0.233 16.086) 16.087 19.298 ( -0.000 -13.069 19.243) 23.262 ======================= Grid point 103 (39/125) ======================= q-point: ( 0.22 0.22 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.379 ( 13.259 0.000 5.112) 14.211 1.470 ( 22.091 0.000 8.219) 23.570 2.196 ( 0.979 0.000 1.032) 1.422 2.537 ( 22.920 0.000 4.897) 23.438 2.548 ( -4.262 -0.000 -1.984) 4.701 2.573 ( 0.177 0.000 3.878) 3.882 4.759 ( -2.408 -0.000 1.249) 2.713 5.490 ( 12.973 0.000 -7.545) 15.008 5.768 ( 32.935 0.000 3.639) 33.135 6.367 ( 1.296 0.000 16.392) 16.443 6.405 ( -23.431 -0.000 8.708) 24.997 6.493 ( -11.128 -0.000 -6.291) 12.783 6.792 ( -3.647 -0.000 8.047) 8.835 7.259 ( -2.133 -0.000 10.683) 10.894 8.167 ( -14.096 -0.000 -1.300) 14.156 8.997 ( -17.022 -0.000 -7.523) 18.610 9.023 ( -22.668 -0.000 0.483) 22.673 9.441 ( -21.078 -0.000 11.649) 24.082 9.947 ( 16.668 0.000 5.002) 17.403 10.333 ( 19.880 0.000 -14.516) 24.616 10.576 ( -11.189 -0.000 -0.830) 11.220 10.771 ( -1.020 -0.000 -3.977) 4.105 11.155 ( -6.201 -0.000 4.621) 7.733 11.318 ( 19.713 0.000 -10.573) 22.369 11.490 ( 5.525 0.000 -19.174) 19.954 11.978 ( -6.351 -0.000 6.099) 8.805 12.188 ( 1.170 0.000 13.012) 13.064 12.320 ( -12.613 -0.000 -0.260) 12.615 12.538 ( -0.925 -0.000 0.008) 0.925 13.294 ( -4.666 -0.000 -4.397) 6.411 13.308 ( -5.182 -0.000 2.352) 5.691 13.462 ( 6.804 0.000 5.722) 8.890 13.542 ( -4.184 -0.000 1.410) 4.415 13.917 ( -7.479 -0.000 -6.445) 9.872 14.013 ( -4.239 -0.000 -11.326) 12.093 14.347 ( 8.931 0.000 -2.805) 9.361 14.394 ( 4.689 0.000 7.287) 8.665 14.639 ( 2.791 0.000 1.191) 3.034 15.043 ( -4.924 -0.000 -6.185) 7.906 15.169 ( 0.359 0.000 1.119) 1.175 15.276 ( 9.287 0.000 -2.115) 9.524 15.552 ( 8.053 0.000 -10.222) 13.013 15.615 ( 2.647 0.000 -1.802) 3.202 15.840 ( 16.483 0.000 -9.770) 19.161 15.998 ( -1.736 -0.000 -3.735) 4.118 16.300 ( -8.652 -0.000 5.879) 10.461 16.350 ( -2.924 -0.000 1.729) 3.397 16.542 ( 1.592 0.000 13.274) 13.369 16.687 ( 3.155 0.000 6.539) 7.261 16.844 ( 3.422 0.000 -2.412) 4.187 17.818 ( 8.252 0.000 4.941) 9.618 18.187 ( 23.832 0.000 1.626) 23.887 18.334 ( -18.756 -0.000 7.537) 20.214 19.632 ( -0.683 -0.000 -4.915) 4.963 ======================= Grid point 104 (40/125) ======================= q-point: ( 0.33 0.22 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.527 ( 7.030 -1.565 2.625) 7.666 1.767 ( 17.715 -2.910 7.317) 19.386 2.188 ( 0.743 1.932 0.788) 2.215 2.506 ( -0.545 -0.099 -0.255) 0.610 2.562 ( 1.921 3.755 4.792) 6.384 2.789 ( 10.134 -1.161 1.518) 10.313 4.698 ( -1.516 4.596 2.618) 5.503 5.631 ( 6.775 1.862 -8.865) 11.312 5.870 ( -0.502 11.183 -3.423) 11.706 6.229 ( 0.152 7.495 9.778) 12.321 6.369 ( 2.839 -7.298 13.011) 15.185 6.634 ( 2.460 -10.527 4.586) 11.743 6.902 ( 7.465 -20.918 10.422) 24.534 7.277 ( 3.137 -0.342 5.459) 6.305 8.016 ( -13.150 -4.987 0.558) 14.075 8.442 ( -24.576 18.695 1.011) 30.895 8.926 ( -12.627 -4.303 -2.526) 13.577 9.236 ( -20.540 -8.164 7.822) 23.446 10.100 ( 16.056 7.820 2.465) 18.029 10.258 ( -13.926 11.239 -0.765) 17.912 10.688 ( 14.980 -7.534 -13.092) 21.274 10.795 ( -3.040 -5.032 -3.882) 7.045 11.062 ( -5.147 1.388 3.283) 6.261 11.473 ( 4.398 1.246 -18.504) 19.060 11.646 ( 17.660 1.212 -9.455) 20.068 11.892 ( -5.857 -0.358 3.813) 6.998 12.099 ( -12.290 -1.986 -1.529) 12.543 12.286 ( 0.289 -2.300 10.512) 10.764 12.559 ( 0.436 -2.304 1.723) 2.910 13.202 ( -4.105 3.978 1.103) 5.822 13.240 ( -4.758 -1.235 -2.768) 5.642 13.404 ( -4.067 8.368 -2.355) 9.598 13.464 ( 5.720 8.336 5.541) 11.528 13.913 ( -6.644 -8.748 -9.184) 14.318 14.061 ( -4.862 -11.614 -2.205) 12.782 14.389 ( 6.722 4.883 2.946) 8.815 14.501 ( 3.585 -2.906 3.352) 5.704 14.673 ( 1.596 -0.956 -0.461) 1.917 14.964 ( -4.642 1.631 -6.793) 8.388 15.136 ( -0.689 3.827 1.670) 4.232 15.395 ( 7.042 -0.596 0.665) 7.099 15.650 ( 5.520 0.666 -7.221) 9.114 15.696 ( 8.275 -1.330 -3.386) 9.039 15.897 ( 1.031 6.116 -3.202) 6.980 16.082 ( 8.265 -1.293 -3.587) 9.102 16.230 ( -4.370 -3.157 4.295) 6.893 16.323 ( -2.353 -1.031 0.677) 2.657 16.561 ( 2.121 0.309 10.231) 10.453 16.715 ( 2.447 0.851 5.392) 5.982 16.902 ( 4.024 -0.566 -7.375) 8.421 17.933 ( 3.412 -1.745 7.272) 8.221 18.107 ( -16.521 -4.127 5.474) 17.887 18.488 ( 21.432 0.677 2.908) 21.639 19.566 ( 1.082 7.935 -4.909) 9.393 ======================= Grid point 105 (41/125) ======================= q-point: ( 0.44 0.22 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.618 ( 4.502 -0.424 0.752) 4.584 1.997 ( 9.558 -1.667 1.585) 9.831 2.183 ( 3.505 1.031 5.704) 6.774 2.494 ( -0.474 4.964 4.501) 6.718 2.518 ( 0.931 1.685 3.581) 4.066 2.839 ( -0.013 2.092 1.325) 2.476 4.621 ( 2.610 4.020 4.287) 6.430 5.504 ( 3.756 18.636 -2.151) 19.132 5.845 ( -5.146 -10.004 -4.604) 12.156 6.040 ( -12.850 -0.284 0.250) 12.856 6.605 ( 12.282 2.530 11.105) 16.750 6.823 ( 7.810 -13.860 15.623) 22.298 7.226 ( -1.827 13.073 3.985) 13.788 7.556 ( 17.519 -31.124 1.341) 35.741 7.895 ( -11.645 2.593 -0.343) 11.935 8.038 ( -8.444 -7.517 5.471) 12.559 8.818 ( -6.925 0.636 1.877) 7.203 9.067 ( -19.097 -1.598 0.699) 19.177 9.911 ( -15.689 1.511 0.554) 15.771 10.187 ( 13.973 10.221 1.811) 17.407 10.744 ( -4.638 -0.292 -5.666) 7.328 10.928 ( -0.073 -0.325 -2.082) 2.108 11.064 ( 6.420 -4.559 -4.435) 9.038 11.458 ( -0.320 2.977 -15.727) 16.010 11.760 ( 1.459 1.942 -1.193) 2.706 11.922 ( 9.866 -0.470 -7.016) 12.116 12.005 ( -8.241 -4.604 -3.440) 10.047 12.314 ( -0.897 -1.206 9.046) 9.170 12.619 ( 0.936 -4.531 1.736) 4.942 13.086 ( -3.268 6.427 -3.438) 7.988 13.180 ( -2.687 4.270 -2.419) 5.595 13.251 ( -5.091 -1.467 -0.245) 5.304 13.435 ( 4.279 3.926 5.309) 7.869 13.957 ( -7.148 -8.605 -8.039) 13.776 14.152 ( 0.038 -2.569 0.416) 2.602 14.403 ( 5.169 3.487 5.715) 8.457 14.565 ( 0.488 -2.352 2.172) 3.238 14.721 ( 1.889 -2.333 -2.452) 3.876 14.875 ( -3.671 2.362 -4.954) 6.603 15.042 ( -3.089 4.431 2.129) 5.806 15.456 ( 3.243 2.988 -0.301) 4.420 15.675 ( -0.050 1.227 -7.234) 7.338 15.775 ( 2.909 5.571 1.084) 6.377 15.867 ( 6.024 -2.239 -3.209) 7.184 16.146 ( 1.410 -0.981 1.890) 2.554 16.267 ( 1.441 -1.588 3.959) 4.502 16.316 ( -1.320 -0.941 0.114) 1.625 16.604 ( 5.962 1.234 3.549) 7.047 16.731 ( 2.131 0.817 4.040) 4.640 16.953 ( 3.212 0.481 -10.244) 10.746 17.814 ( -16.205 -0.252 8.086) 18.112 18.152 ( 0.440 -8.247 4.256) 9.291 18.727 ( 17.161 2.017 3.995) 17.735 19.438 ( 2.994 11.498 -3.313) 12.335 ======================= Grid point 106 (42/125) ======================= q-point: (-0.44 0.22 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.662 ( 4.036 2.173 -1.004) 4.693 2.045 ( 1.558 3.806 -5.373) 6.766 2.250 ( 4.540 0.725 10.532) 11.492 2.355 ( -3.744 9.121 5.163) 11.129 2.480 ( -1.399 2.121 7.926) 8.323 2.796 ( -1.219 0.316 0.877) 1.534 4.681 ( 9.562 -0.811 4.865) 10.759 5.288 ( 2.143 13.361 -4.795) 14.357 5.792 ( -1.463 5.849 11.800) 13.251 6.102 ( -11.275 -23.297 -12.099) 28.571 6.601 ( -9.114 7.397 6.411) 13.375 6.789 ( -3.518 19.745 10.429) 22.606 7.130 ( 7.666 -7.411 13.519) 17.217 7.916 ( 2.225 -3.652 -1.131) 4.423 8.136 ( -1.346 -13.755 3.376) 14.227 8.314 ( 18.836 -28.457 -1.343) 34.153 8.747 ( -2.675 -1.896 5.794) 6.657 8.836 ( -7.617 1.180 -1.694) 7.892 9.803 ( -14.971 -12.132 0.797) 19.286 10.163 ( 9.324 12.900 1.966) 16.038 10.660 ( -4.954 2.506 -6.530) 8.571 10.914 ( -1.470 -1.652 2.319) 3.205 11.121 ( 0.472 6.964 -6.309) 9.409 11.443 ( 1.047 -1.533 -15.465) 15.576 11.752 ( -0.217 -1.678 0.732) 1.843 11.986 ( -5.044 -6.831 -1.791) 8.678 12.064 ( 11.943 6.039 -11.747) 17.807 12.304 ( -1.537 -0.201 7.821) 7.973 12.723 ( 0.644 -6.735 -0.025) 6.766 12.900 ( -6.553 5.492 -5.039) 9.924 13.135 ( 1.119 1.128 -0.585) 1.693 13.259 ( -1.905 -4.142 1.362) 4.758 13.440 ( 0.167 0.081 3.491) 3.496 13.990 ( -5.448 -6.656 -6.538) 10.804 14.144 ( 6.251 7.816 1.393) 10.104 14.392 ( 1.590 4.519 8.481) 9.740 14.608 ( -0.087 -3.194 -0.484) 3.231 14.782 ( 1.368 -1.848 -3.181) 3.925 14.800 ( -2.916 1.277 -2.484) 4.038 14.953 ( -3.153 0.229 1.565) 3.528 15.347 ( -7.486 7.287 -2.075) 10.651 15.619 ( -0.692 3.922 -7.281) 8.299 15.762 ( 1.286 -0.181 1.776) 2.201 15.988 ( 9.025 0.986 -4.133) 9.975 16.195 ( 0.621 -3.652 6.631) 7.596 16.298 ( 0.907 0.301 4.718) 4.814 16.302 ( -1.506 -0.548 -1.119) 1.955 16.650 ( 4.967 3.305 0.758) 6.014 16.759 ( 5.137 1.345 1.547) 5.531 16.966 ( 1.402 1.838 -10.630) 10.879 17.595 ( -16.097 0.612 7.704) 17.856 18.252 ( -2.050 -4.750 3.151) 6.057 18.877 ( 11.477 3.201 5.650) 13.187 19.312 ( 4.774 10.779 -0.593) 11.804 ======================= Grid point 107 (43/125) ======================= q-point: (-0.33 0.22 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.646 ( 2.377 6.425 -3.676) 7.775 1.948 ( -0.047 8.681 -0.928) 8.731 2.044 ( -7.166 16.337 3.306) 18.143 2.306 ( 0.463 -0.332 8.051) 8.071 2.458 ( 1.267 1.412 15.063) 15.182 2.805 ( -0.211 -2.159 -2.568) 3.362 4.839 ( 8.418 -1.387 2.721) 8.955 5.149 ( 2.378 9.322 -4.665) 10.692 5.753 ( 3.361 0.634 10.816) 11.344 6.098 ( -17.904 15.538 3.464) 23.958 6.358 ( -4.803 -21.690 -6.085) 23.034 6.745 ( 5.689 0.953 14.355) 15.471 7.231 ( -0.726 0.030 8.714) 8.744 7.815 ( -5.035 10.641 -1.895) 11.924 8.346 ( 1.715 -12.399 3.656) 13.040 8.654 ( 0.820 -2.230 0.434) 2.415 8.965 ( 8.424 -14.235 -1.206) 16.585 9.146 ( 15.372 -31.913 2.622) 35.520 9.820 ( -13.981 -13.215 -1.038) 19.266 10.044 ( 4.204 13.763 3.535) 14.819 10.554 ( -3.834 2.924 -8.162) 9.480 10.892 ( -1.629 11.816 -6.350) 13.513 10.976 ( -2.072 -2.064 4.698) 5.534 11.465 ( 0.063 1.039 -16.531) 16.564 11.820 ( 2.664 -4.157 2.321) 5.455 12.004 ( 2.612 9.090 -10.355) 14.024 12.069 ( 1.794 0.762 -0.737) 2.084 12.297 ( -3.139 -4.700 4.489) 7.217 12.786 ( -2.358 -4.954 -6.231) 8.302 12.869 ( -0.681 -6.322 1.852) 6.623 13.130 ( 2.451 4.007 -1.451) 4.916 13.313 ( 1.633 -2.158 4.302) 5.083 13.434 ( -5.366 -5.354 -0.059) 7.581 14.015 ( -2.550 -2.641 -5.243) 6.400 14.124 ( 12.219 8.976 2.529) 15.371 14.310 ( -1.505 5.263 8.151) 9.819 14.656 ( -0.947 -3.790 -1.574) 4.212 14.770 ( -1.305 -1.047 -1.400) 2.182 14.805 ( 0.291 -0.452 -2.034) 2.104 14.965 ( -0.430 -2.671 -0.972) 2.875 15.073 ( -13.181 7.607 -1.829) 15.328 15.546 ( 0.272 5.204 -8.496) 9.966 15.787 ( 0.342 -1.289 -1.758) 2.207 16.076 ( 8.638 2.598 -2.972) 9.497 16.242 ( -3.533 1.197 0.198) 3.736 16.259 ( -0.260 -2.636 7.657) 8.102 16.331 ( 0.570 -1.408 3.154) 3.500 16.635 ( 2.623 4.754 0.987) 5.518 16.822 ( 7.450 1.879 -2.672) 8.135 16.938 ( -0.110 2.435 -7.274) 7.671 17.370 ( -13.033 2.970 7.889) 15.521 18.225 ( -3.100 3.599 1.186) 4.896 18.941 ( 5.150 2.632 8.691) 10.440 19.236 ( 4.092 7.116 2.332) 8.533 ======================= Grid point 108 (44/125) ======================= q-point: (-0.22 0.22 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.482 ( 0.000 16.861 -4.974) 17.580 1.696 ( 0.000 20.465 4.681) 20.994 1.841 ( 0.000 4.248 6.782) 8.002 2.293 ( 0.000 3.092 7.851) 8.438 2.450 ( 0.000 0.315 15.341) 15.345 2.842 ( -0.000 -2.387 -4.822) 5.381 4.906 ( -0.000 -0.429 -0.767) 0.879 5.018 ( 0.000 10.152 -0.298) 10.156 5.691 ( 0.000 12.772 -3.881) 13.349 5.900 ( -0.000 -7.324 18.877) 20.248 6.672 ( -0.000 -19.430 -10.814) 22.236 6.827 ( -0.000 -4.723 15.841) 16.530 7.175 ( -0.000 -0.124 6.439) 6.441 7.599 ( 0.000 12.017 -0.623) 12.033 8.517 ( -0.000 -6.356 2.041) 6.676 8.698 ( -0.000 -3.850 0.925) 3.960 9.319 ( -0.000 -19.294 -0.818) 19.312 9.799 ( -0.000 -27.218 -0.230) 27.219 9.823 ( -0.000 -5.906 -1.900) 6.204 9.870 ( 0.000 7.550 4.612) 8.847 10.481 ( 0.000 3.114 -8.773) 9.309 10.647 ( 0.000 13.401 -4.097) 14.014 11.046 ( -0.000 -5.789 5.614) 8.064 11.408 ( 0.000 6.597 -15.610) 16.946 11.757 ( 0.000 19.151 -16.179) 25.071 11.934 ( -0.000 -6.023 4.026) 7.245 12.081 ( -0.000 -0.080 12.581) 12.581 12.426 ( -0.000 -13.737 -3.428) 14.158 12.893 ( -0.000 -9.483 -6.633) 11.573 12.956 ( -0.000 -5.276 1.299) 5.434 13.032 ( 0.000 10.731 0.551) 10.745 13.349 ( -0.000 -2.316 4.156) 4.758 13.519 ( -0.000 -8.889 -2.937) 9.362 13.973 ( 0.000 5.668 -2.353) 6.137 14.186 ( 0.000 5.600 4.254) 7.033 14.218 ( -0.000 -2.837 2.658) 3.887 14.714 ( -0.000 -4.975 -1.953) 5.345 14.767 ( 0.000 1.333 -1.553) 2.046 14.779 ( 0.000 10.656 -2.339) 10.910 14.833 ( -0.000 -3.303 -1.103) 3.482 15.053 ( -0.000 -5.131 -2.028) 5.518 15.457 ( 0.000 7.024 -12.788) 14.590 15.806 ( -0.000 -0.680 -3.154) 3.226 16.113 ( 0.000 4.285 -5.756) 7.176 16.162 ( 0.000 1.570 -0.844) 1.782 16.308 ( -0.000 -3.846 12.129) 12.724 16.348 ( -0.000 -0.290 1.323) 1.355 16.571 ( 0.000 5.670 3.037) 6.432 16.839 ( 0.000 3.304 -8.647) 9.257 16.931 ( -0.000 -0.045 0.027) 0.053 17.195 ( 0.000 5.131 8.271) 9.733 18.086 ( 0.000 10.514 -0.171) 10.516 18.940 ( 0.000 1.616 13.471) 13.568 19.186 ( 0.000 2.994 4.244) 5.194 ======================= Grid point 113 (45/125) ======================= q-point: ( 0.33 0.33 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.585 ( 4.577 0.000 2.332) 5.137 1.966 ( 14.069 0.000 6.439) 15.473 2.218 ( 1.462 0.000 2.214) 2.653 2.502 ( -0.022 -0.000 0.004) 0.022 2.619 ( 2.007 0.000 4.659) 5.073 2.871 ( 2.098 0.000 -1.731) 2.720 4.749 ( 2.626 0.000 1.931) 3.259 5.506 ( -14.553 -0.000 -9.719) 17.499 6.020 ( -19.409 -0.000 2.148) 19.528 6.149 ( 14.679 0.000 6.807) 16.181 6.523 ( 6.613 0.000 9.588) 11.647 6.764 ( 1.763 0.000 20.172) 20.249 6.821 ( 36.856 0.000 2.362) 36.931 7.357 ( 7.850 0.000 0.532) 7.868 7.790 ( -12.809 -0.000 -0.321) 12.813 8.403 ( -22.227 -0.000 2.263) 22.342 8.533 ( -16.817 -0.000 -0.379) 16.821 8.946 ( -14.831 -0.000 9.297) 17.504 10.091 ( -23.540 -0.000 -0.864) 23.556 10.391 ( 15.831 0.000 4.889) 16.569 10.687 ( -4.122 -0.000 -3.922) 5.690 10.872 ( 17.885 0.000 -17.087) 24.735 10.995 ( -6.117 -0.000 1.610) 6.325 11.520 ( 1.450 0.000 -19.425) 19.479 11.788 ( -7.861 -0.000 4.728) 9.173 11.870 ( -6.880 -0.000 -5.528) 8.826 11.936 ( 13.238 0.000 -9.335) 16.199 12.331 ( 4.641 0.000 11.871) 12.746 12.553 ( 1.067 0.000 1.996) 2.264 13.146 ( -5.894 -0.000 -2.673) 6.471 13.151 ( -5.808 -0.000 2.074) 6.167 13.474 ( -1.187 -0.000 -1.193) 1.683 13.564 ( -5.998 -0.000 -9.407) 11.157 13.747 ( -4.961 -0.000 -3.854) 6.283 13.929 ( 6.173 0.000 9.354) 11.207 14.494 ( 2.526 0.000 0.564) 2.588 14.514 ( 1.908 0.000 6.939) 7.197 14.679 ( 0.924 0.000 -1.869) 2.085 14.928 ( -2.871 -0.000 -7.717) 8.234 15.161 ( -1.742 -0.000 2.752) 3.257 15.494 ( 7.715 0.000 2.067) 7.987 15.748 ( 5.632 0.000 2.243) 6.062 15.769 ( 6.790 0.000 -9.312) 11.525 15.900 ( -4.602 -0.000 1.327) 4.790 16.150 ( -2.142 -0.000 0.579) 2.219 16.236 ( 7.475 0.000 1.525) 7.629 16.292 ( 0.044 0.000 -0.332) 0.335 16.609 ( 6.359 0.000 3.410) 7.216 16.740 ( 0.907 0.000 4.013) 4.114 16.963 ( 5.083 0.000 -11.884) 12.925 17.817 ( -18.530 -0.000 7.090) 19.840 17.986 ( 3.620 0.000 7.245) 8.099 18.762 ( 18.106 0.000 2.846) 18.328 19.637 ( 0.766 0.000 -5.087) 5.145 ======================= Grid point 114 (46/125) ======================= q-point: ( 0.44 0.33 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.659 ( 4.601 -1.293 1.433) 4.989 2.105 ( 6.336 0.830 0.067) 6.391 2.247 ( 4.353 0.099 8.422) 9.481 2.490 ( -2.054 0.585 0.514) 2.197 2.613 ( 1.726 3.950 5.588) 7.057 2.841 ( -3.936 1.435 -1.675) 4.512 4.759 ( 7.109 5.251 3.343) 9.449 5.445 ( -13.036 -15.682 -6.513) 21.407 5.687 ( -15.295 8.369 -1.686) 17.516 6.170 ( 12.129 18.218 10.080) 24.095 6.731 ( 2.601 1.173 16.644) 16.886 6.832 ( 13.048 -10.041 8.272) 18.425 7.382 ( 6.012 -5.677 -0.227) 8.272 7.450 ( 18.549 -5.358 0.444) 19.313 7.715 ( -7.339 -9.296 -0.364) 11.849 7.948 ( -5.574 11.424 5.345) 13.789 8.571 ( -13.489 -17.085 0.908) 21.787 8.784 ( -11.006 -0.712 7.363) 13.261 9.709 ( -24.284 4.093 0.219) 24.627 10.522 ( 12.840 8.103 3.765) 15.643 10.652 ( -4.085 -1.880 -5.061) 6.770 10.906 ( -4.790 0.666 1.055) 4.950 11.125 ( 12.535 -4.167 -14.811) 19.846 11.497 ( -1.280 3.416 -16.146) 16.553 11.699 ( -6.474 -1.672 2.167) 7.028 11.761 ( -9.454 -4.534 -4.855) 11.554 12.159 ( 14.813 0.982 -9.215) 17.473 12.381 ( 6.046 2.247 7.748) 10.081 12.586 ( 1.706 -1.873 2.356) 3.460 13.078 ( -4.905 0.447 -0.718) 4.978 13.101 ( -4.546 -3.278 -2.241) 6.036 13.259 ( -7.793 11.164 -4.727) 14.412 13.551 ( -0.651 0.596 -3.730) 3.833 13.721 ( -5.221 -6.799 -3.138) 9.129 14.117 ( 9.351 -4.964 11.150) 15.376 14.495 ( 1.138 1.673 4.293) 4.746 14.542 ( -0.041 -1.561 3.093) 3.465 14.706 ( 0.985 -1.862 -2.562) 3.317 14.883 ( -1.570 1.966 -6.143) 6.638 15.072 ( -5.419 4.603 2.627) 7.580 15.570 ( 5.550 3.387 1.418) 6.654 15.719 ( -0.342 5.750 -1.181) 5.880 15.832 ( -0.473 3.140 4.191) 5.258 15.926 ( 7.277 -4.944 -3.122) 9.336 16.137 ( -0.224 -0.421 -0.290) 0.559 16.262 ( -0.552 -0.802 2.171) 2.380 16.317 ( 0.813 0.030 1.821) 1.994 16.713 ( 6.127 1.533 -0.788) 6.365 16.766 ( 4.882 -1.111 0.392) 5.022 17.016 ( 3.622 1.154 -13.883) 14.394 17.594 ( -14.908 -0.304 7.708) 16.786 18.055 ( 0.442 -4.975 6.850) 8.477 18.960 ( 12.881 1.409 3.401) 13.396 19.602 ( 1.376 5.870 -3.749) 7.099 ======================= Grid point 115 (47/125) ======================= q-point: (-0.44 0.33 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.726 ( 3.076 0.035 -0.202) 3.082 2.125 ( 2.275 2.455 -5.022) 6.035 2.314 ( 3.493 -0.067 11.422) 11.945 2.400 ( -4.764 5.631 0.740) 7.413 2.554 ( 1.310 5.577 8.964) 10.639 2.771 ( -2.799 0.384 -1.688) 3.291 4.837 ( 12.595 1.881 5.321) 13.801 5.357 ( -15.511 2.096 -4.151) 16.193 5.614 ( -5.765 -15.935 -6.705) 18.224 6.056 ( 12.723 16.072 15.193) 25.515 6.619 ( -8.679 10.485 5.262) 14.593 6.905 ( -6.669 8.068 13.569) 17.137 7.284 ( 9.187 3.068 1.709) 9.836 7.861 ( -0.478 -15.845 1.714) 15.945 7.970 ( 8.817 -2.031 -0.077) 9.048 8.078 ( 12.750 -27.546 2.691) 30.473 8.625 ( -9.842 -10.275 -0.079) 14.228 8.680 ( -3.833 -0.291 6.362) 7.433 9.450 ( -15.032 -7.461 1.616) 16.860 10.482 ( 6.511 13.161 2.829) 14.953 10.617 ( -3.488 0.332 -6.464) 7.352 10.865 ( -2.014 -1.610 2.869) 3.858 11.273 ( 5.828 5.704 -13.665) 15.914 11.424 ( -1.383 -0.604 -14.276) 14.355 11.674 ( -3.204 -3.916 1.300) 5.224 11.770 ( -4.762 -8.616 -4.536) 10.839 12.237 ( 3.046 3.791 -0.308) 4.873 12.472 ( 13.866 3.546 -3.596) 14.757 12.652 ( 1.649 -3.210 1.113) 3.776 12.890 ( -11.629 8.962 -8.360) 16.895 13.104 ( -1.779 -1.572 2.462) 3.420 13.139 ( -2.498 -5.842 -1.014) 6.434 13.514 ( 0.874 4.252 -0.545) 4.375 13.793 ( -3.622 -9.205 -3.463) 10.480 14.268 ( 7.194 0.249 10.336) 12.595 14.472 ( -0.356 2.350 6.171) 6.613 14.569 ( -0.068 -2.077 0.606) 2.165 14.758 ( 0.663 -3.005 -2.869) 4.207 14.828 ( -0.443 3.681 -3.461) 5.072 14.927 ( -4.796 2.738 0.626) 5.558 15.443 ( -2.227 14.047 -0.631) 14.237 15.672 ( 0.975 1.908 -1.678) 2.722 15.782 ( 0.182 2.675 4.055) 4.861 16.082 ( 5.861 -2.976 -1.592) 6.764 16.157 ( 0.179 -1.968 2.770) 3.402 16.276 ( 0.111 -1.262 1.856) 2.247 16.310 ( -1.064 0.546 0.905) 1.500 16.723 ( 1.290 1.451 -0.472) 1.998 16.873 ( 7.731 0.655 -2.769) 8.238 17.014 ( 0.262 2.583 -13.964) 14.203 17.428 ( -9.531 0.684 8.352) 12.691 18.140 ( -1.187 -6.223 5.490) 8.383 19.056 ( 6.609 3.135 4.393) 8.533 19.507 ( 1.658 8.676 -1.698) 8.995 ======================= Grid point 116 (48/125) ======================= q-point: (-0.33 0.33 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.727 ( 0.000 2.443 -1.797) 3.033 2.087 ( 0.000 6.060 -6.752) 9.072 2.215 ( 0.000 12.240 1.509) 12.333 2.318 ( 0.000 1.590 10.520) 10.640 2.498 ( 0.000 2.682 14.359) 14.608 2.767 ( -0.000 -1.853 -3.075) 3.590 4.921 ( 0.000 2.170 5.350) 5.773 5.235 ( 0.000 0.645 -7.999) 8.025 5.767 ( -0.000 -5.870 4.542) 7.422 6.051 ( -0.000 -6.433 12.611) 14.157 6.245 ( 0.000 19.595 -5.967) 20.483 6.795 ( 0.000 2.582 21.182) 21.338 7.309 ( 0.000 4.262 0.199) 4.267 7.934 ( 0.000 9.114 -0.236) 9.117 8.118 ( -0.000 -16.940 2.794) 17.168 8.598 ( -0.000 -11.478 -0.028) 11.478 8.748 ( -0.000 -19.259 3.368) 19.551 8.777 ( -0.000 -21.122 2.907) 21.321 9.519 ( -0.000 -12.354 0.205) 12.355 10.304 ( 0.000 14.909 3.763) 15.377 10.567 ( 0.000 2.254 -8.267) 8.569 10.896 ( -0.000 -3.560 4.375) 5.640 11.118 ( 0.000 14.384 -11.504) 18.419 11.462 ( -0.000 -1.799 -15.948) 16.050 11.738 ( -0.000 -6.140 3.006) 6.836 11.893 ( -0.000 -10.736 -3.546) 11.307 12.187 ( 0.000 4.079 -0.699) 4.139 12.459 ( 0.000 17.713 -6.985) 19.041 12.675 ( -0.000 -5.318 -5.730) 7.817 12.774 ( -0.000 -5.015 2.737) 5.713 13.132 ( -0.000 -2.722 0.803) 2.837 13.237 ( -0.000 -8.232 -1.873) 8.442 13.436 ( 0.000 6.380 2.674) 6.918 13.903 ( -0.000 -7.919 -3.966) 8.857 14.289 ( 0.000 3.840 9.485) 10.233 14.406 ( 0.000 5.512 5.400) 7.717 14.603 ( -0.000 -2.494 -0.707) 2.592 14.767 ( 0.000 2.167 -2.381) 3.219 14.800 ( -0.000 -1.218 -2.710) 2.971 14.906 ( -0.000 -3.065 -0.721) 3.149 15.178 ( 0.000 15.444 -0.451) 15.450 15.625 ( 0.000 4.627 -4.983) 6.800 15.771 ( -0.000 -0.696 1.346) 1.515 16.168 ( -0.000 -1.540 -0.623) 1.661 16.181 ( -0.000 -1.585 6.383) 6.577 16.267 ( 0.000 2.232 -2.786) 3.570 16.309 ( -0.000 -1.715 4.194) 4.531 16.707 ( 0.000 2.288 -0.694) 2.391 16.935 ( 0.000 0.329 -1.700) 1.732 16.947 ( 0.000 3.822 -13.555) 14.083 17.329 ( 0.000 2.952 8.855) 9.334 18.206 ( -0.000 -3.017 3.613) 4.707 19.039 ( 0.000 4.422 5.976) 7.434 19.384 ( 0.000 8.609 0.592) 8.630 ======================= Grid point 123 (49/125) ======================= q-point: ( 0.44 0.44 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.709 ( 3.978 0.000 1.414) 4.221 2.168 ( 2.085 0.000 -1.843) 2.783 2.300 ( 3.396 0.000 11.155) 11.661 2.467 ( -2.078 -0.000 0.729) 2.202 2.664 ( 1.048 0.000 5.158) 5.263 2.792 ( -4.109 -0.000 -2.373) 4.746 4.938 ( 10.593 0.000 5.009) 11.718 5.166 ( -7.478 -0.000 -2.850) 8.002 5.498 ( -17.316 -0.000 -1.817) 17.411 6.712 ( 24.447 0.000 -0.278) 24.449 6.718 ( 6.386 0.000 14.791) 16.110 6.806 ( -0.054 -0.000 19.129) 19.129 7.321 ( -14.369 -0.000 -2.052) 14.514 7.553 ( -1.610 -0.000 -0.401) 1.659 7.574 ( 6.056 0.000 -1.672) 6.283 8.171 ( -8.503 -0.000 3.818) 9.321 8.215 ( 16.677 0.000 3.208) 16.983 8.683 ( -4.838 -0.000 7.079) 8.575 9.383 ( -25.850 -0.000 1.694) 25.906 10.603 ( -1.437 -0.000 -5.795) 5.970 10.738 ( 8.212 0.000 4.735) 9.480 10.844 ( -3.949 -0.000 1.984) 4.420 11.235 ( 8.328 0.000 -16.708) 18.669 11.517 ( -1.192 -0.000 -18.880) 18.918 11.591 ( -5.496 -0.000 4.528) 7.121 11.628 ( -5.053 -0.000 -5.202) 7.252 12.306 ( 5.551 0.000 -1.186) 5.677 12.485 ( 5.339 0.000 -2.782) 6.020 12.627 ( 7.202 0.000 4.138) 8.306 13.014 ( -4.786 -0.000 -2.729) 5.510 13.024 ( -2.620 -0.000 -1.842) 3.203 13.258 ( -11.099 -0.000 -8.700) 14.102 13.459 ( -0.173 -0.000 -2.143) 2.150 13.657 ( -1.736 -0.000 -2.624) 3.146 14.246 ( 11.881 0.000 16.976) 20.720 14.511 ( -1.047 -0.000 5.482) 5.581 14.521 ( 0.213 0.000 1.187) 1.206 14.700 ( 0.471 0.000 -2.591) 2.633 14.879 ( -1.131 -0.000 -5.486) 5.601 15.011 ( -7.754 -0.000 2.097) 8.032 15.661 ( 3.857 0.000 4.750) 6.119 15.849 ( 1.977 0.000 4.391) 4.816 15.871 ( 1.289 0.000 4.772) 4.943 15.886 ( 2.022 0.000 -6.105) 6.431 16.134 ( 0.081 0.000 -2.025) 2.027 16.250 ( -0.128 -0.000 3.019) 3.021 16.310 ( -1.147 -0.000 -1.000) 1.521 16.751 ( 0.221 0.000 -0.373) 0.433 16.867 ( 7.993 0.000 -3.990) 8.934 17.067 ( 1.920 0.000 -15.626) 15.744 17.431 ( -8.617 -0.000 8.292) 11.959 18.014 ( -0.520 -0.000 7.680) 7.697 19.103 ( 6.750 0.000 3.271) 7.500 19.659 ( 0.603 0.000 -3.361) 3.414 ======================= Grid point 124 (50/125) ======================= q-point: (-0.44 -0.56 0.12) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.744 ( -0.000 -0.546 0.594) 0.807 2.169 ( 0.000 1.362 -3.227) 3.503 2.331 ( -0.000 -0.711 11.900) 11.921 2.433 ( 0.000 2.526 0.851) 2.665 2.640 ( 0.000 3.799 6.180) 7.254 2.756 ( 0.000 0.677 -2.347) 2.442 5.017 ( 0.000 2.655 9.084) 9.464 5.143 ( -0.000 -3.286 -2.709) 4.259 5.410 ( -0.000 -7.486 -6.574) 9.963 6.500 ( 0.000 23.216 16.660) 28.575 6.709 ( 0.000 8.916 7.538) 11.676 6.967 ( 0.000 5.879 3.719) 6.957 7.280 ( -0.000 -11.492 3.034) 11.886 7.631 ( -0.000 -11.076 1.527) 11.181 7.743 ( -0.000 -18.532 0.455) 18.537 8.105 ( 0.000 1.386 2.591) 2.938 8.431 ( -0.000 -5.495 -0.302) 5.503 8.652 ( -0.000 -0.108 6.927) 6.927 9.209 ( -0.000 -5.444 3.327) 6.380 10.595 ( -0.000 -0.090 -6.677) 6.677 10.713 ( 0.000 9.602 3.742) 10.305 10.825 ( -0.000 -1.058 2.798) 2.991 11.339 ( -0.000 -4.767 -15.313) 16.038 11.448 ( 0.000 6.325 -15.729) 16.953 11.586 ( -0.000 -3.382 1.562) 3.725 11.631 ( -0.000 -4.778 -5.031) 6.938 12.314 ( 0.000 3.022 2.577) 3.972 12.538 ( -0.000 -2.704 -4.482) 5.235 12.707 ( -0.000 -0.098 3.308) 3.309 12.923 ( 0.000 7.455 -14.133) 15.978 13.038 ( -0.000 -3.993 -1.594) 4.300 13.103 ( 0.000 4.494 2.955) 5.379 13.526 ( -0.000 -4.154 -4.624) 6.216 13.659 ( -0.000 -3.307 -1.100) 3.485 14.339 ( 0.000 0.063 17.072) 17.073 14.487 ( 0.000 1.224 4.649) 4.807 14.540 ( -0.000 -1.646 1.267) 2.077 14.720 ( -0.000 -2.100 -2.589) 3.334 14.862 ( 0.000 1.115 -4.772) 4.900 14.926 ( 0.000 2.767 0.843) 2.892 15.673 ( 0.000 14.924 0.234) 14.926 15.689 ( -0.000 -0.102 3.633) 3.635 15.844 ( 0.000 3.890 4.213) 5.734 16.035 ( -0.000 -7.732 -0.769) 7.770 16.139 ( -0.000 -0.667 -0.819) 1.056 16.259 ( -0.000 -1.095 4.539) 4.670 16.302 ( -0.000 -0.077 -3.133) 3.134 16.746 ( 0.000 0.782 -1.383) 1.589 16.930 ( -0.000 -0.637 -3.393) 3.452 17.057 ( 0.000 2.540 -16.029) 16.229 17.372 ( 0.000 0.167 8.589) 8.591 18.046 ( -0.000 -4.414 7.082) 8.345 19.136 ( 0.000 1.513 3.612) 3.917 19.624 ( 0.000 4.983 -2.623) 5.631 ======================= Grid point 166 (51/125) ======================= q-point: ( 0.00 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 125 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.015 ( 0.000 0.000 25.957) 25.957 1.038 ( 0.000 0.000 26.524) 26.524 1.816 ( 0.000 0.000 30.185) 30.185 2.309 ( 0.000 0.000 6.952) 6.952 2.684 ( 0.000 0.000 7.793) 7.793 2.706 ( 0.000 0.000 -13.663) 13.663 4.889 ( 0.000 0.000 17.230) 17.230 4.898 ( 0.000 0.000 -9.037) 9.037 5.052 ( 0.000 0.000 -3.239) 3.239 6.355 ( 0.000 0.000 -6.243) 6.243 6.851 ( 0.000 0.000 5.083) 5.083 6.971 ( 0.000 0.000 26.931) 26.931 7.865 ( 0.000 0.000 -14.810) 14.810 7.896 ( 0.000 0.000 6.302) 6.302 8.104 ( 0.000 0.000 28.366) 28.366 9.119 ( 0.000 0.000 -16.367) 16.367 9.466 ( 0.000 0.000 8.110) 8.110 9.805 ( 0.000 0.000 -5.116) 5.116 9.887 ( 0.000 0.000 -18.014) 18.014 10.183 ( 0.000 0.000 -0.406) 0.406 10.479 ( 0.000 0.000 -10.952) 10.952 10.485 ( 0.000 0.000 -3.167) 3.167 10.575 ( 0.000 0.000 5.814) 5.814 11.063 ( 0.000 0.000 -15.662) 15.662 11.666 ( 0.000 0.000 16.261) 16.261 12.413 ( 0.000 0.000 15.344) 15.344 12.560 ( 0.000 0.000 7.061) 7.061 12.578 ( 0.000 0.000 3.356) 3.356 13.000 ( 0.000 0.000 -5.337) 5.337 13.032 ( 0.000 0.000 -14.809) 14.809 13.157 ( 0.000 0.000 -6.651) 6.651 13.400 ( 0.000 0.000 8.119) 8.119 13.637 ( 0.000 0.000 0.113) 0.113 13.849 ( 0.000 0.000 -16.272) 16.272 14.008 ( 0.000 0.000 0.124) 0.124 14.078 ( 0.000 0.000 8.713) 8.713 14.305 ( 0.000 0.000 -10.137) 10.137 14.323 ( 0.000 0.000 1.384) 1.384 14.402 ( 0.000 0.000 -0.186) 0.186 14.972 ( 0.000 0.000 -7.925) 7.925 15.123 ( 0.000 0.000 -1.024) 1.024 15.221 ( 0.000 0.000 2.640) 2.640 15.610 ( 0.000 0.000 -6.962) 6.962 15.857 ( 0.000 0.000 -10.109) 10.109 16.060 ( 0.000 0.000 1.625) 1.625 16.178 ( 0.000 0.000 -1.402) 1.402 16.621 ( 0.000 0.000 8.662) 8.662 16.629 ( 0.000 0.000 8.161) 8.161 16.690 ( 0.000 0.000 2.642) 2.642 16.940 ( 0.000 0.000 0.484) 0.484 17.141 ( 0.000 0.000 4.378) 4.378 17.502 ( 0.000 0.000 -1.173) 1.173 19.125 ( 0.000 0.000 13.073) 13.073 19.938 ( 0.000 0.000 -4.846) 4.846 ======================= Grid point 167 (52/125) ======================= q-point: ( 0.11 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 325 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.069 ( 6.420 -2.898 21.794) 22.903 1.159 ( 6.172 -9.968 22.550) 25.415 1.954 ( 10.693 -3.186 17.782) 20.993 2.302 ( -0.138 -1.453 12.601) 12.686 2.655 ( -4.156 -0.331 -3.962) 5.752 2.729 ( 0.187 -2.373 -0.914) 2.550 4.842 ( -1.901 1.973 -4.057) 4.895 4.964 ( 8.820 -1.488 15.385) 17.796 5.166 ( 2.173 -7.973 -7.061) 10.869 6.371 ( 2.361 -0.350 -7.437) 7.811 6.845 ( -3.790 0.482 9.060) 9.832 6.958 ( 2.221 0.302 21.067) 21.186 7.492 ( -23.742 8.506 2.904) 25.386 8.020 ( 7.426 3.496 14.495) 16.658 8.221 ( 0.293 -10.582 3.191) 11.057 9.011 ( 0.442 13.154 -11.556) 17.514 9.488 ( 2.620 0.360 3.721) 4.565 9.763 ( -13.099 1.116 -0.657) 13.163 9.922 ( -5.760 -13.924 -12.054) 19.297 10.314 ( 5.070 1.548 -3.657) 6.440 10.380 ( -0.062 -5.780 -6.467) 8.674 10.418 ( 5.956 9.027 -3.599) 11.398 10.712 ( 5.458 -2.595 -2.333) 6.478 11.019 ( -1.516 2.697 -18.506) 18.763 11.594 ( -4.071 4.852 15.303) 16.562 12.396 ( -7.321 8.667 8.529) 14.194 12.412 ( 0.011 1.519 14.139) 14.221 12.614 ( 0.323 -5.884 6.736) 8.950 12.859 ( -10.420 -1.066 -10.761) 15.017 13.060 ( 8.303 10.893 -7.726) 15.726 13.246 ( 0.509 3.610 -3.706) 5.198 13.288 ( 5.183 1.481 1.485) 5.591 13.783 ( 2.783 4.855 -0.799) 5.652 13.835 ( 0.953 -0.057 -8.731) 8.783 13.933 ( -10.495 -2.556 2.380) 11.061 14.208 ( -1.112 -19.708 -8.512) 21.496 14.377 ( 0.542 -5.825 -4.822) 7.581 14.444 ( 9.918 -1.060 0.246) 9.977 14.475 ( 9.288 -6.999 -3.703) 12.205 14.964 ( 2.328 2.945 -8.661) 9.440 15.089 ( 1.127 4.340 1.247) 4.654 15.237 ( 4.205 2.160 2.001) 5.133 15.590 ( -4.831 -2.339 -6.285) 8.265 15.724 ( -15.307 -3.923 -7.845) 17.642 16.072 ( 0.012 -1.514 2.265) 2.725 16.339 ( 14.114 0.784 -3.102) 14.472 16.597 ( -3.917 -0.217 6.791) 7.843 16.650 ( 4.024 0.412 7.662) 8.664 16.730 ( 4.557 0.119 2.573) 5.234 16.826 ( -10.819 -1.070 2.581) 11.174 17.309 ( 18.117 -0.795 3.563) 18.481 17.587 ( 5.136 -6.005 -0.911) 7.955 19.090 ( -6.358 -1.009 12.777) 14.307 19.761 ( -8.066 12.111 1.409) 14.620 ======================= Grid point 168 (53/125) ======================= q-point: ( 0.22 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 325 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.277 ( 11.162 -6.233 12.590) 17.943 1.464 ( 8.657 -15.179 14.567) 22.750 2.039 ( 5.174 4.676 -0.750) 7.014 2.417 ( 6.257 -5.288 18.585) 20.311 2.615 ( -2.792 -0.979 -2.194) 3.683 2.770 ( -0.282 -3.620 3.781) 5.242 4.802 ( -2.235 0.285 -0.323) 2.276 5.121 ( 11.901 2.530 11.710) 16.886 5.319 ( 3.482 -8.995 -6.509) 11.636 6.439 ( 6.247 -0.853 -8.526) 10.604 6.684 ( -8.682 8.042 16.246) 20.099 7.056 ( -9.449 4.998 11.333) 15.580 7.104 ( -4.358 -9.226 4.776) 11.266 8.062 ( 0.066 -2.479 21.826) 21.966 8.349 ( 0.212 -5.128 -5.263) 7.351 8.788 ( -2.430 12.134 -2.843) 12.697 9.288 ( -22.642 11.510 0.121) 25.400 9.645 ( 0.987 -3.716 1.119) 4.004 10.025 ( -15.416 5.310 -4.399) 16.888 10.253 ( 7.236 -9.480 -10.790) 16.083 10.339 ( 6.070 6.454 3.620) 9.571 10.722 ( 4.361 -1.920 -9.316) 10.464 10.739 ( 10.551 -4.444 -7.958) 13.943 11.011 ( 0.836 -2.493 -22.411) 22.565 11.446 ( -5.110 5.254 13.834) 15.655 12.195 ( -5.028 6.287 7.333) 10.890 12.365 ( -1.641 4.084 9.621) 10.579 12.716 ( -1.910 -6.669 3.665) 7.846 12.774 ( -6.157 -3.203 -4.452) 8.245 12.951 ( 6.445 12.902 -3.204) 14.774 13.186 ( 2.256 3.766 -2.237) 4.927 13.359 ( -0.681 0.152 -1.609) 1.754 13.602 ( -9.954 2.341 3.465) 10.797 13.868 ( 3.627 6.125 -2.118) 7.427 13.869 ( 2.742 -0.028 -2.730) 3.869 14.376 ( -2.285 -5.958 -8.987) 11.022 14.521 ( 0.279 -7.457 -3.597) 8.284 14.611 ( 2.090 -9.426 -5.138) 10.937 14.768 ( 12.576 -5.433 -9.072) 16.431 14.969 ( 6.567 1.324 -7.928) 10.379 15.053 ( 2.531 2.645 1.686) 4.031 15.259 ( 6.433 3.884 2.184) 7.826 15.588 ( -2.965 -4.664 -5.405) 7.730 15.622 ( -11.885 -5.534 -6.851) 14.793 16.109 ( 0.102 -3.238 2.111) 3.867 16.441 ( 6.211 2.747 -2.448) 7.219 16.544 ( -4.950 -0.645 5.125) 7.154 16.627 ( -5.763 3.045 1.328) 6.652 16.732 ( 2.273 -0.930 8.404) 8.755 16.859 ( 6.176 -1.585 3.897) 7.472 17.593 ( 20.605 -1.816 4.441) 21.157 17.803 ( 8.623 -9.244 -0.562) 12.654 18.994 ( -11.602 -2.382 11.733) 16.672 19.455 ( -7.551 12.451 4.897) 15.363 ======================= Grid point 169 (54/125) ======================= q-point: ( 0.33 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 325 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.476 ( 5.632 -3.310 6.130) 8.958 1.782 ( 5.671 -10.359 4.007) 12.471 2.088 ( 8.517 -2.628 3.645) 9.629 2.507 ( 1.864 1.239 10.243) 10.485 2.612 ( -1.092 -1.670 1.959) 2.796 2.853 ( 2.969 -4.031 9.331) 10.589 4.756 ( -3.604 0.697 4.953) 6.165 5.137 ( 4.506 7.863 5.671) 10.691 5.570 ( 8.486 -10.678 -6.051) 14.921 6.366 ( -12.401 8.649 -2.103) 15.264 6.613 ( 13.451 -1.442 9.970) 16.805 6.849 ( -7.020 -0.327 10.377) 12.533 7.416 ( 8.482 -18.451 -0.074) 20.307 8.060 ( -9.521 -2.634 22.971) 25.006 8.385 ( 3.865 4.173 -6.585) 8.702 8.605 ( -2.779 6.460 5.929) 9.198 8.786 ( -23.507 7.302 3.801) 24.906 9.523 ( -14.804 21.402 -4.233) 26.365 9.784 ( -0.585 -5.502 0.177) 5.536 10.333 ( 2.136 1.410 2.132) 3.331 10.576 ( 9.943 -10.983 -11.561) 18.792 10.649 ( 3.796 7.151 -5.410) 9.737 11.002 ( -2.137 -8.128 -22.767) 24.268 11.108 ( 9.027 -4.310 -12.481) 15.995 11.317 ( -3.763 3.349 12.816) 13.771 12.050 ( -3.941 4.943 6.114) 8.794 12.262 ( -2.813 4.040 2.810) 5.668 12.700 ( -4.893 1.305 -5.348) 7.365 12.789 ( 2.577 -0.151 2.854) 3.848 12.928 ( 4.397 -0.043 2.180) 4.908 13.155 ( 1.672 5.674 -3.274) 6.761 13.232 ( -11.486 -1.023 1.154) 11.589 13.551 ( -1.690 -1.614 6.889) 7.275 13.819 ( 5.859 7.009 -1.780) 9.307 13.930 ( 3.285 -1.444 -4.219) 5.538 14.420 ( -0.325 -2.388 -7.139) 7.535 14.611 ( 0.081 -4.165 -3.584) 5.496 14.668 ( -2.140 0.217 -4.490) 4.979 14.902 ( 2.987 -1.281 -4.076) 5.213 15.044 ( 2.039 0.075 -2.937) 3.576 15.156 ( 9.776 -2.986 -10.143) 14.400 15.303 ( 7.921 2.277 2.901) 8.738 15.559 ( -9.827 -4.681 -4.029) 11.607 15.645 ( 0.470 -4.053 -5.358) 6.734 16.176 ( 0.675 -4.662 0.200) 4.715 16.448 ( 3.120 3.830 -3.846) 6.261 16.483 ( -5.991 -0.303 3.173) 6.786 16.510 ( -4.870 1.191 0.738) 5.068 16.788 ( 3.807 -0.257 11.000) 11.643 16.947 ( 4.153 -0.557 5.144) 6.634 17.894 ( 19.432 -2.020 5.414) 20.273 18.069 ( 8.682 -8.829 0.366) 12.388 18.868 ( -14.174 -4.272 9.730) 17.715 19.184 ( -5.868 11.194 3.438) 13.098 ======================= Grid point 170 (55/125) ======================= q-point: ( 0.44 0.00 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 325 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.536 ( 0.845 -0.301 2.998) 3.130 1.925 ( 2.455 -2.381 -2.745) 4.385 2.301 ( 6.111 -7.968 9.175) 13.602 2.461 ( -1.558 4.553 8.664) 9.911 2.622 ( -0.191 -0.591 6.222) 6.253 2.931 ( 1.681 -1.237 9.892) 10.110 4.701 ( -2.333 0.411 10.758) 11.015 5.065 ( 0.958 4.241 1.878) 4.736 5.823 ( 9.319 -7.023 -7.999) 14.148 6.071 ( -12.259 7.061 -5.210) 15.076 6.827 ( -0.898 -1.311 14.646) 14.732 6.913 ( 16.599 -7.040 9.220) 20.251 7.675 ( -6.894 4.699 1.584) 8.492 7.952 ( -5.659 -14.997 -1.580) 16.107 8.327 ( 7.780 11.510 9.290) 16.713 8.512 ( -3.291 -0.154 12.226) 12.662 8.624 ( -5.037 -10.097 3.993) 11.969 8.964 ( -12.663 22.113 -1.892) 25.553 9.863 ( 0.817 -2.482 0.096) 2.615 10.343 ( 0.313 -0.355 1.200) 1.290 10.584 ( 0.908 3.056 -4.571) 5.573 10.852 ( 9.326 -5.405 -16.903) 20.047 10.993 ( -6.016 -0.103 -20.869) 21.720 11.243 ( 0.087 1.236 11.386) 11.453 11.282 ( 2.407 -3.339 -8.523) 9.465 11.947 ( -1.942 2.392 5.284) 6.116 12.193 ( -1.096 1.286 -0.162) 1.697 12.617 ( -1.587 2.141 -8.448) 8.859 12.850 ( 5.116 -0.371 4.589) 6.883 12.958 ( -2.250 0.596 3.293) 4.033 13.064 ( -3.172 -0.347 -0.766) 3.282 13.180 ( -1.439 -0.332 -1.813) 2.338 13.548 ( -0.475 -0.009 8.695) 8.708 13.806 ( 2.881 2.569 -1.143) 4.026 13.982 ( 1.325 -0.775 -4.189) 4.462 14.443 ( -0.080 -0.848 -6.835) 6.888 14.625 ( -1.103 0.995 -4.179) 4.435 14.655 ( 0.085 -1.304 -4.072) 4.277 14.930 ( 0.720 0.107 3.114) 3.198 15.060 ( 0.495 -0.033 -6.622) 6.640 15.271 ( 3.423 -0.476 -10.747) 11.289 15.396 ( 8.057 0.589 1.160) 8.162 15.496 ( -8.236 -2.523 -0.719) 8.643 15.701 ( 0.692 -1.516 -5.382) 5.634 16.257 ( 0.718 -3.598 -1.094) 3.828 16.409 ( -1.433 2.118 0.744) 2.663 16.419 ( -0.165 1.780 -4.984) 5.295 16.466 ( -2.005 -0.592 0.471) 2.143 16.830 ( 1.666 -0.073 13.101) 13.206 16.987 ( 1.237 -0.126 5.775) 5.908 18.150 ( 14.500 -0.704 5.267) 15.443 18.244 ( -0.590 -3.977 3.378) 5.251 18.790 ( -8.020 -6.432 6.645) 12.241 18.958 ( -2.868 9.136 1.956) 9.773 ======================= Grid point 176 (56/125) ======================= q-point: ( 0.11 0.11 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 185 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.162 ( 11.933 0.000 18.450) 21.972 1.207 ( 12.142 0.000 18.567) 22.185 2.122 ( 12.404 0.000 5.678) 13.642 2.308 ( 5.865 0.000 20.081) 20.920 2.588 ( -5.359 -0.000 -8.895) 10.385 2.689 ( -1.538 -0.000 4.293) 4.560 4.828 ( -2.613 -0.000 -2.707) 3.762 5.094 ( 11.035 0.000 5.518) 12.338 5.219 ( 15.353 0.000 4.110) 15.893 6.377 ( 0.039 0.000 -10.799) 10.799 6.817 ( -3.028 -0.000 8.131) 8.677 6.983 ( 1.848 0.000 26.408) 26.472 7.226 ( -26.099 -0.000 3.197) 26.294 7.894 ( -13.146 -0.000 24.009) 27.372 8.255 ( 3.969 0.000 -7.932) 8.869 9.135 ( -2.855 -0.000 -11.404) 11.756 9.588 ( -17.727 -0.000 -0.312) 17.730 9.665 ( 13.404 0.000 9.436) 16.392 9.684 ( 0.893 0.000 -17.101) 17.124 10.115 ( -17.857 -0.000 2.406) 18.019 10.553 ( 18.937 0.000 -12.219) 22.537 10.636 ( 5.954 0.000 -5.975) 8.435 10.698 ( 1.712 0.000 -0.439) 1.767 11.014 ( -2.190 -0.000 -19.031) 19.156 11.550 ( -7.926 -0.000 14.836) 16.821 12.347 ( -9.875 -0.000 9.267) 13.542 12.430 ( 0.832 0.000 14.376) 14.400 12.568 ( 0.434 0.000 6.472) 6.487 12.635 ( -14.825 -0.000 -9.407) 17.558 13.237 ( 0.209 0.000 -8.398) 8.401 13.319 ( 8.486 0.000 -5.930) 10.353 13.451 ( 3.311 0.000 9.271) 9.844 13.760 ( -7.727 -0.000 -0.086) 7.727 13.842 ( 4.271 0.000 -10.986) 11.787 13.928 ( -7.355 -0.000 -3.548) 8.166 13.961 ( 7.395 0.000 -4.167) 8.488 14.372 ( 3.586 0.000 -0.691) 3.652 14.543 ( 6.674 0.000 0.975) 6.745 14.609 ( 19.543 0.000 -10.249) 22.067 15.005 ( 0.275 0.000 -8.363) 8.368 15.147 ( 1.802 0.000 1.283) 2.212 15.346 ( 7.557 0.000 1.548) 7.714 15.499 ( -9.759 -0.000 -7.343) 12.213 15.504 ( -4.248 -0.000 -7.734) 8.824 16.054 ( -0.801 -0.000 3.908) 3.989 16.486 ( 3.622 0.000 -1.785) 4.038 16.545 ( -1.957 -0.000 3.612) 4.109 16.660 ( -11.391 -0.000 2.805) 11.731 16.719 ( 5.477 0.000 8.183) 9.847 16.830 ( 8.193 0.000 3.962) 9.100 17.580 ( 22.573 0.000 2.017) 22.663 17.637 ( 9.418 0.000 1.675) 9.565 18.958 ( -12.034 -0.000 12.683) 17.484 19.715 ( -11.508 -0.000 -2.610) 11.800 ======================= Grid point 177 (57/125) ======================= q-point: ( 0.22 0.11 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 325 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.384 ( 12.367 -1.834 11.445) 16.949 1.430 ( 14.903 -7.833 11.517) 20.398 2.162 ( 2.274 3.529 -2.391) 4.831 2.490 ( 10.959 -1.204 15.904) 19.352 2.547 ( -1.979 -2.459 -5.568) 6.400 2.704 ( 0.722 -3.786 7.145) 8.118 4.794 ( -1.049 1.226 1.275) 2.057 5.271 ( 7.591 -5.780 -5.246) 10.888 5.431 ( 21.302 7.719 8.988) 24.375 6.431 ( 1.375 -6.580 -11.934) 13.697 6.709 ( -5.834 6.557 15.357) 17.688 6.863 ( -20.186 2.022 4.997) 20.893 7.051 ( 4.468 -4.019 21.160) 21.997 7.781 ( -14.453 -8.611 21.483) 27.287 8.278 ( -5.222 -5.062 -4.910) 8.775 8.976 ( -6.454 9.793 -3.784) 12.324 9.220 ( -17.643 14.190 -0.920) 22.661 9.657 ( 5.679 1.741 -3.699) 6.998 9.889 ( -10.593 0.918 2.018) 10.823 10.095 ( 7.268 -18.558 -6.204) 20.874 10.505 ( -2.156 11.242 0.736) 11.470 10.778 ( 0.576 -1.747 -6.202) 6.469 10.815 ( 12.317 -3.039 -16.692) 20.966 11.032 ( 6.966 -1.005 -19.288) 20.532 11.412 ( -8.597 2.328 13.078) 15.823 12.193 ( -7.103 3.810 7.910) 11.293 12.376 ( -7.972 1.908 1.744) 8.381 12.536 ( -6.900 -6.482 4.614) 10.532 12.612 ( -0.379 -3.975 4.287) 5.858 13.224 ( -1.152 0.300 -6.469) 6.577 13.293 ( 5.214 14.405 1.586) 15.401 13.414 ( 1.402 5.235 -0.825) 5.482 13.543 ( -7.395 6.640 2.939) 10.364 13.849 ( -2.262 -4.790 -5.710) 7.789 14.039 ( 1.240 -3.206 -5.820) 6.760 14.148 ( 5.928 -9.751 -7.319) 13.557 14.437 ( 4.006 -2.434 0.734) 4.744 14.633 ( 5.275 -1.118 2.247) 5.841 14.887 ( 11.934 0.391 -11.470) 16.557 15.021 ( 5.183 -4.185 -8.217) 10.578 15.122 ( 0.269 4.110 -0.055) 4.119 15.388 ( -2.139 -3.710 -3.978) 5.845 15.456 ( 3.358 2.869 -4.975) 6.652 15.556 ( 7.949 -1.541 -3.575) 8.851 16.057 ( -1.053 -2.264 3.951) 4.674 16.455 ( -4.773 -0.378 2.930) 5.614 16.520 ( -9.652 -0.561 2.420) 9.966 16.551 ( 2.166 1.832 -3.340) 4.382 16.785 ( 4.225 0.122 8.832) 9.792 16.917 ( 3.202 -0.909 5.715) 6.613 17.807 ( 12.491 -3.109 4.441) 13.617 17.904 ( 22.611 -1.359 1.557) 22.705 18.779 ( -15.874 -1.393 12.298) 20.129 19.519 ( -7.005 7.803 -3.209) 10.965 ======================= Grid point 178 (58/125) ======================= q-point: ( 0.33 0.11 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 325 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.528 ( 6.063 -0.703 5.925) 8.507 1.751 ( 11.619 -7.681 3.837) 14.447 2.169 ( 5.528 0.659 2.963) 6.306 2.550 ( -1.374 -3.558 -0.074) 3.815 2.577 ( 3.092 3.020 7.674) 8.808 2.838 ( 5.295 -4.755 8.525) 11.105 4.747 ( -1.793 2.439 5.570) 6.340 5.361 ( 4.509 7.850 -2.515) 9.396 5.588 ( 13.176 -1.410 -1.580) 13.345 6.353 ( -11.116 9.158 1.732) 14.506 6.707 ( -4.450 -4.714 9.078) 11.156 6.743 ( 12.019 -5.621 4.886) 14.139 7.278 ( 9.185 -14.959 10.732) 20.575 7.735 ( -15.914 -9.326 20.098) 27.279 8.287 ( -8.892 -7.664 2.330) 11.968 8.598 ( -22.908 10.709 4.922) 25.762 8.890 ( 3.327 14.110 -1.709) 14.597 9.555 ( -17.967 8.342 -2.225) 19.934 9.800 ( 9.534 3.113 -3.743) 10.705 10.287 ( -8.085 0.310 2.535) 8.479 10.512 ( 9.231 -12.088 -6.914) 16.707 10.751 ( -0.718 1.973 -6.783) 7.100 10.958 ( 3.859 -0.980 -25.711) 26.017 11.214 ( 12.836 -1.643 -11.219) 17.127 11.283 ( -5.138 1.010 10.735) 11.944 12.052 ( -5.666 3.412 6.480) 9.259 12.226 ( -10.449 0.004 -3.419) 10.994 12.564 ( -5.127 -5.676 6.390) 9.967 12.666 ( -1.539 -4.815 2.985) 5.871 13.145 ( 3.439 9.804 1.117) 10.449 13.183 ( -7.253 9.365 0.090) 11.845 13.235 ( 1.782 1.544 -6.890) 7.282 13.514 ( 0.317 -1.339 6.687) 6.827 13.910 ( -0.901 -4.790 -5.655) 7.465 14.047 ( 5.642 7.137 -3.659) 9.806 14.314 ( 0.854 -6.777 -6.285) 9.282 14.542 ( 2.277 -4.429 -1.377) 5.167 14.690 ( 2.027 0.953 2.485) 3.346 14.903 ( -1.330 -0.394 -5.162) 5.345 15.064 ( -0.643 2.467 -1.963) 3.217 15.250 ( 12.154 -2.631 -9.681) 15.760 15.406 ( -3.412 -2.960 -7.706) 8.933 15.499 ( 10.671 4.404 0.958) 11.584 15.680 ( 9.211 1.043 -2.959) 9.731 16.102 ( -0.216 -4.687 2.336) 5.241 16.396 ( -5.146 -0.692 2.211) 5.643 16.426 ( -6.588 -1.487 0.707) 6.790 16.545 ( 2.644 2.797 -5.427) 6.653 16.823 ( 1.400 -0.073 10.517) 10.610 16.950 ( -1.239 -1.973 6.123) 6.552 18.036 ( 10.573 -5.588 6.059) 13.406 18.192 ( 16.939 0.661 1.355) 17.006 18.608 ( -13.206 -4.000 11.798) 18.154 19.312 ( -1.969 10.936 -3.739) 11.724 ======================= Grid point 179 (59/125) ======================= q-point: ( 0.44 0.11 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 325 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.573 ( 2.772 1.728 2.553) 4.146 1.923 ( 2.920 -2.176 -2.874) 4.639 2.296 ( 7.487 -4.081 9.545) 12.799 2.525 ( -0.999 4.627 4.689) 6.662 2.599 ( 0.762 -1.558 7.206) 7.411 2.925 ( 0.402 -1.489 7.740) 7.892 4.700 ( 0.356 0.975 9.828) 9.883 5.220 ( 1.915 12.781 1.825) 13.052 5.809 ( 6.176 -10.381 -14.139) 18.597 6.058 ( -8.787 10.027 0.718) 13.351 6.786 ( 3.179 -3.150 15.044) 15.696 7.038 ( 14.404 -4.376 7.350) 16.753 7.547 ( -18.690 1.281 14.631) 23.770 7.733 ( 13.769 -19.507 -1.256) 23.910 8.179 ( -16.026 -6.875 8.429) 19.369 8.394 ( -5.692 -7.026 9.173) 12.881 8.781 ( 8.001 10.410 2.117) 13.299 9.103 ( -14.470 16.816 -2.268) 22.300 9.895 ( 7.872 1.634 -2.679) 8.475 10.203 ( -10.712 -6.112 3.056) 12.706 10.629 ( -1.857 2.601 -5.528) 6.386 10.848 ( 4.806 -7.459 -9.412) 12.935 10.973 ( 1.236 1.986 -26.508) 26.611 11.205 ( -4.117 -1.227 10.098) 10.974 11.400 ( 12.078 2.683 -10.601) 16.293 11.944 ( -3.657 1.819 5.532) 6.876 12.127 ( -7.968 -3.455 -4.650) 9.852 12.554 ( -5.411 -2.617 1.807) 6.276 12.727 ( -3.167 -6.287 0.883) 7.094 12.964 ( -4.305 5.708 -0.516) 7.168 13.091 ( 2.786 4.642 3.334) 6.358 13.261 ( 2.463 -0.704 -4.863) 5.496 13.539 ( 0.219 -1.407 7.883) 8.011 13.939 ( 0.717 2.758 -3.290) 4.353 13.998 ( 3.097 4.825 -3.849) 6.906 14.406 ( 1.783 -2.919 -4.230) 5.440 14.605 ( 0.332 -0.911 -1.876) 2.111 14.683 ( 1.337 0.989 -1.390) 2.168 14.894 ( -3.147 -1.885 1.520) 3.971 15.026 ( -2.368 0.165 -3.563) 4.282 15.365 ( 4.759 3.680 -13.246) 14.548 15.388 ( -2.148 -0.366 -2.442) 3.273 15.588 ( 12.012 3.801 2.073) 12.768 15.756 ( 5.991 2.294 -3.018) 7.090 16.192 ( 1.466 -5.542 0.534) 5.757 16.356 ( -3.083 -1.047 1.534) 3.599 16.377 ( -4.038 -1.436 -1.609) 4.578 16.543 ( 4.004 2.907 -5.236) 7.204 16.821 ( -2.116 -0.417 11.288) 11.492 16.953 ( -3.033 -2.186 5.056) 6.289 18.160 ( -8.125 -0.576 7.504) 11.075 18.282 ( 4.257 -1.765 1.911) 4.989 18.662 ( 8.756 -5.084 8.952) 13.515 19.141 ( 3.395 11.394 -2.384) 12.125 ======================= Grid point 180 (60/125) ======================= q-point: (-0.44 0.11 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 325 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.565 ( 1.394 2.899 1.494) 3.547 1.928 ( -1.565 1.670 -3.527) 4.204 2.359 ( -5.930 9.020 6.974) 12.852 2.444 ( 3.420 -1.817 9.189) 9.972 2.619 ( 0.203 -0.683 6.764) 6.801 2.915 ( -2.710 0.112 8.401) 8.828 4.747 ( 5.740 -0.952 11.417) 12.815 5.080 ( 0.866 6.455 1.464) 6.676 5.832 ( -4.989 7.533 -2.401) 9.349 6.076 ( 6.466 -12.858 -16.834) 22.148 6.844 ( 0.371 0.672 16.820) 16.838 6.852 ( -14.519 14.849 14.865) 25.540 7.624 ( 4.710 -12.324 10.261) 16.714 8.010 ( -13.286 -3.940 5.098) 14.766 8.218 ( 13.725 -1.709 -7.851) 15.904 8.473 ( 0.049 -7.999 11.591) 14.084 8.793 ( 1.301 -0.333 -2.209) 2.586 8.904 ( 13.084 -5.577 9.185) 16.931 9.930 ( 4.471 4.628 -0.719) 6.476 10.182 ( -11.082 -9.150 0.900) 14.399 10.542 ( -4.497 1.981 -6.396) 8.066 10.836 ( -5.545 5.277 -12.431) 14.599 11.033 ( 3.156 -2.400 -20.435) 20.816 11.202 ( -1.476 -2.844 8.718) 9.288 11.436 ( 7.585 9.976 -12.454) 17.668 11.923 ( 0.112 -2.489 5.116) 5.690 12.120 ( -4.660 -6.241 -4.384) 8.938 12.535 ( -4.213 -4.080 0.650) 5.901 12.725 ( -5.466 -1.792 -3.016) 6.495 12.933 ( -0.195 -4.497 3.125) 5.480 13.064 ( 1.745 3.250 1.679) 4.053 13.318 ( 3.204 -1.661 -3.183) 4.812 13.563 ( 0.001 -1.436 6.820) 6.970 13.855 ( 5.330 10.770 1.313) 12.089 13.982 ( -1.482 0.336 -5.115) 5.336 14.442 ( 0.815 0.884 -1.320) 1.785 14.614 ( 0.562 -1.242 -2.771) 3.088 14.698 ( 1.806 0.836 -4.456) 4.881 14.875 ( -4.004 -1.856 3.574) 5.680 14.997 ( -3.612 -1.962 -3.617) 5.476 15.275 ( -6.617 4.078 -11.440) 13.831 15.357 ( 0.495 4.632 -2.942) 5.510 15.686 ( 10.354 3.374 0.136) 10.891 15.775 ( 4.706 4.025 -3.355) 7.043 16.280 ( 0.353 0.104 -0.923) 0.994 16.319 ( -2.197 -2.772 -1.847) 3.990 16.398 ( 0.549 -3.655 1.450) 3.970 16.563 ( 5.144 2.674 -1.772) 6.062 16.786 ( -3.832 -0.431 8.743) 9.556 16.935 ( -3.983 -1.423 4.065) 5.866 17.954 ( -17.288 1.640 7.052) 18.743 18.307 ( -1.675 3.774 -0.197) 4.134 18.882 ( 11.071 -4.783 8.871) 14.971 19.082 ( 9.810 7.297 2.147) 12.414 ======================= Grid point 181 (61/125) ======================= q-point: (-0.33 0.11 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 325 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.498 ( -2.204 6.384 2.893) 7.348 1.866 ( -0.577 4.188 -0.710) 4.287 2.052 ( -11.911 11.485 6.730) 17.863 2.491 ( 0.623 -0.123 10.860) 10.879 2.639 ( 1.765 -0.028 3.121) 3.585 2.859 ( -3.427 1.583 7.750) 8.620 4.826 ( 5.583 1.691 6.050) 8.404 5.052 ( 0.734 -0.020 5.323) 5.373 5.648 ( -3.907 10.248 -5.210) 12.142 6.325 ( -3.229 -10.388 -18.247) 21.244 6.520 ( -1.381 2.310 23.465) 23.619 6.904 ( 6.465 -1.602 15.508) 16.878 7.609 ( -5.514 17.099 -3.414) 18.288 7.812 ( -17.348 -11.736 17.635) 27.380 8.479 ( 11.567 -0.712 -2.242) 11.803 8.626 ( 7.011 -4.066 8.615) 11.828 8.937 ( 15.545 -9.061 0.158) 17.994 9.405 ( 17.899 -22.129 1.312) 28.492 9.890 ( 3.081 5.986 2.498) 7.181 10.161 ( -12.066 -7.633 -2.178) 14.443 10.467 ( -8.559 -3.190 -7.370) 11.737 10.623 ( -6.862 9.679 -9.551) 15.231 11.065 ( -1.320 0.607 -17.638) 17.698 11.222 ( 0.875 4.356 -3.883) 5.901 11.324 ( 3.184 7.762 -5.070) 9.803 12.008 ( 2.124 -5.658 5.873) 8.427 12.191 ( -1.220 -7.714 -2.179) 8.108 12.562 ( -5.658 -6.979 4.925) 10.246 12.720 ( -0.069 -3.900 -6.846) 7.879 12.998 ( 1.547 2.221 1.636) 3.163 13.038 ( -1.460 -2.577 1.414) 3.282 13.389 ( 3.097 -1.381 -0.629) 3.449 13.571 ( -3.704 -2.497 1.611) 4.749 13.816 ( 13.277 8.231 4.793) 16.340 13.936 ( -1.638 2.692 -4.624) 5.596 14.412 ( -1.710 1.264 0.967) 2.336 14.664 ( 0.669 -2.996 -4.584) 5.517 14.689 ( 1.757 3.091 -4.778) 5.956 14.850 ( -3.650 -1.605 -0.054) 3.987 14.984 ( -4.646 -0.956 -2.783) 5.500 15.078 ( -11.661 3.427 -10.749) 16.225 15.265 ( -1.276 5.998 -2.627) 6.671 15.735 ( 3.824 3.118 -2.054) 5.345 15.789 ( 10.137 5.882 -4.729) 12.638 16.215 ( -2.360 2.956 -0.940) 3.898 16.360 ( -1.021 -1.929 -1.441) 2.615 16.491 ( 1.894 -5.290 3.922) 6.852 16.591 ( 4.560 2.215 2.108) 5.490 16.744 ( -2.839 -0.219 4.225) 5.095 16.894 ( -2.971 0.218 2.993) 4.223 17.680 ( -17.795 3.176 7.031) 19.396 18.137 ( -5.398 10.376 -2.636) 11.990 19.075 ( 9.472 -0.754 11.052) 14.575 19.163 ( 9.093 -1.777 5.963) 11.019 ======================= Grid point 182 (62/125) ======================= q-point: (-0.22 0.11 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 325 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.304 ( -4.764 10.880 9.014) 14.911 1.617 ( -6.758 17.107 12.358) 22.160 1.927 ( -1.808 -3.166 0.506) 3.681 2.456 ( -0.936 4.610 15.042) 15.761 2.667 ( 3.633 0.567 -0.614) 3.728 2.787 ( -3.540 1.462 4.519) 5.923 4.849 ( 2.701 1.999 0.135) 3.363 5.027 ( -2.908 2.348 10.338) 10.993 5.434 ( -1.809 10.049 -6.708) 12.217 6.325 ( -5.461 -4.483 -2.298) 7.430 6.688 ( 7.503 -7.503 11.765) 15.843 7.071 ( 5.443 -1.842 12.459) 13.721 7.333 ( 5.827 7.379 1.236) 9.483 7.751 ( -18.982 -10.577 12.075) 24.859 8.542 ( 5.414 5.799 4.012) 8.891 8.739 ( 3.705 -2.970 1.580) 5.004 9.386 ( 17.517 -12.097 -1.879) 21.370 9.757 ( 7.639 4.376 4.135) 9.726 9.990 ( 1.689 -14.186 2.046) 14.432 10.155 ( -0.976 -10.389 -5.413) 11.755 10.290 ( -8.904 9.132 -9.983) 16.197 10.502 ( -8.567 -6.411 -4.046) 11.440 10.903 ( -3.780 16.507 -14.010) 21.979 11.089 ( 1.736 7.609 -24.148) 25.378 11.391 ( 1.548 -6.829 11.753) 13.681 12.137 ( 2.270 -7.134 7.229) 10.407 12.304 ( 0.471 -6.554 4.080) 7.734 12.603 ( -5.505 -8.915 1.761) 10.625 12.828 ( 4.127 -3.809 -7.146) 9.089 12.913 ( -0.322 5.788 -0.306) 5.805 13.085 ( -1.860 -4.480 2.890) 5.646 13.403 ( 0.008 3.107 0.848) 3.220 13.582 ( -2.902 -5.913 -4.135) 7.777 13.858 ( -1.042 3.154 -2.570) 4.200 13.974 ( 20.518 2.891 3.473) 21.010 14.378 ( -3.256 -1.023 1.936) 3.924 14.616 ( -2.182 6.804 -6.311) 9.533 14.693 ( -10.560 5.946 -5.432) 13.281 14.735 ( -1.923 0.615 -8.213) 8.458 14.867 ( -3.797 -0.440 -5.874) 7.008 15.000 ( -1.800 0.768 -3.869) 4.335 15.173 ( -2.069 1.299 0.328) 2.465 15.722 ( 3.982 4.850 -2.794) 6.869 15.845 ( 8.833 3.509 -7.226) 11.940 16.146 ( -1.360 2.684 0.719) 3.094 16.333 ( -4.569 0.946 -1.425) 4.878 16.574 ( -1.532 -4.369 5.892) 7.493 16.616 ( 3.131 1.080 5.570) 6.481 16.719 ( -2.282 -0.489 -0.474) 2.382 16.882 ( 4.670 1.484 2.347) 5.433 17.395 ( -15.213 4.554 7.254) 17.458 17.890 ( -4.113 12.131 -3.090) 13.177 19.153 ( 5.960 2.817 11.629) 13.367 19.358 ( 4.837 -10.040 9.831) 14.861 ======================= Grid point 183 (63/125) ======================= q-point: (-0.11 0.11 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 185 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.109 ( 0.000 8.195 18.334) 20.083 1.312 ( 0.000 15.164 18.623) 24.016 1.940 ( 0.000 0.961 8.549) 8.603 2.354 ( 0.000 5.762 16.587) 17.560 2.712 ( 0.000 0.255 -12.378) 12.380 2.725 ( 0.000 0.917 10.022) 10.063 4.844 ( 0.000 0.652 -2.895) 2.968 4.945 ( 0.000 3.401 14.244) 14.644 5.293 ( 0.000 8.231 -9.857) 12.842 6.338 ( -0.000 -1.767 -3.785) 4.178 6.856 ( -0.000 -6.465 18.587) 19.680 6.970 ( 0.000 8.100 4.167) 9.109 7.608 ( -0.000 -7.509 9.220) 11.891 7.683 ( -0.000 -13.984 6.322) 15.347 8.443 ( 0.000 11.823 7.281) 13.886 8.844 ( -0.000 -7.949 -5.599) 9.723 9.518 ( 0.000 4.049 2.188) 4.602 9.933 ( 0.000 3.333 2.315) 4.058 10.006 ( -0.000 -11.927 -1.314) 11.999 10.121 ( 0.000 0.343 -11.075) 11.081 10.435 ( -0.000 -2.460 -4.304) 4.958 10.442 ( 0.000 4.667 -8.022) 9.281 10.648 ( 0.000 2.674 -6.871) 7.373 11.020 ( 0.000 2.647 -21.494) 21.657 11.519 ( -0.000 -7.511 13.929) 15.825 12.288 ( -0.000 -9.847 9.076) 13.392 12.382 ( -0.000 -2.974 12.254) 12.610 12.685 ( -0.000 -1.953 -0.138) 1.958 12.793 ( -0.000 -0.337 -2.794) 2.815 12.975 ( -0.000 -5.188 -10.803) 11.984 13.142 ( -0.000 -5.435 4.399) 6.992 13.321 ( 0.000 6.036 -3.796) 7.130 13.665 ( -0.000 -6.762 -3.314) 7.531 13.818 ( 0.000 0.438 -4.159) 4.182 14.197 ( 0.000 2.280 1.159) 2.557 14.267 ( 0.000 4.916 -1.516) 5.144 14.410 ( 0.000 3.874 -1.965) 4.344 14.526 ( 0.000 9.228 -6.294) 11.171 14.618 ( 0.000 16.533 -11.168) 19.952 14.875 ( -0.000 -5.093 -8.092) 9.561 15.010 ( -0.000 -3.785 2.353) 4.457 15.175 ( -0.000 -2.403 0.979) 2.595 15.680 ( 0.000 4.444 -4.180) 6.101 15.893 ( 0.000 1.040 -8.718) 8.780 16.099 ( 0.000 2.164 1.153) 2.452 16.237 ( 0.000 3.530 -1.788) 3.957 16.604 ( -0.000 -1.979 7.064) 7.336 16.632 ( 0.000 0.273 8.167) 8.171 16.698 ( 0.000 0.202 -0.460) 0.503 16.940 ( -0.000 -0.056 0.327) 0.332 17.190 ( 0.000 4.225 7.548) 8.650 17.682 ( 0.000 10.375 -2.511) 10.674 19.156 ( 0.000 2.036 12.456) 12.621 19.588 ( -0.000 -14.787 8.838) 17.227 ======================= Grid point 186 (64/125) ======================= q-point: ( 0.22 0.22 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 185 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.509 ( 8.182 0.000 7.825) 11.321 1.611 ( 18.493 0.000 5.876) 19.404 2.213 ( 2.246 0.000 0.756) 2.370 2.475 ( -1.332 -0.000 -4.940) 5.116 2.676 ( 0.857 0.000 5.774) 5.837 2.685 ( 12.509 0.000 9.169) 15.510 4.798 ( -0.427 -0.000 3.171) 3.200 5.325 ( 6.009 0.000 -8.868) 10.713 5.865 ( 28.288 0.000 6.085) 28.935 6.342 ( -2.937 -0.000 -8.060) 8.579 6.602 ( -16.434 -0.000 10.954) 19.750 6.700 ( -3.978 -0.000 13.952) 14.508 7.085 ( 5.113 0.000 23.218) 23.774 7.541 ( -10.800 -0.000 18.328) 21.273 8.104 ( -12.189 -0.000 -5.712) 13.461 8.932 ( -10.647 -0.000 1.556) 10.760 9.052 ( -21.447 -0.000 2.419) 21.583 9.608 ( -19.532 -0.000 5.438) 20.275 9.961 ( 16.728 0.000 -23.408) 28.771 10.089 ( 16.880 0.000 9.922) 19.580 10.549 ( -12.365 -0.000 -2.007) 12.527 10.678 ( -2.726 -0.000 -5.131) 5.810 10.941 ( 7.329 0.000 -26.703) 27.691 11.188 ( 16.812 0.000 -13.666) 21.666 11.303 ( -9.587 -0.000 10.545) 14.252 12.123 ( -7.711 -0.000 8.693) 11.620 12.172 ( -16.905 -0.000 -8.758) 19.039 12.499 ( 1.673 0.000 12.856) 12.964 12.588 ( 0.850 0.000 4.909) 4.982 13.192 ( -3.064 -0.000 -6.053) 6.784 13.381 ( -4.601 -0.000 4.680) 6.563 13.511 ( -0.348 -0.000 -3.918) 3.933 13.552 ( -6.635 -0.000 -0.837) 6.688 13.766 ( -4.498 -0.000 -8.470) 9.590 13.864 ( 4.859 0.000 -0.331) 4.870 14.294 ( 11.002 0.000 -2.380) 11.256 14.514 ( 7.097 0.000 5.260) 8.834 14.661 ( 1.652 0.000 1.040) 1.952 14.919 ( -5.946 -0.000 -6.099) 8.518 15.168 ( 0.374 0.000 -1.926) 1.962 15.177 ( 20.038 0.000 -9.580) 22.210 15.319 ( 1.223 0.000 -10.728) 10.797 15.558 ( 7.527 0.000 -2.021) 7.794 15.745 ( 16.879 0.000 -2.219) 17.024 16.020 ( -1.625 -0.000 4.596) 4.875 16.381 ( -9.578 -0.000 3.136) 10.078 16.389 ( -4.554 -0.000 2.114) 5.021 16.592 ( 1.929 0.000 -5.722) 6.039 16.828 ( 1.986 0.000 7.304) 7.569 16.904 ( -3.370 -0.000 6.603) 7.413 17.935 ( 10.951 0.000 6.889) 12.938 18.207 ( 20.680 0.000 0.509) 20.686 18.547 ( -15.175 -0.000 13.853) 20.547 19.508 ( -3.435 -0.000 -7.868) 8.585 ======================= Grid point 187 (65/125) ======================= q-point: ( 0.33 0.22 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 325 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.596 ( 4.638 -0.322 4.333) 6.356 1.847 ( 12.498 -1.512 0.367) 12.594 2.255 ( 6.117 0.625 5.572) 8.298 2.499 ( 1.187 -2.263 -0.667) 2.641 2.665 ( 2.467 3.082 5.725) 6.954 2.841 ( 4.258 -3.359 3.532) 6.473 4.771 ( -0.711 2.453 4.975) 5.592 5.406 ( 1.185 -4.632 -12.606) 13.482 5.887 ( 2.934 20.051 4.170) 20.689 6.361 ( -3.760 3.997 1.806) 5.777 6.605 ( 6.894 -8.375 11.246) 15.625 6.776 ( 12.638 -10.484 9.572) 19.006 7.200 ( 6.171 -7.474 18.077) 20.511 7.466 ( -6.994 -3.695 15.813) 17.681 8.005 ( -12.579 -9.000 -1.777) 15.569 8.519 ( -20.723 16.914 7.535) 27.790 8.929 ( -8.761 -4.450 3.720) 10.507 9.361 ( -18.795 -0.572 4.447) 19.322 10.086 ( 16.937 9.411 -10.794) 22.180 10.218 ( -12.233 7.955 -2.037) 14.734 10.473 ( 10.657 -10.539 -2.762) 15.241 10.683 ( -4.589 -4.465 -7.227) 9.655 11.009 ( 3.353 0.610 -27.204) 27.417 11.181 ( -7.785 -0.271 7.707) 10.958 11.431 ( 17.955 -0.010 -13.044) 22.193 11.977 ( -13.914 -2.809 -6.361) 15.555 12.013 ( -9.287 0.251 5.505) 10.799 12.514 ( 0.352 0.243 9.610) 9.619 12.613 ( 0.772 -1.433 4.985) 5.244 13.157 ( -3.690 -1.607 -4.876) 6.323 13.237 ( -7.560 7.856 -0.621) 10.920 13.336 ( -3.037 7.597 -2.685) 8.611 13.537 ( -0.246 1.079 0.887) 1.418 13.755 ( -4.249 -7.306 -6.372) 10.585 14.055 ( 5.769 -7.325 2.983) 9.789 14.398 ( 8.240 2.690 -0.948) 8.720 14.580 ( 5.438 1.401 3.028) 6.380 14.692 ( -0.566 -1.670 3.222) 3.673 14.844 ( -4.893 -0.712 -5.297) 7.246 15.134 ( 1.192 4.936 -2.028) 5.468 15.366 ( 5.362 -1.134 -5.246) 7.587 15.432 ( 13.264 0.824 -11.592) 17.635 15.670 ( 9.791 0.496 0.581) 9.821 15.895 ( 9.676 6.440 0.153) 11.624 16.051 ( 4.152 -3.546 1.273) 5.606 16.288 ( -6.558 -2.773 2.300) 7.482 16.339 ( -3.802 -0.727 0.913) 3.978 16.611 ( 2.669 1.233 -7.786) 8.323 16.818 ( -3.304 0.511 6.750) 7.533 16.870 ( -3.580 -2.662 4.693) 6.475 18.085 ( 6.657 -2.795 7.916) 10.714 18.232 ( -14.459 -0.679 6.212) 15.752 18.589 ( 18.016 -0.661 8.103) 19.765 19.439 ( 0.680 6.006 -8.112) 10.116 ======================= Grid point 188 (66/125) ======================= q-point: ( 0.44 0.22 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 325 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.644 ( 3.488 1.192 2.021) 4.203 1.955 ( 3.797 1.052 -4.077) 5.670 2.367 ( 8.561 -1.204 9.725) 13.012 2.531 ( -1.516 -0.178 1.658) 2.253 2.645 ( 2.214 3.351 6.951) 8.028 2.889 ( -2.458 -1.558 3.481) 4.537 4.739 ( 2.795 1.610 7.673) 8.324 5.474 ( 3.434 9.202 -4.018) 10.612 5.641 ( -7.159 -4.693 -7.578) 11.432 6.143 ( -4.632 11.722 4.201) 13.286 6.875 ( 13.240 -0.042 14.327) 19.508 7.114 ( 11.927 -11.154 13.158) 20.972 7.362 ( -10.880 4.870 10.067) 15.602 7.604 ( 15.121 -23.144 4.281) 27.976 7.946 ( -11.646 0.615 6.711) 13.455 8.164 ( -8.533 -7.693 7.597) 13.774 8.894 ( -2.761 -1.119 7.241) 7.830 9.075 ( -17.160 6.833 0.044) 18.471 9.943 ( -15.583 -1.224 2.954) 15.907 10.156 ( 14.068 9.833 -8.427) 19.121 10.610 ( -4.130 -0.407 -6.248) 7.501 10.800 ( 5.887 -6.686 -7.593) 11.705 11.018 ( 1.317 0.637 -23.883) 23.928 11.115 ( -5.073 -1.828 3.774) 6.582 11.635 ( 15.228 3.224 -13.262) 20.449 11.881 ( -12.178 -7.430 -8.153) 16.431 11.902 ( -5.542 0.258 5.461) 7.785 12.498 ( -1.205 0.840 6.622) 6.783 12.649 ( 0.151 -2.213 2.487) 3.332 13.005 ( -6.523 8.033 -3.575) 10.948 13.142 ( -2.125 -1.016 -2.873) 3.715 13.238 ( -2.316 0.672 -0.230) 2.423 13.526 ( -0.461 -0.220 3.448) 3.486 13.820 ( -4.531 -7.879 -5.985) 10.883 14.183 ( 7.896 2.880 3.537) 9.118 14.458 ( 6.514 1.482 0.246) 6.685 14.628 ( 2.470 0.489 1.793) 3.091 14.683 ( -1.376 -0.654 -0.086) 1.526 14.818 ( -2.587 -1.737 -0.143) 3.119 15.050 ( -1.193 5.864 -0.969) 6.062 15.396 ( 1.016 3.626 -6.892) 7.854 15.521 ( 6.924 5.152 -6.848) 11.017 15.790 ( 9.545 2.614 1.506) 10.010 15.877 ( 3.325 3.081 1.840) 4.892 16.171 ( 5.114 -2.835 0.583) 5.876 16.300 ( 0.226 -2.777 0.568) 2.843 16.311 ( -2.404 -0.996 -0.752) 2.708 16.632 ( 3.999 1.636 -7.295) 8.479 16.763 ( -4.879 -1.069 3.447) 6.068 16.867 ( -3.346 -2.557 3.178) 5.276 17.985 ( -16.431 0.462 9.193) 18.833 18.244 ( 1.628 -5.416 4.544) 7.255 18.834 ( 16.917 0.363 6.990) 18.308 19.356 ( 4.428 8.593 -5.012) 10.889 ======================= Grid point 189 (67/125) ======================= q-point: (-0.44 0.22 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 325 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.649 ( 2.756 3.572 0.051) 4.512 1.950 ( 0.534 2.556 -4.865) 5.521 2.403 ( -6.738 7.405 3.276) 10.534 2.486 ( 4.286 0.256 9.967) 10.852 2.634 ( 1.958 1.130 5.856) 6.277 2.856 ( -4.618 -1.247 5.488) 7.281 4.824 ( 9.132 -1.461 9.821) 13.490 5.257 ( -0.275 13.179 2.175) 13.360 5.813 ( -5.463 -18.081 -15.949) 24.722 5.950 ( 2.844 9.640 2.432) 10.341 6.812 ( -14.969 10.503 14.839) 23.550 7.061 ( 6.708 12.962 15.426) 21.236 7.435 ( -0.744 -12.538 17.609) 21.629 7.904 ( 0.895 -0.365 0.340) 1.024 8.160 ( 6.899 -20.891 -1.305) 22.040 8.352 ( 8.514 -15.352 5.865) 18.509 8.798 ( -5.503 2.208 -1.036) 6.019 8.915 ( 1.361 -4.891 11.668) 12.725 9.832 ( -15.728 -9.995 1.911) 18.732 10.164 ( 10.592 10.325 -4.440) 15.443 10.513 ( -6.279 3.342 -7.220) 10.135 10.848 ( -2.063 3.123 -11.154) 11.765 11.035 ( -0.271 -0.273 -15.160) 15.165 11.124 ( -0.549 -4.539 -0.173) 4.576 11.716 ( 10.193 8.407 -14.176) 19.378 11.875 ( -1.197 -2.013 2.763) 3.622 11.886 ( -7.822 -10.397 -8.348) 15.458 12.474 ( -0.381 0.168 6.055) 6.070 12.657 ( -3.245 -0.290 -3.939) 5.111 12.874 ( -2.532 -0.871 2.654) 3.770 13.129 ( 0.774 1.353 -1.169) 1.949 13.243 ( -2.844 -5.227 -2.258) 6.365 13.520 ( -1.903 -0.573 4.304) 4.741 13.875 ( -3.245 -6.042 -5.336) 8.690 14.198 ( 11.508 10.630 4.485) 16.295 14.515 ( 4.375 2.044 2.482) 5.430 14.612 ( -0.741 0.944 1.463) 1.893 14.710 ( 1.029 -1.381 -4.008) 4.362 14.808 ( -1.901 -0.242 4.035) 4.467 14.942 ( -4.125 1.675 -2.339) 5.029 15.266 ( -6.256 8.305 -6.316) 12.166 15.483 ( 2.667 7.182 -5.888) 9.662 15.799 ( 1.156 2.229 1.193) 2.780 15.946 ( 10.310 3.178 -0.825) 10.820 16.275 ( -1.888 0.300 -0.747) 2.052 16.292 ( 3.307 -3.995 1.813) 5.494 16.351 ( 1.360 -1.622 1.157) 2.412 16.659 ( 3.569 1.902 -4.124) 5.776 16.724 ( -3.524 -1.076 -0.955) 3.806 16.866 ( -1.620 -1.928 1.302) 2.835 17.757 ( -15.104 1.614 9.179) 17.748 18.296 ( -2.486 -1.174 0.479) 2.791 19.017 ( 11.778 0.657 8.321) 14.436 19.309 ( 6.846 6.989 0.329) 9.789 ======================= Grid point 190 (68/125) ======================= q-point: (-0.33 0.22 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 325 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.598 ( 0.766 6.672 -0.876) 6.773 1.908 ( 0.256 2.884 -3.423) 4.483 2.122 ( -7.819 13.703 5.196) 16.611 2.511 ( 1.256 0.928 11.696) 11.800 2.668 ( 2.988 -0.542 -0.234) 3.046 2.811 ( -4.383 -0.546 8.089) 9.216 4.944 ( 6.523 2.815 8.753) 11.274 5.121 ( 1.217 4.801 1.988) 5.337 5.809 ( 2.875 11.712 -3.297) 12.503 6.032 ( -7.580 -14.656 -13.222) 21.144 6.497 ( -6.700 0.746 21.115) 22.165 7.070 ( 12.822 5.303 15.414) 20.739 7.459 ( -14.943 -4.131 15.776) 22.118 7.785 ( -1.432 11.136 -0.641) 11.246 8.435 ( 0.476 -12.576 5.227) 13.627 8.679 ( 7.480 -4.249 2.976) 9.103 8.933 ( 9.214 -13.474 -2.084) 16.455 9.240 ( 11.559 -25.413 7.790) 28.985 9.797 ( -14.449 -10.724 -1.799) 18.084 10.118 ( 6.876 11.180 2.351) 13.334 10.361 ( -7.359 3.061 -10.118) 12.880 10.697 ( -4.044 9.449 -12.835) 16.443 11.051 ( -0.489 -1.789 -8.930) 9.121 11.178 ( -0.380 -3.386 -1.526) 3.733 11.621 ( 4.616 16.712 -21.377) 27.524 11.932 ( 0.195 -6.068 5.834) 8.420 11.989 ( -3.418 -12.237 -7.978) 15.003 12.477 ( 0.066 0.130 10.970) 10.971 12.636 ( -2.177 -4.579 -8.119) 9.572 12.924 ( -0.296 -5.517 3.802) 6.706 13.111 ( 1.342 3.482 -1.489) 4.018 13.315 ( -1.072 -7.435 -3.369) 8.233 13.487 ( -3.285 0.237 5.082) 6.056 13.919 ( -1.280 -2.984 -4.896) 5.875 14.201 ( 15.402 10.855 5.420) 19.607 14.462 ( -1.425 6.755 6.956) 9.800 14.618 ( -0.499 -2.258 -1.772) 2.914 14.729 ( 0.360 0.218 -4.451) 4.471 14.785 ( -1.603 -1.388 1.496) 2.595 14.924 ( -1.513 -2.822 -3.086) 4.447 14.996 ( -11.036 10.200 -5.832) 16.119 15.385 ( 0.697 8.200 -6.684) 10.602 15.789 ( 0.640 0.494 0.149) 0.822 16.005 ( 8.271 5.836 -4.692) 11.157 16.216 ( -2.758 1.830 -0.093) 3.311 16.370 ( 1.937 0.612 0.308) 2.054 16.413 ( -0.097 -5.669 6.165) 8.376 16.664 ( 1.720 1.672 -0.369) 2.427 16.700 ( -2.192 -0.703 -4.356) 4.927 16.890 ( 1.951 -0.826 -0.153) 2.124 17.538 ( -10.923 3.956 9.699) 15.134 18.213 ( -3.152 6.288 -2.961) 7.632 19.139 ( 5.906 -1.529 10.851) 12.448 19.306 ( 5.038 4.408 4.716) 8.189 ======================= Grid point 191 (69/125) ======================= q-point: (-0.22 0.22 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 185 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.457 ( 0.000 11.213 2.266) 11.440 1.827 ( 0.000 16.440 8.859) 18.675 1.889 ( -0.000 -0.444 -0.980) 1.076 2.502 ( 0.000 1.594 12.525) 12.626 2.708 ( -0.000 -0.622 -9.053) 9.074 2.764 ( 0.000 1.325 14.452) 14.513 4.918 ( 0.000 3.905 3.169) 5.029 5.074 ( 0.000 4.220 6.541) 7.784 5.600 ( 0.000 13.664 -5.599) 14.767 6.170 ( -0.000 -10.325 -2.352) 10.589 6.587 ( -0.000 -10.821 12.034) 16.183 7.192 ( 0.000 4.376 19.935) 20.410 7.290 ( -0.000 -5.584 5.002) 7.496 7.626 ( 0.000 8.291 3.977) 9.196 8.580 ( -0.000 -4.748 5.262) 7.088 8.740 ( -0.000 -0.855 3.924) 4.016 9.295 ( -0.000 -18.017 -1.878) 18.115 9.788 ( -0.000 -7.395 -1.756) 7.601 9.806 ( -0.000 -27.577 1.331) 27.609 9.988 ( 0.000 9.507 7.370) 12.029 10.270 ( 0.000 1.723 -13.152) 13.264 10.506 ( 0.000 9.685 -9.564) 13.611 11.035 ( 0.000 4.126 -14.623) 15.194 11.231 ( -0.000 -0.680 -0.922) 1.146 11.383 ( 0.000 12.883 -15.509) 20.162 12.041 ( -0.000 -7.053 6.838) 9.824 12.158 ( -0.000 -11.613 -6.171) 13.151 12.485 ( -0.000 -2.532 11.015) 11.302 12.733 ( -0.000 -8.096 -9.572) 12.537 13.003 ( -0.000 -4.873 3.757) 6.153 13.038 ( 0.000 7.313 -0.317) 7.320 13.439 ( -0.000 -8.288 -5.080) 9.721 13.441 ( 0.000 1.591 5.299) 5.532 13.912 ( 0.000 2.954 -4.104) 5.056 14.282 ( 0.000 1.890 3.937) 4.368 14.292 ( 0.000 6.330 6.369) 8.979 14.660 ( -0.000 -3.216 -3.400) 4.680 14.707 ( 0.000 12.089 -5.132) 13.133 14.714 ( 0.000 1.915 -4.220) 4.634 14.815 ( -0.000 -3.128 -1.398) 3.426 14.974 ( -0.000 -3.114 -5.321) 6.165 15.255 ( 0.000 8.574 -6.117) 10.532 15.791 ( 0.000 0.733 -0.228) 0.767 15.969 ( 0.000 5.725 -8.169) 9.975 16.167 ( 0.000 1.886 1.433) 2.369 16.353 ( 0.000 2.899 -0.869) 3.027 16.490 ( -0.000 -4.871 6.638) 8.233 16.655 ( 0.000 1.308 5.370) 5.527 16.692 ( -0.000 -0.511 -6.061) 6.083 16.927 ( -0.000 -0.900 -0.547) 1.053 17.373 ( 0.000 6.180 10.273) 11.988 18.049 ( 0.000 11.246 -3.968) 11.925 19.214 ( -0.000 -1.591 13.255) 13.350 19.299 ( -0.000 -0.453 7.047) 7.061 ======================= Grid point 196 (70/125) ======================= q-point: ( 0.33 0.33 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 185 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.646 ( 3.910 0.000 3.922) 5.538 1.987 ( 8.098 0.000 -3.327) 8.755 2.356 ( 8.375 0.000 9.541) 12.696 2.504 ( 1.372 0.000 0.211) 1.389 2.724 ( 2.298 0.000 5.594) 6.048 2.841 ( -0.587 -0.000 -0.942) 1.110 4.802 ( 2.485 0.000 3.517) 4.306 5.302 ( -7.795 -0.000 -10.750) 13.279 6.083 ( -17.189 -0.000 4.881) 17.869 6.281 ( 9.148 0.000 6.303) 11.110 6.770 ( 9.324 0.000 13.476) 16.387 6.881 ( 30.129 0.000 3.704) 30.356 7.215 ( 3.961 0.000 19.526) 19.924 7.423 ( 2.204 0.000 13.114) 13.298 7.734 ( -14.361 -0.000 -5.930) 15.537 8.495 ( -18.502 -0.000 7.231) 19.865 8.631 ( -11.811 -0.000 12.038) 16.864 9.121 ( -15.177 -0.000 8.159) 17.231 10.069 ( -22.096 -0.000 -1.559) 22.151 10.438 ( 16.728 0.000 -27.118) 31.862 10.509 ( 8.986 0.000 2.984) 9.468 10.588 ( 1.488 0.000 -1.527) 2.132 11.054 ( 1.889 0.000 -28.397) 28.460 11.068 ( -7.845 -0.000 5.989) 9.870 11.679 ( 18.219 0.000 -14.673) 23.392 11.750 ( -13.477 -0.000 -8.682) 16.032 11.911 ( -8.244 -0.000 7.900) 11.419 12.514 ( -0.966 -0.000 3.455) 3.587 12.631 ( 2.522 0.000 8.541) 8.905 13.081 ( -4.711 -0.000 -3.797) 6.051 13.182 ( -9.065 -0.000 -0.987) 9.118 13.397 ( -6.582 -0.000 -4.701) 8.089 13.430 ( -2.614 -0.000 -3.694) 4.525 13.658 ( -3.349 -0.000 -4.936) 5.965 14.149 ( 14.568 0.000 12.866) 19.436 14.500 ( 4.656 0.000 -0.032) 4.656 14.652 ( -1.246 -0.000 -0.599) 1.383 14.655 ( 0.620 0.000 6.852) 6.880 14.790 ( -1.275 -0.000 -5.831) 5.969 15.194 ( 0.344 0.000 0.790) 0.862 15.456 ( 8.751 0.000 -7.915) 11.799 15.626 ( 11.743 0.000 -4.690) 12.645 15.793 ( 8.787 0.000 3.522) 9.467 15.966 ( -2.162 -0.000 4.775) 5.242 16.173 ( -5.181 -0.000 1.946) 5.534 16.204 ( 15.005 0.000 -4.455) 15.652 16.286 ( -3.034 -0.000 -0.272) 3.047 16.657 ( 2.742 0.000 -6.420) 6.982 16.740 ( -6.149 -0.000 -2.875) 6.788 16.817 ( -2.551 -0.000 3.440) 4.283 17.993 ( -17.254 -0.000 10.421) 20.157 18.135 ( 3.385 0.000 7.463) 8.195 18.842 ( 18.131 0.000 5.533) 18.957 19.506 ( 2.391 0.000 -8.261) 8.600 ======================= Grid point 197 (71/125) ======================= q-point: ( 0.44 0.33 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 325 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.700 ( 3.829 0.183 2.838) 4.770 2.042 ( 3.543 2.566 -4.857) 6.537 2.467 ( 6.953 0.059 9.994) 12.175 2.511 ( -0.987 -0.101 2.470) 2.662 2.724 ( 1.559 3.126 4.752) 5.898 2.817 ( -4.445 -1.254 0.305) 4.628 4.840 ( 7.737 2.840 4.599) 9.438 5.293 ( -6.659 -11.992 -8.740) 16.265 5.720 ( -14.555 12.265 5.856) 19.915 6.331 ( 9.091 12.169 5.158) 16.042 7.021 ( 13.106 -10.090 11.643) 20.227 7.118 ( 1.465 7.742 17.644) 19.323 7.378 ( 1.387 -0.072 -0.415) 1.449 7.484 ( 13.417 -13.203 3.450) 19.137 7.734 ( -3.190 -15.534 5.408) 16.755 8.108 ( -5.662 13.072 11.163) 18.098 8.660 ( -12.444 -13.617 9.149) 20.591 8.944 ( -9.474 1.751 9.123) 13.268 9.723 ( -21.704 2.765 1.405) 21.925 10.478 ( 0.835 5.075 -13.682) 14.617 10.556 ( 8.229 3.579 -7.767) 11.868 10.817 ( 9.734 -5.373 -5.208) 12.278 10.984 ( -4.327 -2.009 2.173) 5.242 11.062 ( -1.260 0.424 -25.390) 25.425 11.630 ( -9.607 -4.630 -8.251) 13.484 11.801 ( -5.739 0.155 6.614) 8.758 11.906 ( 14.976 1.201 -15.406) 21.519 12.490 ( -2.347 0.154 -0.267) 2.367 12.661 ( 2.705 0.914 7.214) 7.759 13.008 ( -9.396 5.261 -4.300) 11.595 13.052 ( -3.637 -3.095 -2.977) 5.628 13.242 ( -3.349 4.531 1.863) 5.934 13.478 ( -2.481 -4.383 -3.543) 6.158 13.656 ( -2.787 -5.053 -3.598) 6.800 14.351 ( 14.319 0.695 12.511) 19.027 14.539 ( 2.421 0.549 1.132) 2.729 14.635 ( -2.252 0.139 3.472) 4.141 14.653 ( -0.015 -1.494 -2.423) 2.846 14.796 ( 0.781 -0.217 -1.225) 1.468 15.125 ( -3.848 5.627 3.429) 7.630 15.526 ( 6.193 6.363 -6.833) 11.204 15.694 ( 5.428 5.733 -1.128) 7.975 15.902 ( 1.572 2.861 3.179) 4.557 15.945 ( 6.525 -2.096 4.292) 8.086 16.149 ( -1.102 -3.028 1.800) 3.691 16.262 ( -1.909 -1.324 -1.025) 2.539 16.349 ( 5.340 0.361 -1.432) 5.540 16.674 ( -1.078 -1.341 -2.531) 3.061 16.714 ( 2.432 1.233 -13.002) 13.285 16.794 ( -2.187 -2.097 -0.283) 3.043 17.783 ( -13.658 0.261 11.497) 17.855 18.183 ( -0.188 -3.358 5.494) 6.442 19.048 ( 13.020 0.576 5.607) 14.188 19.509 ( 3.367 4.295 -5.624) 7.837 ======================= Grid point 198 (72/125) ======================= q-point: (-0.44 0.33 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 325 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.727 ( 2.264 1.946 0.550) 3.036 2.021 ( 1.558 3.994 -5.669) 7.107 2.423 ( -4.202 5.224 1.833) 6.950 2.553 ( 3.933 0.673 11.210) 11.899 2.686 ( 0.373 2.287 1.180) 2.600 2.776 ( -3.413 -0.696 5.542) 6.546 4.960 ( 13.193 -0.109 6.152) 14.557 5.357 ( -12.690 6.374 5.543) 15.244 5.467 ( -3.895 -13.720 -8.231) 16.466 6.257 ( 13.726 15.471 2.851) 20.878 6.782 ( -17.634 14.221 13.175) 26.206 7.275 ( 0.635 -2.093 21.755) 21.864 7.318 ( 4.390 2.102 1.400) 5.065 7.890 ( 1.206 -18.085 -0.405) 18.129 8.008 ( 12.306 -0.194 7.324) 14.322 8.165 ( 8.416 -21.851 6.198) 24.222 8.633 ( -11.957 -7.112 1.369) 13.980 8.861 ( -1.257 -1.163 12.960) 13.072 9.505 ( -13.547 -6.232 4.091) 15.463 10.402 ( -0.498 4.413 -13.265) 13.989 10.549 ( 4.417 9.177 -1.775) 10.338 10.889 ( 1.764 1.886 -10.635) 10.944 10.989 ( -4.835 -0.019 -7.221) 8.690 11.077 ( 2.465 -4.032 -14.353) 15.111 11.640 ( -4.627 -8.807 -8.224) 12.907 11.766 ( -2.528 -3.527 6.857) 8.114 12.020 ( 9.671 7.282 -18.767) 22.333 12.469 ( -1.119 -1.717 -3.912) 4.416 12.653 ( -0.359 4.328 3.781) 5.758 12.829 ( -5.006 1.386 2.009) 5.570 13.088 ( -1.305 -5.430 -2.783) 6.240 13.171 ( -1.721 0.870 1.919) 2.720 13.494 ( -1.079 -0.979 -0.783) 1.654 13.726 ( -1.961 -7.571 -3.469) 8.555 14.474 ( 11.103 5.385 9.755) 15.730 14.565 ( 1.659 -0.067 1.550) 2.271 14.607 ( -1.131 0.457 3.941) 4.125 14.688 ( 0.185 -2.216 -3.790) 4.394 14.812 ( 0.583 -0.745 1.591) 1.851 14.943 ( -6.654 7.197 3.122) 10.287 15.400 ( -0.185 14.050 -4.337) 14.706 15.631 ( 1.783 7.670 -2.608) 8.296 15.844 ( -0.019 3.667 1.681) 4.034 16.091 ( 7.842 -1.499 2.299) 8.309 16.225 ( 0.613 -6.076 4.092) 7.351 16.254 ( -1.981 0.109 -1.845) 2.709 16.373 ( 0.466 -0.189 2.672) 2.719 16.678 ( -0.573 -0.419 -13.136) 13.156 16.705 ( -0.372 1.092 -3.774) 3.947 16.841 ( 2.460 -2.170 -3.925) 5.115 17.622 ( -8.325 1.529 11.719) 14.456 18.227 ( -1.593 -3.552 2.449) 4.600 19.164 ( 6.688 1.513 6.558) 9.488 19.472 ( 2.948 5.663 -1.657) 6.596 ======================= Grid point 199 (73/125) ======================= q-point: (-0.33 0.33 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 185 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.693 ( 0.000 4.398 -1.254) 4.573 1.968 ( 0.000 4.043 -5.930) 7.177 2.260 ( 0.000 10.635 3.224) 11.113 2.548 ( 0.000 2.447 12.332) 12.573 2.684 ( -0.000 -0.484 -5.371) 5.393 2.760 ( -0.000 -0.936 11.496) 11.534 5.090 ( 0.000 6.832 12.499) 14.245 5.146 ( -0.000 -0.321 -1.348) 1.386 5.689 ( -0.000 -17.672 -8.648) 19.674 6.128 ( 0.000 18.815 -6.762) 19.993 6.450 ( 0.000 4.833 23.995) 24.477 7.278 ( 0.000 1.069 27.271) 27.292 7.308 ( 0.000 3.202 -0.598) 3.258 7.940 ( 0.000 9.817 0.993) 9.867 8.197 ( -0.000 -16.690 6.377) 17.866 8.609 ( -0.000 -16.842 1.212) 16.886 8.746 ( -0.000 -15.216 -1.083) 15.254 8.955 ( -0.000 -15.623 13.637) 20.737 9.537 ( -0.000 -8.919 1.448) 9.036 10.344 ( 0.000 3.354 -14.685) 15.063 10.390 ( 0.000 13.414 3.826) 13.949 10.811 ( 0.000 8.241 -19.204) 20.897 10.992 ( -0.000 -4.127 1.857) 4.526 11.140 ( -0.000 -2.214 -12.561) 12.754 11.768 ( -0.000 -11.048 -8.857) 14.160 11.833 ( -0.000 -6.101 6.696) 9.059 11.911 ( 0.000 13.672 -21.911) 25.827 12.531 ( -0.000 -5.120 -8.948) 10.309 12.538 ( 0.000 5.651 10.313) 11.760 12.842 ( -0.000 -4.397 4.203) 6.082 13.148 ( 0.000 0.738 -0.296) 0.795 13.184 ( -0.000 -7.440 -3.563) 8.249 13.484 ( 0.000 1.071 2.885) 3.077 13.827 ( -0.000 -6.842 -3.919) 7.885 14.489 ( 0.000 8.398 10.813) 13.691 14.518 ( 0.000 4.591 3.971) 6.070 14.591 ( -0.000 -0.785 0.866) 1.168 14.718 ( -0.000 -1.515 -4.221) 4.485 14.790 ( 0.000 3.713 3.648) 5.205 14.857 ( -0.000 -3.280 -3.536) 4.823 15.145 ( 0.000 16.097 -3.368) 16.445 15.518 ( 0.000 8.195 -5.238) 9.726 15.803 ( 0.000 1.497 0.726) 1.664 16.170 ( 0.000 5.446 -5.529) 7.761 16.191 ( -0.000 -0.902 3.106) 3.234 16.323 ( -0.000 -5.839 5.825) 8.248 16.386 ( -0.000 -0.480 3.356) 3.390 16.676 ( -0.000 -0.263 -13.278) 13.280 16.692 ( 0.000 0.594 -0.681) 0.904 16.888 ( -0.000 -1.485 -3.142) 3.475 17.524 ( 0.000 3.375 11.526) 12.010 18.243 ( 0.000 0.325 -0.738) 0.807 19.183 ( 0.000 1.432 8.427) 8.548 19.411 ( 0.000 5.032 2.204) 5.494 ======================= Grid point 206 (74/125) ======================= q-point: ( 0.44 0.44 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 185 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.751 ( 3.081 0.000 2.956) 4.270 2.099 ( 1.692 0.000 -4.648) 4.946 2.489 ( -1.665 -0.000 1.537) 2.266 2.550 ( 4.521 0.000 12.309) 13.114 2.738 ( -4.449 -0.000 -2.680) 5.194 2.778 ( 1.340 0.000 5.946) 6.095 5.029 ( 14.673 0.000 2.774) 14.932 5.099 ( -4.675 -0.000 -3.658) 5.936 5.542 ( -21.183 -0.000 8.373) 22.778 6.674 ( 17.294 0.000 -4.577) 17.889 7.055 ( 10.039 0.000 17.638) 20.295 7.242 ( -2.875 -0.000 21.244) 21.438 7.279 ( -13.267 -0.000 -1.809) 13.389 7.536 ( 5.888 0.000 -1.230) 6.015 7.573 ( 5.875 0.000 5.224) 7.862 8.294 ( 7.143 0.000 4.295) 8.335 8.330 ( -8.438 -0.000 14.236) 16.549 8.869 ( -4.035 -0.000 12.301) 12.946 9.439 ( -20.985 -0.000 4.171) 21.396 10.441 ( -2.823 -0.000 -10.773) 11.136 10.808 ( 9.868 0.000 -27.259) 28.990 10.871 ( 6.377 0.000 8.863) 10.918 10.912 ( -1.809 -0.000 5.306) 5.606 11.043 ( -2.641 -0.000 -29.523) 29.641 11.495 ( -5.039 -0.000 -8.205) 9.629 11.711 ( -5.457 -0.000 7.743) 9.473 12.119 ( 13.388 0.000 -16.328) 21.115 12.440 ( -4.793 -0.000 -5.646) 7.406 12.723 ( 4.762 0.000 6.581) 8.123 12.921 ( -9.713 -0.000 -2.471) 10.022 12.982 ( -2.145 -0.000 -2.270) 3.123 13.254 ( -3.085 -0.000 4.823) 5.726 13.391 ( -0.617 -0.000 -5.095) 5.133 13.596 ( -1.202 -0.000 -3.476) 3.678 14.553 ( 11.436 0.000 11.786) 16.422 14.555 ( 0.184 0.000 2.194) 2.202 14.616 ( 1.670 0.000 5.459) 5.708 14.642 ( 0.386 0.000 -3.050) 3.074 14.800 ( -0.492 -0.000 -0.595) 0.772 15.084 ( -8.090 -0.000 6.400) 10.315 15.695 ( 7.684 0.000 -6.072) 9.793 15.803 ( 1.542 0.000 1.420) 2.096 15.949 ( 1.451 0.000 3.548) 3.834 15.980 ( 3.712 0.000 7.809) 8.646 16.104 ( -0.819 -0.000 0.040) 0.820 16.223 ( -1.455 -0.000 -3.665) 3.943 16.365 ( -1.807 -0.000 4.157) 4.532 16.679 ( 2.088 0.000 -18.763) 18.879 16.732 ( -2.598 -0.000 -1.703) 3.106 16.787 ( 4.463 0.000 -8.569) 9.662 17.643 ( -7.455 -0.000 13.047) 15.027 18.146 ( -1.045 -0.000 5.089) 5.195 19.186 ( 6.838 0.000 5.194) 8.587 19.577 ( 1.892 0.000 -4.899) 5.252 ======================= Grid point 207 (75/125) ======================= q-point: (-0.44 -0.56 0.25) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 185 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.766 ( 0.000 0.930 1.837) 2.059 2.088 ( 0.000 2.780 -4.978) 5.702 2.457 ( 0.000 2.511 1.700) 3.032 2.587 ( -0.000 -0.349 13.061) 13.066 2.696 ( 0.000 0.853 -3.661) 3.759 2.774 ( 0.000 1.450 6.845) 6.997 5.087 ( -0.000 -2.134 -2.668) 3.417 5.275 ( 0.000 3.777 17.597) 17.998 5.277 ( -0.000 -7.120 -6.897) 9.913 6.682 ( 0.000 15.449 -8.668) 17.714 6.853 ( 0.000 19.270 17.778) 26.218 7.231 ( -0.000 -5.142 19.050) 19.732 7.341 ( -0.000 -3.894 2.357) 4.552 7.660 ( -0.000 -11.426 1.201) 11.489 7.806 ( -0.000 -22.716 7.530) 23.932 8.230 ( 0.000 5.032 12.419) 13.400 8.418 ( -0.000 -5.382 -1.239) 5.523 8.843 ( -0.000 -0.138 13.271) 13.272 9.308 ( -0.000 -4.315 6.976) 8.202 10.415 ( 0.000 0.892 -11.886) 11.920 10.762 ( 0.000 10.171 -6.161) 11.891 10.895 ( -0.000 -1.720 3.668) 4.051 10.990 ( 0.000 3.052 -29.232) 29.391 11.022 ( -0.000 -5.691 -8.886) 10.552 11.500 ( -0.000 -4.971 -8.148) 9.545 11.692 ( -0.000 -2.545 7.559) 7.976 12.197 ( 0.000 4.484 -16.828) 17.415 12.407 ( -0.000 -2.415 -8.569) 8.903 12.764 ( 0.000 6.080 1.610) 6.290 12.787 ( 0.000 0.414 4.370) 4.390 13.000 ( -0.000 -3.944 -2.161) 4.497 13.191 ( 0.000 3.205 4.426) 5.465 13.444 ( -0.000 -4.541 -3.928) 6.004 13.618 ( -0.000 -4.114 -2.762) 4.955 14.556 ( -0.000 -0.042 2.034) 2.034 14.585 ( 0.000 0.068 2.222) 2.223 14.658 ( -0.000 -1.523 -3.503) 3.820 14.681 ( 0.000 3.364 17.619) 17.937 14.786 ( -0.000 -0.985 -2.747) 2.919 14.976 ( 0.000 4.328 6.140) 7.512 15.633 ( 0.000 13.340 -4.993) 14.244 15.750 ( 0.000 5.686 1.987) 6.023 15.916 ( 0.000 4.825 2.153) 5.283 16.078 ( -0.000 -6.207 5.747) 8.459 16.140 ( -0.000 -4.790 1.459) 5.008 16.233 ( -0.000 -1.483 -3.729) 4.013 16.356 ( -0.000 -0.891 5.256) 5.331 16.688 ( 0.000 0.742 -21.282) 21.295 16.707 ( 0.000 0.681 -2.745) 2.829 16.836 ( -0.000 -1.643 -6.313) 6.523 17.586 ( 0.000 0.855 13.130) 13.158 18.162 ( -0.000 -2.931 4.008) 4.965 19.227 ( 0.000 0.700 5.520) 5.564 19.562 ( 0.000 3.416 -3.474) 4.872 ======================= Grid point 249 (76/125) ======================= q-point: ( 0.00 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 100 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.481 ( 0.000 0.000 22.111) 22.111 1.532 ( 0.000 0.000 25.106) 25.106 2.010 ( 0.000 0.000 -3.573) 3.573 2.391 ( 0.000 0.000 -18.946) 18.946 2.620 ( 0.000 0.000 17.618) 17.618 2.801 ( 0.000 0.000 3.969) 3.969 4.781 ( 0.000 0.000 -1.662) 1.662 4.967 ( 0.000 0.000 -5.819) 5.819 5.268 ( 0.000 0.000 21.765) 21.765 6.093 ( 0.000 0.000 -18.468) 18.468 7.007 ( 0.000 0.000 10.700) 10.700 7.556 ( 0.000 0.000 -16.802) 16.802 7.603 ( 0.000 0.000 33.795) 33.795 8.022 ( 0.000 0.000 6.082) 6.082 8.662 ( 0.000 0.000 29.198) 29.198 8.866 ( 0.000 0.000 -8.174) 8.174 9.449 ( 0.000 0.000 -27.335) 27.335 9.594 ( 0.000 0.000 -16.732) 16.732 9.655 ( 0.000 0.000 11.555) 11.555 10.201 ( 0.000 0.000 -16.317) 16.317 10.227 ( 0.000 0.000 4.407) 4.407 10.414 ( 0.000 0.000 -4.276) 4.276 10.667 ( 0.000 0.000 4.187) 4.187 10.852 ( 0.000 0.000 -7.250) 7.250 11.998 ( 0.000 0.000 17.897) 17.897 12.593 ( 0.000 0.000 -4.696) 4.696 12.657 ( 0.000 0.000 4.943) 4.943 12.712 ( 0.000 0.000 7.431) 7.431 12.860 ( 0.000 0.000 6.363) 6.363 12.886 ( 0.000 0.000 -6.361) 6.361 13.015 ( 0.000 0.000 -7.956) 7.956 13.511 ( 0.000 0.000 -18.656) 18.656 13.563 ( 0.000 0.000 8.197) 8.197 13.656 ( 0.000 0.000 1.760) 1.760 13.988 ( 0.000 0.000 -2.047) 2.047 14.101 ( 0.000 0.000 -10.097) 10.097 14.224 ( 0.000 0.000 6.467) 6.467 14.382 ( 0.000 0.000 -1.942) 1.942 14.388 ( 0.000 0.000 5.746) 5.746 14.761 ( 0.000 0.000 -12.172) 12.172 15.160 ( 0.000 0.000 3.488) 3.488 15.256 ( 0.000 0.000 0.555) 0.555 15.532 ( 0.000 0.000 -1.511) 1.511 15.668 ( 0.000 0.000 -8.850) 8.850 16.092 ( 0.000 0.000 1.618) 1.618 16.151 ( 0.000 0.000 -1.483) 1.483 16.728 ( 0.000 0.000 2.963) 2.963 16.733 ( 0.000 0.000 1.727) 1.727 16.777 ( 0.000 0.000 6.920) 6.920 16.935 ( 0.000 0.000 -1.280) 1.280 17.253 ( 0.000 0.000 6.826) 6.826 17.463 ( 0.000 0.000 -3.165) 3.165 19.386 ( 0.000 0.000 13.621) 13.621 19.815 ( 0.000 0.000 -8.101) 8.101 ======================= Grid point 250 (77/125) ======================= q-point: ( 0.11 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.477 ( 0.971 0.967 20.017) 20.064 1.588 ( 1.726 -6.509 21.522) 22.551 2.014 ( 2.906 3.045 -4.300) 6.017 2.390 ( -1.420 -2.078 -17.157) 17.341 2.656 ( 2.471 -2.119 15.764) 16.096 2.819 ( -0.081 -2.540 3.796) 4.568 4.800 ( 1.074 -1.518 1.252) 2.242 5.037 ( 3.240 -5.107 -6.820) 9.116 5.312 ( 6.443 0.104 20.097) 21.105 6.097 ( 1.173 -0.155 -18.332) 18.370 7.014 ( -2.372 -2.067 10.323) 10.792 7.443 ( -15.180 2.066 -7.887) 17.231 7.529 ( 0.714 8.435 30.228) 31.391 8.047 ( 8.966 3.578 -1.592) 9.784 8.582 ( -13.059 -5.830 20.646) 25.115 8.891 ( 5.198 4.716 4.119) 8.138 9.396 ( -7.310 -3.089 -18.357) 19.999 9.629 ( -3.780 -2.505 -14.659) 15.344 9.815 ( 5.675 -10.153 5.194) 12.738 10.193 ( 4.962 1.410 -4.756) 7.016 10.278 ( 2.889 3.203 -8.308) 9.361 10.322 ( -4.471 -0.108 -4.405) 6.277 10.671 ( 1.424 1.956 -0.683) 2.514 10.780 ( -1.465 6.613 -6.810) 9.604 11.907 ( -4.757 6.066 16.800) 18.484 12.466 ( -7.837 7.789 -6.654) 12.898 12.578 ( -3.176 5.025 4.563) 7.494 12.742 ( -1.564 -4.077 5.419) 6.960 12.789 ( -3.221 -2.407 5.415) 6.745 12.930 ( 8.964 8.460 -3.333) 12.768 13.130 ( 2.700 -6.072 -3.949) 7.730 13.414 ( 2.122 9.005 6.716) 11.433 13.591 ( 4.870 -3.299 -14.295) 15.458 13.727 ( 4.888 6.782 -5.108) 9.797 13.963 ( -10.485 -7.828 1.732) 13.198 14.111 ( -9.439 -9.366 -4.373) 13.998 14.330 ( 4.715 -5.005 0.559) 6.899 14.411 ( 6.646 -5.396 -2.282) 8.860 14.478 ( 7.761 -0.693 2.967) 8.338 14.765 ( 2.924 1.687 -10.777) 11.293 15.145 ( 1.643 3.135 4.024) 5.359 15.264 ( 4.079 2.634 0.186) 4.859 15.511 ( -6.135 -3.555 -2.210) 7.427 15.580 ( -12.931 -3.923 -6.476) 14.985 16.125 ( 2.726 -1.057 3.154) 4.300 16.266 ( 11.176 -0.227 -4.082) 11.900 16.696 ( -4.238 0.714 3.336) 5.440 16.732 ( 0.454 1.664 1.509) 2.291 16.801 ( 3.852 0.253 4.478) 5.913 16.875 ( -5.147 -1.342 1.663) 5.573 17.394 ( 15.031 -2.488 5.095) 16.065 17.555 ( 7.511 -4.806 -2.504) 9.262 19.340 ( -6.689 0.038 12.839) 14.477 19.715 ( -7.547 5.522 -5.587) 10.893 ======================= Grid point 251 (78/125) ======================= q-point: ( 0.22 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.522 ( 4.909 -1.398 12.349) 13.362 1.725 ( 0.009 -6.894 9.705) 11.904 2.021 ( 7.045 0.951 1.612) 7.290 2.438 ( 0.951 -4.223 -12.040) 12.794 2.718 ( 1.952 -1.350 11.493) 11.736 2.887 ( 1.773 -4.777 3.838) 6.379 4.846 ( 0.815 -2.248 5.437) 5.940 5.164 ( 2.503 -4.639 -7.797) 9.412 5.421 ( 10.168 0.505 17.168) 19.960 6.145 ( 5.035 -0.014 -18.138) 18.824 6.956 ( -8.131 0.971 9.804) 12.774 7.144 ( -18.599 3.262 0.984) 18.909 7.457 ( 5.560 3.577 24.038) 24.931 8.139 ( 10.960 3.469 -11.372) 16.170 8.542 ( -11.063 -9.334 21.568) 25.975 8.859 ( -0.566 2.331 12.611) 12.838 9.243 ( -16.606 6.745 -6.855) 19.190 9.580 ( -5.313 -4.242 -10.406) 12.430 9.959 ( -10.650 6.899 -1.571) 12.786 10.082 ( 5.641 -0.140 -6.337) 8.485 10.349 ( 9.842 -4.115 -6.863) 12.684 10.465 ( 3.927 -6.219 -6.226) 9.636 10.657 ( -0.235 5.276 -8.810) 10.271 10.675 ( 5.877 1.127 -7.138) 9.314 11.736 ( -5.265 6.144 15.904) 17.844 12.259 ( -5.773 6.176 -5.581) 10.130 12.423 ( -5.072 7.382 3.430) 9.591 12.703 ( -4.481 3.873 -5.666) 8.197 12.831 ( -0.551 -4.816 6.551) 8.149 12.936 ( 9.395 5.872 2.861) 11.443 13.176 ( -2.189 -0.889 2.279) 3.283 13.378 ( -0.685 1.964 2.458) 3.220 13.618 ( 0.675 2.423 -2.122) 3.291 13.730 ( 5.586 -1.219 -7.902) 9.754 13.902 ( -3.756 2.236 2.729) 5.153 14.150 ( -6.776 -8.695 -11.230) 15.736 14.472 ( 1.392 -6.399 -0.609) 6.577 14.576 ( 5.524 -1.881 -2.335) 6.286 14.660 ( 9.536 -5.601 -1.545) 11.167 14.817 ( 7.486 -1.593 -7.376) 10.629 15.113 ( 1.395 3.320 4.443) 5.719 15.281 ( 6.024 3.805 -0.874) 7.178 15.501 ( -8.527 -6.067 -3.957) 11.188 15.516 ( -5.307 -5.726 -3.139) 8.415 16.172 ( 1.133 -1.485 4.259) 4.650 16.364 ( 4.614 1.594 -5.034) 7.012 16.613 ( -6.131 0.682 2.332) 6.595 16.644 ( -6.781 2.458 0.462) 7.227 16.867 ( 6.052 -0.307 5.367) 8.095 16.924 ( 6.219 -1.598 2.298) 6.819 17.677 ( 19.078 -3.601 4.149) 19.853 17.785 ( 11.810 -7.368 -1.435) 13.994 19.215 ( -11.981 -0.435 10.929) 16.223 19.483 ( -10.914 7.331 -1.822) 13.274 ======================= Grid point 252 (79/125) ======================= q-point: ( 0.33 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.599 ( 3.050 -0.216 6.403) 7.096 1.789 ( 1.208 -2.693 -2.507) 3.872 2.212 ( 10.286 -7.625 8.610) 15.430 2.522 ( 1.832 -3.178 -5.655) 6.741 2.759 ( 1.522 -1.414 11.053) 11.247 2.990 ( 2.752 -3.734 2.468) 5.254 4.888 ( -0.112 -2.933 8.660) 9.144 5.207 ( 0.076 1.649 -2.218) 2.765 5.545 ( 6.568 -0.857 7.235) 9.809 6.137 ( -0.406 8.428 -15.954) 18.048 6.873 ( 0.186 -2.656 10.637) 10.966 6.996 ( -5.764 -7.317 3.361) 9.902 7.550 ( 5.846 -3.631 13.865) 15.479 8.150 ( -2.411 6.010 -13.522) 14.993 8.555 ( 0.178 -0.793 24.177) 24.190 8.805 ( -7.242 0.558 12.590) 14.535 8.878 ( -15.140 2.971 6.327) 16.675 9.446 ( -12.098 16.160 -5.122) 20.827 9.722 ( -5.022 -5.253 -5.712) 9.243 10.218 ( 9.672 1.041 -18.431) 20.840 10.454 ( -1.897 0.484 -0.479) 2.015 10.558 ( 1.509 4.228 -3.194) 5.509 10.615 ( 4.066 -8.506 -10.120) 13.831 10.883 ( 10.842 -6.799 -11.679) 17.326 11.595 ( -3.671 4.045 15.607) 16.536 12.122 ( -3.405 3.823 -5.459) 7.483 12.237 ( -5.145 6.923 2.870) 9.090 12.555 ( -3.743 6.803 -9.142) 11.995 12.893 ( 0.760 -3.060 5.714) 6.527 12.987 ( 6.846 2.220 2.248) 7.540 13.147 ( -1.489 1.440 3.490) 4.058 13.264 ( -9.797 0.326 1.890) 9.983 13.669 ( 2.846 -2.775 4.473) 5.984 13.793 ( 3.347 2.959 -0.803) 4.538 13.855 ( 2.204 -0.217 -2.287) 3.184 14.191 ( -2.684 -4.646 -14.386) 15.354 14.546 ( -0.220 -2.629 -2.138) 3.396 14.604 ( 0.681 2.061 -3.430) 4.059 14.845 ( 6.286 -4.636 -0.390) 7.820 14.988 ( 8.246 -3.283 -6.460) 10.977 15.084 ( 0.438 2.132 4.580) 5.071 15.315 ( 6.144 2.052 -2.818) 7.064 15.497 ( -5.854 -5.847 -1.252) 8.369 15.568 ( 0.068 -4.146 -3.115) 5.186 16.206 ( 0.274 -1.977 2.788) 3.429 16.360 ( 0.744 2.723 -4.740) 5.517 16.518 ( -6.299 1.654 0.853) 6.569 16.522 ( -5.825 0.658 0.426) 5.877 16.958 ( 5.776 -0.697 6.567) 8.774 17.028 ( 5.682 -0.681 2.643) 6.303 17.985 ( 18.360 -3.150 4.007) 19.054 18.069 ( 12.463 -7.225 -0.532) 14.415 19.049 ( -14.358 -1.451 8.598) 16.798 19.222 ( -10.778 7.233 0.102) 12.980 ======================= Grid point 253 (80/125) ======================= q-point: ( 0.44 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.617 ( 0.626 0.255 5.334) 5.377 1.845 ( 1.464 -1.102 -5.379) 5.682 2.443 ( 6.044 -6.409 5.916) 10.612 2.549 ( -0.930 1.348 1.044) 1.942 2.804 ( 1.370 -1.254 11.497) 11.646 3.058 ( 1.269 -1.230 1.881) 2.581 4.947 ( 0.226 -4.424 13.079) 13.809 5.128 ( -1.143 5.812 4.253) 7.292 5.639 ( 2.975 -4.198 -7.281) 8.916 5.921 ( -5.370 9.434 -11.253) 15.636 7.060 ( 5.074 -7.774 10.161) 13.763 7.143 ( 8.672 -7.563 10.252) 15.411 7.656 ( 0.413 -1.132 -0.746) 1.418 7.862 ( -13.557 9.001 -7.024) 17.724 8.587 ( 10.413 2.925 9.628) 14.481 8.721 ( -5.732 -4.413 7.622) 10.508 8.776 ( -8.584 -0.262 14.245) 16.633 9.045 ( -7.220 10.990 14.030) 19.229 9.779 ( -0.359 -3.243 -9.448) 9.996 10.306 ( 6.556 1.291 -24.866) 25.749 10.396 ( -4.855 -0.260 -3.976) 6.281 10.511 ( 0.445 2.129 -4.933) 5.391 10.787 ( 2.936 -4.164 -2.081) 5.503 11.073 ( 4.312 -3.268 -11.454) 12.668 11.519 ( -1.298 1.406 15.413) 15.532 12.048 ( -1.300 1.538 -2.649) 3.327 12.104 ( -2.265 2.825 -0.463) 3.650 12.431 ( -1.715 3.275 -10.172) 10.823 12.951 ( 1.866 -2.015 4.181) 5.003 13.020 ( 1.467 2.114 1.303) 2.884 13.104 ( 1.056 1.838 5.087) 5.511 13.167 ( -6.438 -1.899 1.075) 6.798 13.712 ( -0.344 -0.712 8.458) 8.494 13.796 ( 2.912 1.346 0.851) 3.319 13.904 ( 1.321 -0.959 -4.062) 4.378 14.219 ( -0.683 -1.584 -15.014) 15.112 14.557 ( -0.628 0.044 -2.714) 2.786 14.582 ( 0.190 0.731 -3.453) 3.535 14.957 ( 2.236 -2.192 -0.882) 3.253 15.058 ( -0.140 1.203 6.729) 6.837 15.092 ( 2.901 -0.628 -6.774) 7.396 15.368 ( 3.318 0.254 -5.129) 6.114 15.511 ( -2.246 -2.477 2.131) 3.965 15.621 ( 0.608 -1.522 -3.348) 3.727 16.249 ( 0.770 -2.584 0.177) 2.702 16.315 ( -0.440 2.989 -3.753) 4.818 16.434 ( -2.632 0.891 0.649) 2.853 16.457 ( -2.705 -0.045 -0.913) 2.855 17.026 ( 2.473 -0.424 7.229) 7.652 17.085 ( 1.901 -0.105 3.547) 4.025 18.231 ( 11.250 -1.307 3.458) 11.841 18.290 ( 5.363 -3.641 1.034) 6.564 18.916 ( -8.656 -3.212 5.815) 10.911 18.995 ( -5.911 6.151 1.406) 8.646 ======================= Grid point 259 (81/125) ======================= q-point: ( 0.11 0.11 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.524 ( 2.345 0.000 18.398) 18.547 1.553 ( 4.443 0.000 16.433) 17.023 2.094 ( 4.174 0.000 -3.721) 5.592 2.339 ( -2.106 -0.000 -15.084) 15.231 2.692 ( 4.969 0.000 13.851) 14.716 2.788 ( -0.990 -0.000 4.078) 4.197 4.819 ( 2.991 0.000 2.886) 4.156 5.060 ( 5.381 0.000 -5.394) 7.619 5.455 ( 14.315 0.000 16.173) 21.598 6.104 ( 1.331 0.000 -16.126) 16.181 6.976 ( -2.510 -0.000 9.102) 9.441 7.247 ( -17.894 -0.000 -1.846) 17.989 7.601 ( -0.267 -0.000 31.932) 31.933 8.117 ( 1.045 0.000 -5.696) 5.791 8.319 ( -16.446 -0.000 19.222) 25.297 9.031 ( 4.632 0.000 3.508) 5.811 9.256 ( -5.413 -0.000 -25.869) 26.430 9.544 ( -8.167 -0.000 -7.997) 11.430 9.881 ( 14.702 0.000 12.943) 19.587 10.136 ( -16.092 -0.000 0.305) 16.095 10.290 ( 5.965 0.000 -12.688) 14.020 10.437 ( 13.054 0.000 -14.105) 19.219 10.695 ( -1.065 -0.000 0.260) 1.097 10.778 ( -5.177 -0.000 -6.027) 7.945 11.851 ( -9.877 -0.000 15.880) 18.701 12.390 ( -13.455 -0.000 -12.031) 18.050 12.519 ( -7.814 -0.000 8.852) 11.807 12.679 ( -2.358 -0.000 4.802) 5.350 12.738 ( 0.370 0.000 12.001) 12.007 13.074 ( 1.398 0.000 -8.507) 8.621 13.214 ( 11.551 0.000 -2.851) 11.897 13.583 ( 3.327 0.000 -14.844) 15.212 13.645 ( 4.076 0.000 10.500) 11.264 13.739 ( -4.402 -0.000 -0.909) 4.494 13.836 ( -10.219 -0.000 -5.226) 11.478 13.929 ( 7.101 0.000 -2.106) 7.406 14.382 ( 6.732 0.000 1.336) 6.864 14.460 ( 10.813 0.000 -4.628) 11.762 14.575 ( 7.636 0.000 2.030) 7.901 14.817 ( 2.633 0.000 -10.114) 10.451 15.190 ( -0.531 -0.000 2.889) 2.937 15.361 ( -12.095 -0.000 -4.187) 12.799 15.377 ( 8.474 0.000 -1.236) 8.563 15.408 ( -2.345 -0.000 -2.537) 3.455 16.147 ( 1.330 0.000 5.641) 5.796 16.393 ( 5.916 0.000 -6.429) 8.736 16.624 ( -6.543 -0.000 3.624) 7.479 16.683 ( -9.095 -0.000 0.354) 9.102 16.855 ( 4.358 0.000 5.053) 6.673 16.891 ( 7.888 0.000 2.275) 8.210 17.623 ( 20.986 0.000 2.234) 21.105 17.661 ( 13.455 0.000 0.657) 13.471 19.212 ( -12.249 -0.000 13.286) 18.071 19.621 ( -12.160 -0.000 -7.132) 14.097 ======================= Grid point 260 (82/125) ======================= q-point: ( 0.22 0.11 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.589 ( 6.474 -0.250 9.643) 11.617 1.649 ( 3.148 -4.547 9.629) 11.104 2.132 ( 6.148 1.666 -0.106) 6.371 2.375 ( 1.361 -4.890 -9.805) 11.040 2.739 ( 1.980 0.743 8.454) 8.714 2.833 ( 2.243 -5.023 4.538) 7.131 4.860 ( 2.661 0.223 5.848) 6.429 5.151 ( 3.676 -2.813 -7.090) 8.467 5.646 ( 17.315 4.783 12.921) 22.128 6.177 ( 5.253 -4.095 -13.835) 15.355 6.901 ( -5.582 3.054 6.615) 9.178 6.970 ( -16.170 3.838 4.390) 17.189 7.558 ( 0.635 2.779 26.253) 26.407 8.111 ( -10.114 -5.011 -0.855) 11.320 8.236 ( -7.605 -11.958 14.679) 20.403 8.990 ( 4.091 8.692 4.016) 10.412 9.138 ( -14.293 7.506 -8.405) 18.200 9.482 ( 0.231 -3.893 -10.549) 11.247 9.894 ( -16.481 4.010 -0.259) 16.964 10.140 ( 14.350 -5.476 8.218) 17.420 10.355 ( 2.196 -1.836 -23.288) 23.463 10.529 ( 0.776 5.232 0.515) 5.315 10.707 ( -4.307 1.008 -5.397) 6.978 10.733 ( 11.253 -3.487 -11.681) 16.590 11.687 ( -10.904 1.808 14.920) 18.568 12.193 ( -13.013 0.559 -10.236) 16.566 12.393 ( -8.416 2.470 8.278) 12.060 12.654 ( -4.044 -0.809 0.204) 4.129 12.765 ( 0.789 -1.887 11.262) 11.446 13.083 ( 0.651 0.033 -7.572) 7.600 13.255 ( 4.338 8.898 -0.955) 9.945 13.445 ( -3.875 9.438 -0.166) 10.204 13.606 ( -4.067 0.147 3.077) 5.102 13.735 ( -0.838 -5.720 -5.565) 8.024 13.932 ( 0.999 -7.894 -2.726) 8.411 14.055 ( 12.922 2.760 -3.951) 13.791 14.460 ( 6.092 -0.011 2.133) 6.454 14.677 ( 7.776 -6.334 -3.377) 10.583 14.684 ( 9.867 2.484 -3.340) 10.709 14.868 ( 5.130 -3.187 -7.490) 9.621 15.128 ( -4.224 1.510 0.982) 4.592 15.270 ( -7.561 -4.547 -6.379) 10.888 15.440 ( 7.671 0.992 1.457) 7.871 15.514 ( 10.675 0.562 -1.599) 10.809 16.158 ( -0.570 -0.904 6.213) 6.304 16.421 ( 0.427 0.999 -6.355) 6.447 16.533 ( -6.490 0.449 1.838) 6.760 16.553 ( -9.048 0.327 1.048) 9.115 16.923 ( 3.983 -0.958 5.449) 6.817 16.990 ( 4.607 -1.166 1.841) 5.096 17.884 ( 15.873 -2.768 3.366) 16.460 17.930 ( 21.919 -1.440 0.846) 21.982 19.026 ( -15.129 -0.201 12.965) 19.926 19.423 ( -11.236 4.327 -6.896) 13.876 ======================= Grid point 261 (83/125) ======================= q-point: ( 0.33 0.11 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.641 ( 2.219 0.749 5.559) 6.032 1.774 ( 4.578 -3.375 -0.906) 5.760 2.256 ( 9.621 -3.626 5.975) 11.892 2.489 ( 2.952 -4.792 -4.746) 7.362 2.756 ( 1.160 -0.713 9.221) 9.321 2.948 ( 1.843 -5.190 1.778) 5.788 4.879 ( 0.905 -0.016 7.946) 7.997 5.223 ( 1.636 -2.006 -9.488) 9.835 5.705 ( 7.176 9.949 11.633) 16.905 6.231 ( -2.161 6.601 -11.591) 13.513 6.822 ( -0.739 -4.681 5.553) 7.300 6.885 ( 6.883 -5.220 4.127) 9.573 7.584 ( 3.186 -2.381 18.633) 19.053 8.030 ( -14.490 -4.691 4.496) 15.880 8.377 ( -5.713 -14.616 11.268) 19.319 8.722 ( -19.428 10.985 5.540) 22.996 8.922 ( 6.447 9.053 7.239) 13.264 9.539 ( -14.648 13.391 -2.190) 19.967 9.606 ( 4.126 -5.390 -11.266) 13.153 10.329 ( -5.059 -0.996 -20.687) 21.320 10.351 ( 3.974 -1.179 0.037) 4.145 10.574 ( 7.120 -5.094 1.754) 8.928 10.628 ( -2.847 1.586 -7.661) 8.325 10.975 ( 13.964 -3.165 -13.067) 19.384 11.536 ( -9.194 -0.145 14.378) 17.067 12.042 ( -11.414 -2.198 -10.168) 15.443 12.229 ( -7.581 4.343 8.022) 11.861 12.575 ( -4.940 3.084 -6.209) 8.513 12.806 ( -0.835 -3.289 9.781) 10.353 13.093 ( 0.127 -0.242 -6.682) 6.687 13.133 ( -3.604 5.411 2.271) 6.886 13.258 ( -1.895 6.831 2.079) 7.388 13.633 ( -0.124 -3.640 5.268) 6.405 13.809 ( -1.721 -5.947 -4.951) 7.927 13.994 ( 7.421 5.797 -0.714) 9.444 14.182 ( 9.440 0.701 -7.204) 11.896 14.534 ( 3.419 -0.753 0.902) 3.615 14.692 ( 2.681 5.185 -4.054) 7.107 14.839 ( 3.775 -5.056 0.525) 6.332 15.035 ( 2.926 -2.723 -6.581) 7.700 15.080 ( 3.021 -0.100 -0.391) 3.048 15.278 ( -2.413 -4.608 -6.631) 8.428 15.540 ( 10.390 2.324 2.794) 11.008 15.636 ( 10.933 2.704 -2.029) 11.444 16.170 ( -0.814 -2.160 4.616) 5.161 16.393 ( -1.776 1.404 -5.104) 5.583 16.439 ( -6.275 0.041 0.928) 6.344 16.454 ( -4.926 -0.096 -1.131) 5.055 16.981 ( 1.035 -1.962 6.017) 6.413 17.042 ( -0.790 -2.251 2.844) 3.711 18.138 ( 12.748 -4.276 4.435) 14.158 18.212 ( 15.548 -0.640 0.416) 15.566 18.846 ( -11.320 -1.164 12.356) 16.797 19.216 ( -6.126 6.680 -6.431) 11.114 ======================= Grid point 262 (84/125) ======================= q-point: ( 0.44 0.11 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.643 ( 1.125 1.665 4.675) 5.089 1.846 ( 1.265 -0.822 -4.895) 5.123 2.444 ( 7.033 -4.354 5.892) 10.156 2.556 ( 0.021 0.093 -0.173) 0.197 2.789 ( 0.300 -1.568 10.610) 10.729 3.021 ( -1.233 -3.311 1.109) 3.703 4.911 ( 1.836 -2.853 11.178) 11.681 5.245 ( 3.395 5.576 -2.099) 6.857 5.615 ( -1.398 0.418 -1.683) 2.228 5.984 ( -7.327 11.602 -8.746) 16.272 7.030 ( 9.718 -7.345 10.109) 15.830 7.184 ( 14.603 -7.832 4.851) 17.266 7.672 ( 0.649 -0.099 4.041) 4.094 7.823 ( -9.295 3.505 4.088) 10.742 8.377 ( -15.788 -7.975 10.703) 20.674 8.558 ( -6.573 -8.991 6.101) 12.698 8.876 ( 6.407 8.320 9.374) 14.076 9.172 ( -5.772 10.773 11.164) 16.553 9.738 ( 4.444 -3.171 -13.093) 14.185 10.239 ( -10.852 -3.932 -6.412) 13.203 10.403 ( 2.582 1.539 -19.904) 20.129 10.552 ( -1.198 2.323 -6.548) 7.051 10.766 ( 4.806 -4.434 1.757) 6.771 11.155 ( 9.291 1.191 -12.978) 16.005 11.454 ( -6.396 -2.701 13.610) 15.278 11.959 ( -9.363 -5.068 -10.706) 15.099 12.086 ( -4.524 2.520 7.882) 9.431 12.456 ( -3.407 3.657 -9.802) 11.003 12.838 ( -3.634 -4.081 8.385) 10.008 13.017 ( -3.532 1.329 4.917) 6.198 13.093 ( -1.549 0.108 -3.569) 3.892 13.203 ( 2.110 1.055 -1.247) 2.669 13.678 ( -1.415 -3.250 6.230) 7.168 13.862 ( -2.499 -4.164 -4.355) 6.523 13.981 ( 9.504 10.073 2.527) 14.077 14.278 ( 8.460 2.322 -8.629) 12.305 14.568 ( 2.016 0.847 -1.191) 2.490 14.641 ( 1.292 4.085 -3.368) 5.450 14.930 ( 0.139 -3.337 0.940) 3.469 15.014 ( -3.994 -0.738 2.831) 4.951 15.149 ( 3.339 2.259 -7.109) 8.172 15.321 ( -0.272 -1.861 -5.436) 5.752 15.631 ( 10.491 4.235 2.248) 11.534 15.710 ( 7.834 4.121 -2.109) 9.100 16.210 ( 0.503 -3.262 1.668) 3.698 16.330 ( -3.245 1.906 -3.109) 4.882 16.385 ( -2.544 -1.696 1.063) 3.237 16.442 ( 1.086 -1.156 -3.870) 4.183 16.998 ( -3.758 -2.059 6.574) 7.847 17.043 ( -4.185 -2.585 3.464) 6.017 18.269 ( -5.912 0.807 4.026) 7.198 18.318 ( 3.576 -1.650 1.392) 4.177 18.842 ( 6.816 -2.742 9.117) 11.709 19.086 ( 3.541 6.471 -3.635) 8.223 ======================= Grid point 263 (85/125) ======================= q-point: (-0.44 0.11 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.623 ( -0.027 1.819 4.509) 4.862 1.841 ( -1.331 0.992 -5.500) 5.745 2.463 ( -6.391 6.390 4.580) 10.132 2.549 ( 2.075 -1.014 1.522) 2.766 2.788 ( -2.145 0.077 10.406) 10.625 3.022 ( -3.536 -1.441 1.363) 4.054 5.019 ( 5.083 -2.456 15.370) 16.374 5.146 ( 2.543 7.605 5.458) 9.700 5.674 ( -0.300 1.840 -11.338) 11.490 5.806 ( -2.344 -5.620 -12.178) 13.615 7.144 ( -9.430 7.405 13.561) 18.101 7.150 ( 1.654 6.910 13.369) 15.140 7.705 ( 5.859 -0.783 0.743) 5.958 7.929 ( 10.292 -5.193 -10.737) 15.754 8.339 ( -8.732 -7.509 14.232) 18.308 8.634 ( -0.623 -13.264 0.075) 13.279 8.867 ( 2.790 0.544 15.472) 15.731 9.151 ( 12.253 -0.689 16.614) 20.655 9.806 ( 1.156 -0.748 -12.701) 12.776 10.165 ( -9.206 -3.162 -8.503) 12.925 10.387 ( -3.349 -0.878 -10.553) 11.107 10.517 ( 0.173 1.757 -11.918) 12.048 10.806 ( -1.149 2.363 -1.432) 2.993 11.157 ( 2.162 8.794 -13.664) 16.393 11.448 ( -3.593 -5.091 13.202) 14.598 11.953 ( -6.337 -7.700 -10.921) 14.789 12.057 ( 0.016 -2.884 7.518) 8.052 12.411 ( 0.199 -1.279 -9.978) 10.061 12.823 ( -6.062 -2.927 8.573) 10.900 13.010 ( 0.280 -1.884 3.659) 4.125 13.065 ( -1.490 -0.005 -0.620) 1.614 13.251 ( 2.142 -2.865 -3.955) 5.333 13.689 ( -3.325 -1.841 5.779) 6.917 13.869 ( -1.136 -0.178 -3.077) 3.285 13.944 ( 9.422 10.509 5.034) 14.986 14.330 ( 7.821 5.117 -9.666) 13.445 14.572 ( 1.376 0.898 -1.681) 2.351 14.614 ( 1.503 1.900 -3.929) 4.616 14.932 ( -4.136 0.605 -0.861) 4.268 14.988 ( -3.501 -3.435 5.109) 7.082 15.092 ( -3.374 4.757 -5.176) 7.798 15.304 ( -2.551 1.482 -4.306) 5.220 15.679 ( 7.955 5.365 -0.501) 9.608 15.723 ( 5.766 5.421 -2.402) 8.271 16.265 ( -2.039 0.772 -1.382) 2.582 16.274 ( 1.652 -1.799 -0.637) 2.524 16.428 ( 2.325 -3.604 1.374) 4.503 16.501 ( 4.328 -1.274 -3.266) 5.570 16.945 ( -7.871 -1.614 6.623) 10.413 17.012 ( -5.833 -1.776 2.864) 6.736 18.081 ( -14.966 2.817 6.329) 16.492 18.276 ( -6.173 4.485 -3.088) 8.231 19.037 ( 12.639 -3.653 6.740) 14.783 19.125 ( 11.949 3.111 1.733) 12.468 ======================= Grid point 264 (86/125) ======================= q-point: (-0.33 0.11 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.583 ( -1.812 2.205 5.660) 6.339 1.808 ( -0.019 0.760 -4.726) 4.786 2.211 ( -10.574 9.981 9.369) 17.298 2.539 ( -1.482 2.055 -5.764) 6.296 2.752 ( -1.747 0.681 10.429) 10.596 2.982 ( -3.345 0.569 1.955) 3.916 4.991 ( 2.990 7.760 10.696) 13.548 5.200 ( 3.771 -2.462 8.371) 9.505 5.538 ( -4.117 7.743 -4.466) 9.841 5.971 ( -2.317 -11.272 -18.311) 21.626 6.932 ( 0.611 2.486 17.467) 17.653 7.143 ( 5.690 1.650 7.452) 9.520 7.611 ( -2.521 11.920 4.955) 13.152 7.973 ( -12.349 -4.325 -3.747) 13.610 8.566 ( 13.239 -9.014 14.017) 21.284 8.885 ( 0.908 -0.872 17.906) 17.950 8.927 ( 11.058 -12.397 -1.794) 16.708 9.466 ( 19.184 -10.237 4.253) 22.156 9.820 ( 0.296 -1.418 -11.393) 11.485 10.071 ( -7.595 0.718 -8.106) 11.131 10.361 ( -8.071 -4.915 -2.315) 9.729 10.472 ( -4.755 1.152 -6.470) 8.111 10.710 ( -1.074 5.332 -12.545) 13.673 10.952 ( -3.690 15.339 -14.694) 21.559 11.515 ( -1.135 -7.628 13.728) 15.746 12.026 ( -2.817 -9.515 -10.458) 14.417 12.158 ( 1.977 -7.359 6.953) 10.315 12.494 ( 2.707 -6.073 -9.194) 11.346 12.789 ( -5.391 -2.857 9.214) 11.051 13.000 ( 0.118 3.339 -1.726) 3.761 13.100 ( -0.149 -4.864 5.272) 7.175 13.337 ( 1.754 -4.685 -4.529) 6.748 13.631 ( -5.107 2.207 4.397) 7.092 13.838 ( -1.480 2.605 -5.242) 6.038 13.943 ( 14.050 8.064 8.124) 18.122 14.335 ( 6.823 6.055 -9.002) 12.816 14.587 ( 0.970 0.266 -2.962) 3.129 14.607 ( 1.415 1.411 -3.461) 3.997 14.818 ( -7.916 4.180 -1.636) 9.100 14.922 ( -10.186 3.917 -5.292) 12.128 15.007 ( -2.476 -3.198 4.938) 6.383 15.229 ( -3.823 1.768 -2.909) 5.118 15.690 ( 5.771 4.565 -2.567) 7.793 15.707 ( 6.808 7.045 -3.172) 10.298 16.225 ( -0.794 1.656 1.741) 2.530 16.318 ( 0.189 -1.033 -2.490) 2.702 16.537 ( 3.945 -4.244 1.453) 5.974 16.582 ( 4.315 -1.410 -1.395) 4.749 16.857 ( -7.685 -1.068 5.911) 9.753 16.948 ( -5.474 -0.411 1.594) 5.716 17.817 ( -15.238 4.753 7.257) 17.534 18.063 ( -8.250 9.157 -4.977) 13.292 19.245 ( 11.262 0.567 6.330) 12.931 19.272 ( 10.590 -4.352 4.616) 12.345 ======================= Grid point 265 (87/125) ======================= q-point: (-0.22 0.11 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.510 ( -1.865 2.872 11.580) 12.075 1.826 ( 2.510 2.433 1.702) 3.888 1.938 ( -8.102 5.078 8.476) 12.778 2.476 ( -1.291 2.867 -12.856) 13.235 2.721 ( -0.978 1.230 11.045) 11.157 2.920 ( -1.794 2.665 3.122) 4.479 4.916 ( 1.373 6.071 7.056) 9.409 5.235 ( 2.272 3.748 1.658) 4.686 5.347 ( -6.512 5.536 6.639) 10.823 6.048 ( -3.386 -4.862 -19.312) 20.201 7.056 ( 9.679 -5.411 17.287) 20.538 7.311 ( 8.961 -4.156 8.869) 13.275 7.389 ( 0.199 6.443 7.446) 9.849 7.838 ( -17.638 -4.992 -3.961) 18.754 8.754 ( 7.679 1.504 17.093) 18.799 8.873 ( -0.724 1.554 14.844) 14.943 9.315 ( 13.106 -10.546 -7.050) 18.240 9.761 ( 10.227 2.887 -13.977) 17.558 9.922 ( -3.435 -6.079 -2.527) 7.426 10.050 ( 11.653 -6.877 -1.400) 13.603 10.227 ( -13.341 2.512 2.680) 13.837 10.430 ( -10.268 -9.141 -3.351) 14.150 10.621 ( -2.477 17.411 -15.644) 23.538 10.669 ( -0.203 1.701 -16.040) 16.131 11.647 ( 0.599 -9.463 14.390) 17.234 12.171 ( 0.595 -11.058 -10.191) 15.050 12.309 ( 0.543 -9.286 6.882) 11.571 12.643 ( 2.663 -7.783 -8.916) 12.131 12.770 ( -3.961 -2.691 9.332) 10.489 12.932 ( -0.106 5.351 0.417) 5.369 13.176 ( 0.664 -4.485 6.453) 7.887 13.420 ( 1.939 0.600 -0.999) 2.263 13.510 ( -5.708 0.406 -1.069) 5.821 13.752 ( -1.527 5.374 -7.747) 9.551 14.072 ( 17.882 3.769 6.082) 19.261 14.346 ( 6.937 4.217 -6.183) 10.205 14.545 ( -3.843 4.400 -0.350) 5.852 14.566 ( -8.242 7.552 -4.706) 12.129 14.615 ( -3.566 2.625 -4.200) 6.103 14.736 ( -7.966 2.088 -6.602) 10.555 15.031 ( -1.715 -3.537 4.316) 5.838 15.177 ( -2.693 -1.217 -0.839) 3.072 15.678 ( 5.258 6.278 -1.832) 8.391 15.718 ( 7.153 3.943 -5.224) 9.696 16.180 ( -1.535 2.270 2.587) 3.769 16.291 ( -3.980 1.556 -2.713) 5.062 16.638 ( 0.743 -4.055 1.536) 4.400 16.652 ( 2.073 -2.050 0.061) 2.916 16.792 ( -3.477 -0.525 5.650) 6.655 16.910 ( 0.577 0.304 0.142) 0.667 17.545 ( -11.617 6.505 8.103) 15.586 17.809 ( -5.782 10.499 -5.240) 13.082 19.349 ( 6.414 0.834 8.703) 10.843 19.484 ( 6.317 -7.395 2.932) 10.158 ======================= Grid point 266 (88/125) ======================= q-point: (-0.11 0.11 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.471 ( 0.000 0.693 18.296) 18.309 1.690 ( 0.000 9.220 20.414) 22.400 1.941 ( -0.000 -4.229 -5.167) 6.677 2.429 ( 0.000 2.194 -16.940) 17.081 2.682 ( 0.000 2.710 13.617) 13.884 2.862 ( 0.000 3.143 3.657) 4.822 4.840 ( 0.000 4.318 3.423) 5.510 5.128 ( 0.000 8.579 -8.193) 11.862 5.273 ( 0.000 0.246 19.636) 19.638 6.073 ( -0.000 -1.792 -19.227) 19.311 7.118 ( 0.000 8.292 10.715) 13.549 7.345 ( -0.000 -12.920 25.573) 28.651 7.587 ( 0.000 2.379 -9.300) 9.599 7.779 ( -0.000 -15.438 2.163) 15.589 8.773 ( 0.000 4.878 24.901) 25.375 8.821 ( 0.000 1.364 5.647) 5.809 9.474 ( -0.000 -0.004 -11.389) 11.389 9.746 ( 0.000 7.140 -20.470) 21.679 9.958 ( 0.000 5.718 -0.052) 5.718 10.086 ( -0.000 -6.947 5.934) 9.137 10.256 ( 0.000 9.322 -10.021) 13.687 10.339 ( -0.000 -3.900 -5.809) 6.997 10.569 ( -0.000 -10.347 -2.147) 10.567 10.683 ( -0.000 -3.072 -12.103) 12.487 11.806 ( -0.000 -9.656 15.638) 18.379 12.371 ( -0.000 -12.107 -11.533) 16.721 12.452 ( -0.000 -9.514 8.275) 12.610 12.775 ( -0.000 -2.242 9.933) 10.183 12.782 ( -0.000 -6.728 -9.421) 11.577 12.839 ( 0.000 6.122 3.816) 7.214 13.269 ( -0.000 -6.535 8.250) 10.525 13.279 ( 0.000 11.706 0.619) 11.722 13.574 ( -0.000 -8.079 -6.106) 10.127 13.646 ( 0.000 6.361 -12.612) 14.125 14.222 ( 0.000 8.072 1.681) 8.245 14.280 ( 0.000 3.092 2.282) 3.843 14.375 ( 0.000 0.912 -1.963) 2.164 14.412 ( 0.000 10.912 -7.705) 13.358 14.484 ( 0.000 7.054 -0.301) 7.060 14.708 ( -0.000 -2.462 -8.816) 9.153 15.077 ( -0.000 -3.904 4.276) 5.790 15.193 ( -0.000 -2.932 0.019) 2.932 15.629 ( 0.000 5.353 -1.197) 5.486 15.734 ( 0.000 2.755 -7.203) 7.712 16.128 ( 0.000 2.207 1.808) 2.853 16.202 ( 0.000 3.133 -1.885) 3.656 16.688 ( -0.000 -2.664 2.194) 3.451 16.700 ( -0.000 -2.101 0.430) 2.144 16.777 ( -0.000 -0.085 6.720) 6.721 16.933 ( -0.000 -0.264 -1.374) 1.399 17.351 ( 0.000 6.219 8.656) 10.658 17.614 ( 0.000 8.897 -4.656) 10.042 19.386 ( 0.000 0.202 11.194) 11.196 19.653 ( -0.000 -8.311 -1.171) 8.393 ======================= Grid point 269 (89/125) ======================= q-point: ( 0.22 0.22 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.651 ( 2.556 0.000 6.336) 6.832 1.698 ( 8.971 0.000 3.311) 9.562 2.233 ( 7.421 0.000 1.539) 7.579 2.371 ( 4.756 0.000 -5.503) 7.274 2.775 ( 0.553 0.000 4.333) 4.368 2.820 ( 3.483 0.000 3.913) 5.239 4.890 ( 0.778 0.000 6.326) 6.374 5.166 ( 1.403 0.000 -7.731) 7.857 5.985 ( 22.678 0.000 6.090) 23.481 6.202 ( 5.806 0.000 -6.379) 8.625 6.797 ( -11.734 -0.000 8.804) 14.670 6.881 ( -3.379 -0.000 5.550) 6.497 7.524 ( -7.291 -0.000 17.689) 19.132 7.954 ( -11.981 -0.000 -9.384) 15.218 7.990 ( -5.090 -0.000 29.951) 30.380 9.052 ( -14.177 -0.000 -7.420) 16.001 9.084 ( 0.023 0.000 13.935) 13.935 9.510 ( 9.925 0.000 -19.197) 21.611 9.669 ( -18.167 -0.000 2.493) 18.337 10.321 ( 16.855 0.000 14.047) 21.941 10.344 ( -3.709 -0.000 -28.037) 28.282 10.555 ( -6.166 -0.000 -3.302) 6.995 10.592 ( -5.897 -0.000 -3.631) 6.926 10.912 ( 17.391 0.000 -15.336) 23.187 11.532 ( -12.938 -0.000 12.703) 18.132 11.982 ( -16.247 -0.000 -10.606) 19.402 12.305 ( -8.075 -0.000 10.187) 12.999 12.597 ( -3.827 -0.000 -0.835) 3.917 12.778 ( 1.928 0.000 11.139) 11.305 13.071 ( -1.319 -0.000 -6.450) 6.583 13.365 ( -4.356 -0.000 -6.272) 7.636 13.472 ( -5.205 -0.000 4.269) 6.732 13.489 ( -8.022 -0.000 -6.050) 10.047 13.628 ( -1.596 -0.000 -5.366) 5.599 13.990 ( 13.736 0.000 10.245) 17.136 14.257 ( 12.120 0.000 -2.011) 12.286 14.595 ( 8.811 0.000 3.192) 9.371 14.673 ( 2.452 0.000 -0.132) 2.456 14.822 ( -3.141 -0.000 -3.841) 4.962 14.942 ( 18.268 0.000 -12.163) 21.947 15.110 ( -0.298 -0.000 -2.815) 2.831 15.171 ( 0.372 0.000 -5.709) 5.721 15.575 ( 11.134 0.000 3.216) 11.589 15.708 ( 15.133 0.000 -2.281) 15.304 16.133 ( -1.778 -0.000 6.856) 7.083 16.406 ( -3.430 -0.000 -2.877) 4.477 16.429 ( -9.136 -0.000 1.943) 9.340 16.467 ( -3.957 -0.000 -3.995) 5.622 16.945 ( 0.420 0.000 4.618) 4.637 16.993 ( -2.337 -0.000 2.418) 3.363 18.064 ( 13.494 0.000 6.126) 14.819 18.203 ( 18.044 0.000 -1.113) 18.078 18.831 ( -12.073 -0.000 15.142) 19.366 19.333 ( -6.658 -0.000 -10.440) 12.382 ======================= Grid point 270 (90/125) ======================= q-point: ( 0.33 0.22 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.682 ( 2.604 0.473 4.441) 5.170 1.817 ( 6.410 -0.633 -2.638) 6.960 2.354 ( 10.039 -0.825 4.416) 10.998 2.475 ( 4.907 -3.362 -1.918) 6.250 2.776 ( 1.495 0.923 5.520) 5.793 2.889 ( 0.462 -4.077 0.747) 4.171 4.882 ( -0.858 0.231 6.509) 6.570 5.186 ( -1.092 -3.159 -10.180) 10.715 6.010 ( 3.906 17.897 8.265) 20.096 6.318 ( 2.774 4.176 -5.282) 7.282 6.795 ( 8.797 -6.026 8.265) 13.491 6.912 ( 9.430 -6.231 3.544) 11.845 7.477 ( -6.609 -7.442 11.276) 15.040 7.786 ( -12.350 -1.944 3.275) 12.924 8.076 ( -3.273 -12.359 20.656) 24.293 8.692 ( -17.007 15.049 6.826) 23.713 9.090 ( 2.183 1.345 12.694) 12.950 9.418 ( -17.533 2.341 3.661) 18.063 9.686 ( 12.129 -0.825 -23.888) 26.804 10.188 ( -12.984 3.015 -8.536) 15.828 10.462 ( 4.433 1.881 -17.651) 18.296 10.534 ( -8.044 -3.100 -6.894) 11.038 10.612 ( 11.419 -4.440 7.689) 14.464 11.152 ( 16.377 -0.632 -15.113) 22.294 11.376 ( -11.313 -1.631 11.031) 15.885 11.799 ( -15.095 -3.722 -10.218) 18.604 12.179 ( -7.884 2.159 9.844) 12.795 12.535 ( -5.072 0.794 -5.011) 7.174 12.796 ( 1.251 0.519 10.314) 10.403 13.058 ( -1.996 -1.416 -5.381) 5.911 13.173 ( -7.470 7.614 -1.827) 10.822 13.319 ( -4.116 5.622 -2.648) 7.454 13.533 ( -2.917 -6.421 0.852) 7.104 13.660 ( -3.073 -6.487 -4.209) 8.321 14.178 ( 13.647 1.284 8.576) 16.169 14.374 ( 9.645 3.072 -1.498) 10.232 14.614 ( 3.754 3.502 1.668) 5.398 14.753 ( -3.619 1.327 -2.765) 4.744 14.786 ( 2.127 -5.281 3.831) 6.862 15.072 ( 4.542 4.130 -5.578) 8.295 15.174 ( 7.386 -1.241 -8.407) 11.259 15.281 ( 12.177 -0.443 -6.908) 14.007 15.723 ( 12.237 1.404 4.385) 13.074 15.872 ( 13.318 4.973 -2.244) 14.392 16.122 ( -1.236 -1.997 5.464) 5.947 16.327 ( -6.759 -1.377 1.647) 7.092 16.353 ( -4.877 -0.779 0.415) 4.957 16.427 ( -1.143 0.426 -9.570) 9.648 16.930 ( -5.142 -1.426 4.216) 6.801 16.952 ( -5.398 -2.602 2.937) 6.674 18.220 ( 6.523 -2.084 5.894) 9.035 18.309 ( -3.933 0.411 1.716) 4.311 18.795 ( 8.126 -0.609 12.680) 15.073 19.262 ( 0.662 3.607 -10.438) 11.064 ======================= Grid point 271 (91/125) ======================= q-point: ( 0.44 0.22 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.698 ( 2.362 2.134 3.626) 4.826 1.869 ( 2.295 1.286 -4.719) 5.403 2.496 ( 6.763 -1.372 4.114) 8.034 2.555 ( 0.948 -0.623 0.527) 1.251 2.782 ( 0.434 0.300 7.208) 7.227 2.935 ( -2.830 -3.639 0.514) 4.639 4.896 ( 2.187 -2.195 8.387) 8.941 5.274 ( 1.862 -8.064 -12.322) 14.843 5.709 ( -3.507 17.279 10.318) 20.428 6.125 ( -2.431 14.608 -6.036) 15.992 7.101 ( 14.150 -5.080 9.165) 17.607 7.260 ( 15.437 -8.762 2.082) 17.872 7.543 ( -9.454 -8.794 7.908) 15.141 7.708 ( -2.401 -8.960 3.273) 9.837 8.171 ( -6.503 0.571 15.951) 17.235 8.334 ( -8.066 -3.463 9.429) 12.882 9.063 ( -2.009 10.090 4.355) 11.172 9.160 ( -7.517 -0.614 16.577) 18.212 9.816 ( 5.573 1.761 -22.187) 22.944 10.019 ( -9.779 -3.420 0.543) 10.374 10.421 ( -5.002 1.494 -18.728) 19.442 10.523 ( -1.547 -2.555 -17.373) 17.628 10.811 ( 9.140 -1.269 8.723) 12.698 11.273 ( -5.441 -3.084 7.368) 9.664 11.355 ( 9.821 1.403 -12.801) 16.195 11.701 ( -12.242 -7.276 -10.310) 17.581 12.051 ( -5.887 1.468 9.145) 10.975 12.441 ( -5.187 1.714 -9.207) 10.706 12.795 ( 0.019 0.824 9.787) 9.822 13.000 ( -4.716 3.431 2.978) 6.548 13.063 ( -1.536 -2.033 -4.897) 5.520 13.210 ( -2.864 2.303 -3.727) 5.234 13.581 ( -3.023 -4.948 2.991) 6.524 13.724 ( -3.405 -7.050 -4.279) 8.923 14.287 ( 13.267 7.784 6.544) 16.716 14.444 ( 8.046 2.525 -1.444) 8.556 14.621 ( 2.011 1.096 -0.144) 2.295 14.690 ( -2.157 1.623 -0.834) 2.825 14.863 ( -0.335 -3.371 3.445) 4.832 15.039 ( 2.751 6.591 -0.453) 7.157 15.236 ( 3.340 3.278 -6.750) 8.214 15.398 ( 8.484 4.441 -7.155) 11.954 15.836 ( 9.085 4.258 2.647) 10.376 15.892 ( 5.609 5.911 -0.201) 8.151 16.181 ( 3.507 -2.976 1.484) 4.833 16.293 ( -3.174 -0.933 -0.616) 3.365 16.321 ( -1.724 -2.744 1.031) 3.401 16.447 ( 3.019 -1.619 -8.914) 9.549 16.865 ( -9.135 -3.172 4.891) 10.837 16.925 ( -6.152 -3.358 1.881) 7.257 18.150 ( -13.052 1.575 7.697) 15.234 18.299 ( -1.233 -2.064 0.752) 2.519 18.981 ( 14.908 -0.594 8.006) 16.932 19.252 ( 7.385 4.411 -5.874) 10.416 ======================= Grid point 272 (92/125) ======================= q-point: (-0.44 0.22 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.675 ( 1.175 3.691 2.788) 4.772 1.853 ( -0.054 2.206 -5.339) 5.777 2.466 ( -6.514 5.282 3.533) 9.100 2.575 ( 1.779 0.696 -0.386) 1.949 2.770 ( -0.987 0.725 8.464) 8.552 2.938 ( -3.320 -2.626 1.552) 4.509 5.026 ( 7.111 -5.566 10.578) 13.908 5.374 ( 3.846 11.969 6.801) 14.293 5.532 ( -2.960 -10.961 -9.823) 15.013 5.893 ( 1.185 13.729 -7.894) 15.881 7.105 ( -11.123 6.096 13.861) 18.789 7.285 ( -0.402 6.341 6.675) 9.215 7.715 ( 5.052 -10.979 9.247) 15.217 7.923 ( 1.764 -0.972 -0.824) 2.176 8.192 ( 9.137 -13.471 8.089) 18.176 8.454 ( 3.451 -11.076 1.673) 11.721 8.865 ( -5.344 0.941 11.438) 12.660 9.219 ( 5.201 -4.754 19.904) 21.114 9.755 ( -10.344 -1.456 -15.765) 18.912 10.040 ( 2.119 -2.057 -2.540) 3.896 10.328 ( -5.560 1.184 -15.770) 16.764 10.519 ( -2.440 0.174 -18.429) 18.590 10.863 ( 2.484 4.342 4.029) 6.423 11.274 ( -3.982 -5.226 8.935) 11.091 11.387 ( 5.380 8.693 -16.369) 19.298 11.703 ( -7.822 -10.181 -10.547) 16.616 12.005 ( -1.792 -2.666 8.537) 9.121 12.380 ( -2.207 -1.372 -10.197) 10.523 12.765 ( -1.491 1.522 10.133) 10.355 12.954 ( -1.693 -2.763 5.163) 6.096 13.069 ( -0.001 0.302 -4.904) 4.913 13.178 ( -2.986 -3.331 -4.847) 6.596 13.604 ( -2.980 -3.194 4.668) 6.394 13.782 ( -2.502 -5.484 -4.549) 7.552 14.311 ( 13.918 11.624 6.919) 19.409 14.511 ( 6.976 2.165 -1.956) 7.562 14.619 ( 0.988 2.128 -1.207) 2.638 14.650 ( 0.029 1.283 -1.870) 2.268 14.885 ( -2.989 -1.331 0.099) 3.274 14.943 ( -0.697 6.030 4.537) 7.578 15.146 ( -3.257 8.244 -3.606) 9.570 15.377 ( 2.725 7.078 -6.234) 9.817 15.808 ( 0.758 3.818 0.351) 3.909 15.911 ( 7.486 5.773 -3.610) 10.120 16.255 ( 0.419 -0.176 -0.166) 0.484 16.295 ( 4.072 -1.038 -0.106) 4.204 16.390 ( 1.989 -4.912 2.278) 5.768 16.527 ( 3.236 -1.988 -6.244) 7.308 16.795 ( -8.183 -2.983 4.685) 9.890 16.891 ( -6.073 -3.166 0.324) 6.856 17.942 ( -12.278 3.077 9.865) 16.048 18.254 ( -5.169 2.187 -4.859) 7.424 19.172 ( 11.614 -0.910 7.322) 13.760 19.315 ( 9.258 2.534 -0.248) 9.602 ======================= Grid point 273 (93/125) ======================= q-point: (-0.33 0.22 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.621 ( -0.089 4.126 3.238) 5.246 1.821 ( 0.098 1.205 -5.459) 5.592 2.244 ( -6.874 9.798 7.446) 14.096 2.551 ( -1.346 1.923 -7.074) 7.453 2.744 ( -0.802 0.817 9.875) 9.941 2.936 ( -1.776 -1.392 2.231) 3.173 5.172 ( 4.677 4.715 14.256) 15.727 5.224 ( 1.908 3.098 8.595) 9.333 5.682 ( 1.572 9.033 -9.780) 13.406 5.749 ( -2.428 -8.869 -14.775) 17.403 6.908 ( -5.162 -0.307 19.103) 19.791 7.238 ( 3.414 1.432 2.366) 4.393 7.771 ( -9.506 5.257 11.934) 16.137 7.806 ( 1.187 6.411 3.052) 7.199 8.567 ( 9.037 -12.722 9.979) 18.523 8.790 ( 8.354 -12.752 6.836) 16.707 8.901 ( 4.056 -8.814 1.416) 9.805 9.464 ( 8.627 -15.588 15.868) 23.858 9.652 ( -11.757 -5.449 -16.999) 21.375 10.079 ( 1.281 0.264 -1.665) 2.117 10.235 ( -3.688 3.092 -8.246) 9.548 10.442 ( -5.245 3.391 -13.518) 14.891 10.783 ( -0.181 6.133 -6.426) 8.885 11.196 ( 0.744 16.215 -17.143) 23.609 11.364 ( -1.955 -7.619 8.963) 11.926 11.801 ( -3.531 -12.029 -10.973) 16.661 12.073 ( 0.599 -6.190 8.291) 10.365 12.430 ( 0.788 -5.525 -9.754) 11.238 12.726 ( -1.632 0.497 11.129) 11.259 13.011 ( -0.295 -5.392 5.174) 7.479 13.051 ( 0.346 2.312 -4.981) 5.503 13.228 ( -1.857 -6.954 -5.332) 8.957 13.597 ( -2.262 -0.317 6.211) 6.617 13.823 ( -0.984 -2.392 -5.231) 5.836 14.324 ( 15.733 11.396 7.229) 20.728 14.539 ( 4.653 5.837 0.258) 7.469 14.596 ( 1.003 1.503 -0.830) 1.989 14.641 ( 0.322 0.754 -4.096) 4.177 14.774 ( -6.729 3.236 -2.602) 7.908 14.868 ( -7.068 6.930 -5.063) 11.118 14.960 ( -2.765 2.080 6.491) 7.355 15.277 ( -0.139 7.184 -5.870) 9.278 15.778 ( 0.968 1.507 -0.614) 1.893 15.896 ( 4.624 6.407 -6.157) 10.017 16.247 ( 0.405 1.676 2.826) 3.311 16.351 ( 3.320 1.680 -1.787) 4.127 16.495 ( 0.930 -5.156 2.685) 5.887 16.577 ( -0.687 -2.678 -3.592) 4.533 16.754 ( -3.493 -2.110 4.335) 5.954 16.878 ( -1.936 -2.389 -1.451) 3.400 17.737 ( -8.252 5.287 10.869) 14.635 18.111 ( -4.276 7.315 -7.436) 11.274 19.319 ( 6.290 -2.748 7.398) 10.092 19.390 ( 5.828 1.437 3.302) 6.851 ======================= Grid point 274 (94/125) ======================= q-point: (-0.22 0.22 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.553 ( 0.000 4.001 7.153) 8.196 1.828 ( -0.000 -1.707 -5.120) 5.397 2.027 ( 0.000 11.361 11.764) 16.354 2.505 ( 0.000 2.371 -11.917) 12.150 2.728 ( 0.000 0.592 10.499) 10.515 2.931 ( 0.000 0.468 2.656) 2.696 5.049 ( 0.000 9.133 10.224) 13.709 5.266 ( -0.000 -1.180 13.260) 13.312 5.467 ( 0.000 13.791 -8.567) 16.235 5.912 ( -0.000 -9.856 -17.973) 20.498 6.972 ( -0.000 -9.169 20.331) 22.303 7.344 ( -0.000 -8.699 0.007) 8.699 7.506 ( 0.000 14.891 12.415) 19.388 7.720 ( 0.000 5.278 3.246) 6.197 8.779 ( -0.000 -6.455 17.198) 18.369 8.867 ( -0.000 -0.393 9.536) 9.544 9.231 ( -0.000 -15.191 -5.405) 16.123 9.662 ( -0.000 -9.120 -16.137) 18.536 9.870 ( -0.000 -22.381 5.956) 23.160 10.070 ( 0.000 1.787 -2.764) 3.291 10.122 ( 0.000 6.654 4.564) 8.069 10.319 ( 0.000 4.314 -9.641) 10.562 10.706 ( 0.000 3.455 -15.798) 16.171 10.906 ( 0.000 20.105 -18.607) 27.394 11.493 ( -0.000 -9.899 12.269) 15.764 11.973 ( -0.000 -12.928 -11.576) 17.354 12.187 ( -0.000 -7.496 8.319) 11.198 12.543 ( -0.000 -7.503 -10.038) 12.533 12.716 ( -0.000 -0.990 11.483) 11.526 13.005 ( 0.000 3.899 -3.419) 5.186 13.097 ( -0.000 -5.580 5.819) 8.062 13.333 ( -0.000 -7.801 -5.910) 9.787 13.553 ( 0.000 4.056 6.500) 7.662 13.815 ( 0.000 2.876 -6.045) 6.694 14.367 ( 0.000 5.980 4.921) 7.745 14.418 ( 0.000 6.750 6.668) 9.488 14.592 ( 0.000 11.999 -6.474) 13.635 14.595 ( 0.000 1.210 -2.744) 2.999 14.629 ( 0.000 0.919 -4.059) 4.162 14.707 ( 0.000 1.968 -8.463) 8.689 14.971 ( -0.000 -2.678 4.617) 5.337 15.182 ( 0.000 3.951 -3.511) 5.286 15.773 ( 0.000 1.183 -1.434) 1.859 15.833 ( 0.000 5.940 -5.389) 8.020 16.211 ( 0.000 2.799 2.892) 4.025 16.321 ( 0.000 4.004 -2.319) 4.627 16.571 ( -0.000 -4.513 2.339) 5.083 16.616 ( -0.000 -3.184 -2.043) 3.783 16.760 ( -0.000 -1.223 5.315) 5.454 16.905 ( -0.000 -1.764 -1.959) 2.636 17.578 ( 0.000 7.220 10.823) 13.011 17.938 ( 0.000 10.484 -7.339) 12.798 19.407 ( 0.000 0.436 6.689) 6.703 19.428 ( -0.000 -4.552 5.521) 7.155 ======================= Grid point 279 (95/125) ======================= q-point: ( 0.33 0.33 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.728 ( 3.629 0.000 4.460) 5.750 1.903 ( 5.707 0.000 -4.761) 7.432 2.487 ( 9.783 0.000 3.621) 10.432 2.510 ( 3.673 0.000 0.408) 3.696 2.813 ( 1.950 0.000 3.458) 3.970 2.844 ( -1.855 -0.000 0.870) 2.049 4.879 ( 0.997 0.000 4.506) 4.615 5.115 ( -4.055 -0.000 -8.538) 9.452 6.208 ( -9.588 -0.000 7.705) 12.300 6.366 ( 5.456 0.000 1.931) 5.788 6.953 ( 22.345 0.000 3.629) 22.638 6.963 ( 11.487 0.000 5.944) 12.933 7.342 ( -2.645 -0.000 2.828) 3.873 7.581 ( -14.254 -0.000 -9.110) 16.917 7.978 ( 0.691 0.000 34.207) 34.214 8.630 ( -15.464 -0.000 4.449) 16.091 9.013 ( -8.139 -0.000 27.205) 28.397 9.249 ( -9.178 -0.000 5.796) 10.855 9.867 ( 12.269 0.000 -28.882) 31.379 10.023 ( -15.495 -0.000 -8.021) 17.448 10.387 ( -7.654 -0.000 -8.150) 11.181 10.491 ( -0.850 -0.000 -26.646) 26.660 10.770 ( 15.129 0.000 13.532) 20.298 11.213 ( -10.252 -0.000 8.859) 13.549 11.373 ( 16.347 0.000 -16.668) 23.346 11.578 ( -12.888 -0.000 -9.419) 15.963 12.084 ( -8.496 -0.000 10.017) 13.135 12.467 ( -6.177 -0.000 -6.999) 9.335 12.823 ( 1.354 0.000 8.988) 9.089 13.009 ( -2.967 -0.000 -3.587) 4.655 13.125 ( -8.689 -0.000 -1.268) 8.781 13.327 ( -3.894 -0.000 -6.879) 7.905 13.417 ( -2.341 -0.000 4.071) 4.696 13.573 ( -2.142 -0.000 -3.957) 4.500 14.385 ( 14.616 0.000 10.336) 17.902 14.497 ( 5.906 0.000 -0.066) 5.906 14.656 ( -2.344 -0.000 0.684) 2.442 14.691 ( -4.010 -0.000 -2.237) 4.592 14.798 ( 5.069 0.000 6.742) 8.435 15.219 ( 6.132 0.000 2.808) 6.744 15.249 ( 9.733 0.000 -12.511) 15.851 15.500 ( 16.012 0.000 -9.306) 18.520 15.898 ( 11.892 0.000 6.837) 13.717 16.064 ( -3.665 -0.000 5.664) 6.746 16.109 ( 12.416 0.000 -4.692) 13.273 16.222 ( -5.424 -0.000 2.835) 6.121 16.279 ( -5.055 -0.000 -0.584) 5.088 16.426 ( 1.405 0.000 -12.233) 12.314 16.800 ( -10.256 -0.000 3.686) 10.898 16.859 ( -6.228 -0.000 0.910) 6.295 18.176 ( -12.913 -0.000 7.870) 15.122 18.248 ( 0.318 0.000 3.935) 3.948 18.973 ( 15.628 0.000 8.068) 17.588 19.333 ( 5.371 0.000 -9.665) 11.057 ======================= Grid point 280 (96/125) ======================= q-point: ( 0.44 0.33 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.765 ( 3.200 1.622 3.941) 5.329 1.944 ( 3.218 2.629 -5.180) 6.641 2.533 ( -0.293 0.427 2.010) 2.076 2.595 ( 4.892 0.169 1.020) 5.000 2.799 ( -0.832 0.957 4.367) 4.547 2.859 ( -0.446 -1.992 2.219) 3.016 4.923 ( 5.689 -0.396 4.161) 7.059 5.133 ( -1.383 -7.863 -7.560) 10.995 5.909 ( -10.205 13.783 13.002) 21.521 6.338 ( 3.255 11.734 -4.653) 13.036 7.208 ( 11.873 -5.080 7.466) 14.917 7.309 ( 7.581 -5.898 4.750) 10.716 7.358 ( -0.712 -0.583 -1.531) 1.786 7.493 ( 1.774 -13.259 -3.311) 13.781 8.055 ( -0.407 -9.839 23.603) 25.575 8.333 ( -6.988 11.427 9.872) 16.639 8.928 ( -14.883 -4.161 18.234) 23.902 9.165 ( 0.413 1.890 16.280) 16.395 9.739 ( -16.457 1.182 -3.077) 16.784 10.055 ( 10.780 1.938 -25.255) 27.527 10.315 ( -6.777 -2.374 -12.852) 14.722 10.480 ( -1.597 -1.006 -28.845) 28.906 10.952 ( 11.056 1.018 12.665) 16.843 11.117 ( -6.970 -2.976 7.864) 10.921 11.459 ( -9.159 -4.502 -9.334) 13.830 11.568 ( 13.746 2.409 -17.786) 22.607 11.972 ( -7.175 -0.085 9.586) 11.974 12.373 ( -7.077 0.200 -9.781) 12.075 12.827 ( 1.144 1.406 8.158) 8.357 12.988 ( -5.701 3.382 2.495) 7.083 12.994 ( -2.405 -2.341 -2.939) 4.461 13.229 ( -2.297 4.644 -4.602) 6.929 13.456 ( -2.419 -6.094 2.007) 6.857 13.588 ( -2.035 -4.976 -3.483) 6.406 14.534 ( 8.587 2.885 3.242) 9.621 14.550 ( 5.267 1.047 1.199) 5.502 14.630 ( -0.645 -0.521 0.824) 1.169 14.655 ( -1.721 -0.640 0.162) 1.844 14.864 ( 4.252 0.425 8.425) 9.447 15.224 ( 3.806 7.112 5.944) 10.020 15.356 ( 6.950 3.981 -9.071) 12.101 15.625 ( 9.575 7.113 -7.250) 13.958 15.955 ( -2.007 4.888 2.186) 5.718 16.039 ( 7.814 2.022 3.744) 8.898 16.194 ( 1.283 -2.647 1.177) 3.168 16.224 ( -2.403 -2.828 -1.914) 4.176 16.270 ( 2.237 -2.908 -2.085) 4.220 16.481 ( 4.615 -0.738 -10.039) 11.073 16.692 ( -8.270 -2.732 2.678) 9.112 16.788 ( -6.882 -2.444 -1.143) 7.392 18.005 ( -11.101 1.002 10.897) 15.588 18.239 ( -3.161 -1.422 -0.085) 3.467 19.164 ( 12.226 -0.075 6.296) 13.752 19.397 ( 6.544 2.025 -5.927) 9.058 ======================= Grid point 281 (97/125) ======================= q-point: (-0.44 0.33 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 324 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.754 ( 1.409 3.758 2.381) 4.666 1.914 ( 1.045 4.390 -5.421) 7.053 2.469 ( -3.687 4.251 2.934) 6.346 2.604 ( -0.341 1.679 -3.272) 3.694 2.781 ( 0.043 1.033 7.594) 7.664 2.880 ( -0.237 -1.459 3.157) 3.486 5.052 ( 7.438 -3.969 4.252) 9.443 5.293 ( 0.135 -12.301 -8.380) 14.885 5.595 ( -5.520 12.194 16.513) 21.257 6.178 ( 5.504 15.699 -9.638) 19.226 7.056 ( -11.416 8.425 13.032) 19.265 7.320 ( -1.254 1.658 -1.609) 2.629 7.597 ( 4.253 -9.334 10.815) 14.905 7.840 ( 3.441 -14.581 -4.143) 15.543 8.274 ( 15.773 0.638 14.535) 21.458 8.299 ( 3.931 -17.535 7.559) 19.496 8.731 ( -15.470 0.014 12.794) 20.075 9.196 ( 1.735 -2.887 22.282) 22.535 9.556 ( -11.412 -1.656 -3.021) 11.921 10.102 ( 2.134 2.618 -14.554) 14.941 10.293 ( 0.445 -0.246 -22.325) 22.331 10.471 ( -2.982 -1.324 -23.823) 24.045 10.986 ( 2.624 5.318 9.478) 11.180 11.131 ( -1.967 -5.176 8.312) 9.987 11.465 ( -4.463 -7.756 -9.952) 13.383 11.632 ( 7.014 8.422 -19.707) 22.550 11.926 ( -2.920 -3.172 8.998) 9.977 12.306 ( -4.007 -2.494 -10.257) 11.291 12.807 ( 0.711 3.692 9.472) 10.192 12.897 ( -2.605 -0.669 4.377) 5.138 13.028 ( -0.846 -4.355 -3.482) 5.639 13.144 ( -1.455 3.033 -4.866) 5.916 13.514 ( -1.472 -4.618 2.961) 5.680 13.659 ( -1.277 -6.630 -3.608) 7.655 14.543 ( 2.036 2.060 0.228) 2.905 14.608 ( 2.917 0.002 -1.924) 3.494 14.631 ( -0.191 -0.257 1.718) 1.747 14.683 ( 5.643 1.636 1.037) 5.966 14.871 ( 0.266 4.023 7.575) 8.581 15.106 ( -0.050 9.944 11.564) 15.252 15.281 ( 0.841 12.144 -7.178) 14.132 15.560 ( 2.966 10.365 -5.656) 12.174 15.854 ( -1.456 4.101 0.282) 4.361 16.065 ( 3.321 4.009 -8.669) 10.112 16.254 ( 1.540 -1.758 3.981) 4.616 16.300 ( 1.932 -6.223 3.477) 7.386 16.361 ( 4.346 -2.751 -1.971) 5.508 16.505 ( -3.591 -1.398 -4.141) 5.657 16.671 ( -2.463 -2.608 -0.278) 3.598 16.771 ( -2.647 -4.053 -3.603) 6.034 17.858 ( -6.629 2.492 12.346) 14.232 18.210 ( -3.085 -0.303 -4.268) 5.275 19.290 ( 6.455 0.033 6.206) 8.954 19.442 ( 4.580 1.935 -1.826) 5.297 ======================= Grid point 282 (98/125) ======================= q-point: (-0.33 0.33 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.694 ( 0.000 4.804 1.595) 5.061 1.856 ( 0.000 3.311 -5.779) 6.660 2.338 ( 0.000 8.051 4.956) 9.454 2.569 ( 0.000 1.868 -6.452) 6.717 2.759 ( 0.000 1.594 9.201) 9.338 2.901 ( -0.000 -1.641 3.084) 3.493 5.179 ( -0.000 -4.256 4.598) 6.265 5.384 ( 0.000 11.398 17.287) 20.707 5.499 ( -0.000 -14.398 -10.468) 17.802 5.965 ( 0.000 17.204 -10.792) 20.308 6.872 ( 0.000 3.255 18.825) 19.104 7.272 ( 0.000 2.023 -3.633) 4.159 7.707 ( -0.000 -3.686 14.729) 15.183 7.949 ( 0.000 3.625 -1.202) 3.819 8.467 ( -0.000 -5.908 24.449) 25.153 8.641 ( -0.000 -17.038 2.008) 17.156 8.719 ( -0.000 -15.170 -1.736) 15.269 9.300 ( -0.000 -9.727 22.527) 24.537 9.495 ( -0.000 -1.790 -11.074) 11.218 10.082 ( 0.000 0.668 -7.433) 7.463 10.289 ( 0.000 2.627 -18.804) 18.987 10.444 ( 0.000 1.518 -17.915) 17.980 10.895 ( 0.000 7.716 3.009) 8.282 11.211 ( -0.000 -7.047 9.393) 11.743 11.467 ( 0.000 12.760 -20.964) 24.542 11.602 ( -0.000 -8.942 -10.466) 13.766 11.982 ( -0.000 -5.623 8.696) 10.355 12.347 ( -0.000 -5.129 -9.923) 11.170 12.748 ( 0.000 3.274 10.951) 11.430 12.929 ( -0.000 -4.417 4.771) 6.502 13.091 ( 0.000 2.407 -5.706) 6.193 13.108 ( -0.000 -6.255 -4.323) 7.603 13.560 ( -0.000 -2.597 4.940) 5.581 13.749 ( -0.000 -5.771 -4.345) 7.224 14.539 ( 0.000 0.864 0.483) 0.990 14.632 ( -0.000 -0.633 -2.572) 2.649 14.639 ( 0.000 0.365 0.629) 0.727 14.693 ( 0.000 12.344 10.442) 16.168 14.742 ( 0.000 0.678 -4.912) 4.958 14.984 ( 0.000 5.699 12.785) 13.997 15.044 ( 0.000 16.092 -7.051) 17.569 15.417 ( 0.000 9.953 -6.383) 11.824 15.800 ( 0.000 1.752 0.030) 1.752 16.016 ( 0.000 5.214 -10.151) 11.412 16.276 ( 0.000 0.846 5.293) 5.360 16.411 ( -0.000 -6.066 3.258) 6.885 16.419 ( 0.000 2.068 -0.293) 2.089 16.500 ( -0.000 -4.502 -4.728) 6.528 16.695 ( -0.000 -2.796 1.344) 3.102 16.819 ( -0.000 -3.605 -3.958) 5.354 17.759 ( 0.000 4.273 12.599) 13.304 18.166 ( 0.000 3.310 -7.049) 7.788 19.337 ( -0.000 -0.690 7.064) 7.097 19.450 ( 0.000 1.363 1.161) 1.790 ======================= Grid point 289 (99/125) ======================= q-point: ( 0.44 0.44 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.820 ( 2.375 0.000 4.150) 4.782 2.003 ( 1.916 0.000 -5.161) 5.505 2.526 ( -1.285 -0.000 2.339) 2.668 2.636 ( 0.439 0.000 -2.560) 2.598 2.787 ( -0.221 -0.000 6.815) 6.818 2.866 ( 1.501 0.000 2.818) 3.193 5.035 ( 8.897 0.000 -1.118) 8.967 5.040 ( -1.033 -0.000 -2.264) 2.488 5.818 ( -14.360 -0.000 18.759) 23.625 6.508 ( 4.334 0.000 -13.002) 13.705 7.269 ( -6.284 -0.000 0.893) 6.347 7.295 ( 8.234 0.000 5.557) 9.934 7.406 ( 5.701 0.000 2.640) 6.282 7.509 ( 11.946 0.000 -1.618) 12.055 7.922 ( -4.490 -0.000 23.284) 23.713 8.345 ( -3.782 -0.000 0.037) 3.782 8.747 ( -6.545 -0.000 28.777) 29.512 9.174 ( -0.272 -0.000 20.633) 20.635 9.528 ( -13.851 -0.000 3.454) 14.275 10.214 ( -4.113 -0.000 -12.095) 12.775 10.227 ( 10.075 0.000 -31.829) 33.385 10.434 ( -3.980 -0.000 -32.232) 32.477 11.017 ( -3.892 -0.000 7.064) 8.065 11.102 ( 8.066 0.000 13.683) 15.883 11.329 ( -4.842 -0.000 -8.839) 10.079 11.762 ( 11.066 0.000 -19.607) 22.514 11.878 ( -5.645 -0.000 9.516) 11.065 12.271 ( -7.366 -0.000 -10.452) 12.786 12.854 ( 1.153 0.000 5.273) 5.397 12.943 ( -1.492 -0.000 -1.735) 2.288 12.952 ( -4.024 -0.000 5.532) 6.841 13.266 ( -1.024 -0.000 -7.811) 7.878 13.360 ( -1.376 -0.000 5.570) 5.737 13.530 ( -0.905 -0.000 -3.533) 3.647 14.592 ( 1.336 0.000 -0.773) 1.543 14.592 ( -0.873 -0.000 -1.056) 1.370 14.604 ( -0.874 -0.000 1.619) 1.840 14.694 ( 4.387 0.000 -1.096) 4.521 14.967 ( 8.406 0.000 15.699) 17.807 15.277 ( -3.196 -0.000 13.505) 13.878 15.514 ( 7.923 0.000 -11.317) 13.815 15.804 ( 5.736 0.000 -4.694) 7.411 15.968 ( -1.441 -0.000 -0.074) 1.443 16.133 ( -4.317 -0.000 -7.647) 8.782 16.135 ( 1.675 0.000 4.783) 5.068 16.176 ( 3.402 0.000 9.363) 9.962 16.284 ( 2.305 0.000 -10.647) 10.893 16.486 ( -3.984 -0.000 0.445) 4.008 16.635 ( 2.898 0.000 -6.844) 7.432 16.686 ( -4.790 -0.000 -3.060) 5.684 17.895 ( -6.217 -0.000 12.503) 13.963 18.186 ( -2.664 -0.000 -1.268) 2.950 19.290 ( 6.534 0.000 5.439) 8.502 19.482 ( 3.752 0.000 -4.881) 6.156 ======================= Grid point 290 (100/125) ======================= q-point: (-0.44 -0.56 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 180 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.816 ( 0.000 2.544 3.355) 4.210 1.988 ( 0.000 3.439 -5.247) 6.274 2.498 ( 0.000 2.310 2.538) 3.431 2.623 ( 0.000 1.288 -3.831) 4.042 2.790 ( -0.000 -0.016 7.875) 7.875 2.874 ( 0.000 0.123 3.161) 3.163 5.056 ( -0.000 -2.655 -0.319) 2.674 5.157 ( -0.000 -6.149 -5.351) 8.151 5.664 ( 0.000 5.302 22.172) 22.798 6.443 ( 0.000 11.335 -15.928) 19.550 7.123 ( 0.000 10.318 10.349) 14.614 7.343 ( 0.000 1.204 -2.116) 2.435 7.518 ( -0.000 -6.315 9.635) 11.521 7.666 ( -0.000 -10.012 -0.696) 10.037 8.031 ( -0.000 -16.687 13.906) 21.721 8.374 ( -0.000 -5.985 -3.757) 7.067 8.642 ( 0.000 7.409 29.973) 30.875 9.179 ( -0.000 -0.953 22.571) 22.591 9.444 ( -0.000 -1.837 4.695) 5.042 10.155 ( 0.000 3.215 -14.461) 14.814 10.318 ( 0.000 0.095 -31.067) 31.067 10.409 ( -0.000 -2.536 -28.375) 28.488 11.008 ( -0.000 -1.860 7.531) 7.757 11.132 ( 0.000 2.884 12.242) 12.577 11.335 ( -0.000 -4.711 -8.741) 9.929 11.805 ( 0.000 5.415 -21.277) 21.956 11.855 ( -0.000 -2.275 9.263) 9.538 12.228 ( -0.000 -2.215 -9.821) 10.068 12.862 ( -0.000 -0.091 3.398) 3.399 12.887 ( 0.000 4.114 8.759) 9.677 12.960 ( -0.000 -3.103 -2.094) 3.743 13.199 ( 0.000 4.833 -4.668) 6.719 13.421 ( -0.000 -5.987 2.418) 6.457 13.560 ( -0.000 -4.503 -3.271) 5.566 14.571 ( 0.000 1.238 -0.313) 1.277 14.600 ( -0.000 -0.810 -1.865) 2.034 14.617 ( -0.000 -1.095 1.786) 2.095 14.728 ( -0.000 -0.656 -3.556) 3.616 14.998 ( 0.000 5.863 15.429) 16.506 15.199 ( 0.000 4.733 16.336) 17.008 15.488 ( 0.000 10.088 -9.804) 14.067 15.743 ( 0.000 9.824 -3.534) 10.440 15.918 ( 0.000 5.038 -1.050) 5.146 16.111 ( -0.000 -0.427 -11.001) 11.010 16.201 ( -0.000 -6.170 3.142) 6.924 16.235 ( -0.000 -2.853 9.818) 10.225 16.341 ( -0.000 -4.600 -10.388) 11.361 16.448 ( 0.000 0.024 3.762) 3.762 16.639 ( 0.000 0.099 -4.347) 4.348 16.702 ( -0.000 -3.393 -6.826) 7.623 17.843 ( 0.000 1.291 12.997) 13.061 18.176 ( -0.000 -1.060 -2.774) 2.969 19.334 ( 0.000 0.001 5.411) 5.411 19.497 ( 0.000 1.288 -3.387) 3.623 ======================= Grid point 332 (101/125) ======================= q-point: ( 0.00 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 75 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.834 ( 0.000 0.000 -14.208) 14.208 1.834 ( 0.000 0.000 14.208) 14.208 1.991 ( 0.000 0.000 -22.686) 22.686 1.991 ( 0.000 0.000 22.686) 22.686 2.816 ( 0.000 0.000 -3.392) 3.392 2.816 ( 0.000 0.000 3.392) 3.392 4.840 ( 0.000 0.000 -6.447) 6.447 4.840 ( 0.000 0.000 6.447) 6.447 5.696 ( 0.000 0.000 -22.287) 22.287 5.696 ( 0.000 0.000 22.287) 22.287 7.250 ( 0.000 0.000 -14.639) 14.639 7.250 ( 0.000 0.000 14.639) 14.639 8.047 ( 0.000 0.000 -8.162) 8.162 8.047 ( 0.000 0.000 8.162) 8.162 8.946 ( 0.000 0.000 -19.466) 19.466 8.946 ( 0.000 0.000 19.466) 19.466 9.188 ( 0.000 0.000 -25.073) 25.073 9.188 ( 0.000 0.000 25.073) 25.073 9.904 ( 0.000 0.000 -14.386) 14.386 9.904 ( 0.000 0.000 14.386) 14.386 10.323 ( 0.000 0.000 -5.144) 5.144 10.323 ( 0.000 0.000 5.144) 5.144 10.747 ( 0.000 0.000 -4.428) 4.428 10.747 ( 0.000 0.000 4.428) 4.428 12.334 ( 0.000 0.000 -16.868) 16.868 12.334 ( 0.000 0.000 16.868) 16.868 12.765 ( 0.000 0.000 -6.143) 6.143 12.765 ( 0.000 0.000 6.143) 6.143 12.860 ( 0.000 0.000 -8.143) 8.143 12.860 ( 0.000 0.000 8.143) 8.143 13.153 ( 0.000 0.000 -18.382) 18.382 13.153 ( 0.000 0.000 18.382) 18.382 13.671 ( 0.000 0.000 -1.907) 1.907 13.671 ( 0.000 0.000 1.907) 1.907 13.971 ( 0.000 0.000 -2.267) 2.267 13.971 ( 0.000 0.000 2.267) 2.267 14.325 ( 0.000 0.000 -4.120) 4.120 14.325 ( 0.000 0.000 4.120) 4.120 14.542 ( 0.000 0.000 -10.129) 10.129 14.542 ( 0.000 0.000 10.129) 10.129 15.230 ( 0.000 0.000 -3.158) 3.158 15.230 ( 0.000 0.000 3.158) 3.158 15.548 ( 0.000 0.000 -3.363) 3.363 15.548 ( 0.000 0.000 3.363) 3.363 16.122 ( 0.000 0.000 -1.538) 1.538 16.122 ( 0.000 0.000 1.538) 1.538 16.752 ( 0.000 0.000 -0.103) 0.103 16.752 ( 0.000 0.000 0.103) 0.103 16.884 ( 0.000 0.000 -4.128) 4.128 16.884 ( 0.000 0.000 4.128) 4.128 17.377 ( 0.000 0.000 -5.721) 5.721 17.377 ( 0.000 0.000 5.721) 5.721 19.628 ( 0.000 0.000 -11.415) 11.415 19.628 ( 0.000 0.000 11.415) 11.415 ======================= Grid point 334 (102/125) ======================= q-point: ( 0.11 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 203 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.789 ( -3.290 2.003 -10.066) 10.777 1.789 ( -3.290 2.003 10.066) 10.777 2.044 ( 3.998 -3.226 -16.932) 17.694 2.044 ( 3.998 -3.226 16.932) 17.694 2.830 ( 0.502 -1.458 -3.327) 3.667 2.830 ( 0.502 -1.458 3.327) 3.667 4.895 ( 2.996 -3.660 -7.456) 8.829 4.895 ( 2.996 -3.660 7.456) 8.829 5.713 ( 3.370 0.349 -21.146) 21.416 5.713 ( 3.370 0.349 21.146) 21.416 7.235 ( -5.772 -1.408 -12.203) 13.572 7.235 ( -5.772 -1.408 12.203) 13.572 7.949 ( 1.224 10.502 -12.004) 15.996 7.949 ( 1.224 10.502 12.004) 15.996 8.931 ( -9.469 -7.650 -21.650) 24.838 8.931 ( -9.469 -7.650 21.650) 24.838 9.247 ( 2.629 -2.229 -22.245) 22.511 9.247 ( 2.629 -2.229 22.245) 22.511 10.007 ( 8.378 -3.896 -12.357) 15.429 10.007 ( 8.378 -3.896 12.357) 15.429 10.247 ( -5.844 2.972 -3.161) 7.279 10.247 ( -5.844 2.972 3.161) 7.279 10.696 ( -0.150 5.690 -2.866) 6.373 10.696 ( -0.150 5.690 2.866) 6.373 12.219 ( -6.051 6.709 -15.559) 17.992 12.219 ( -6.051 6.709 15.559) 17.992 12.701 ( -2.961 4.655 -6.858) 8.801 12.701 ( -2.961 4.655 6.858) 8.801 12.890 ( 2.557 -0.443 -5.491) 6.073 12.890 ( 2.557 -0.443 5.491) 6.073 13.252 ( 3.592 -6.304 -14.959) 16.626 13.252 ( 3.592 -6.304 14.959) 16.626 13.599 ( 4.459 8.930 -7.680) 12.594 13.599 ( 4.459 8.930 7.680) 12.594 14.022 ( -9.159 -9.101 -4.371) 13.632 14.022 ( -9.159 -9.101 4.371) 13.632 14.368 ( 4.962 -3.255 -2.433) 6.413 14.368 ( 4.962 -3.255 2.433) 6.413 14.581 ( 5.024 -0.374 -7.902) 9.371 14.581 ( 5.024 -0.374 7.902) 9.371 15.227 ( 2.650 2.829 -3.846) 5.461 15.227 ( 2.650 2.829 3.846) 5.461 15.502 ( -9.015 -3.951 -1.501) 9.956 15.502 ( -9.015 -3.951 1.501) 9.956 16.191 ( 6.671 -0.755 -3.732) 7.681 16.191 ( 6.671 -0.755 3.732) 7.681 16.735 ( -2.121 1.636 -0.953) 2.843 16.735 ( -2.121 1.636 0.953) 2.843 16.870 ( 0.049 -0.608 -2.187) 2.270 16.870 ( 0.049 -0.608 2.187) 2.270 17.488 ( 10.905 -3.720 -4.427) 12.344 17.488 ( 10.905 -3.720 4.427) 12.344 19.563 ( -7.037 2.083 -10.098) 12.483 19.563 ( -7.037 2.083 10.098) 12.483 ======================= Grid point 336 (103/125) ======================= q-point: ( 0.22 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 203 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.723 ( -1.451 1.503 -7.638) 7.918 1.723 ( -1.451 1.503 7.638) 7.918 2.189 ( 6.466 -6.081 -13.190) 15.899 2.189 ( 6.466 -6.081 13.190) 15.899 2.874 ( 1.293 -2.562 -4.823) 5.612 2.874 ( 1.293 -2.562 4.823) 5.612 4.996 ( 1.997 -4.118 -9.225) 10.298 4.996 ( 1.997 -4.118 9.225) 10.298 5.780 ( 7.532 1.038 -19.533) 20.961 5.780 ( 7.532 1.038 19.533) 20.961 7.100 ( -13.046 1.097 -5.321) 14.132 7.100 ( -13.046 1.097 5.321) 14.132 7.862 ( 6.329 6.305 -17.543) 19.686 7.862 ( 6.329 6.305 17.543) 19.686 8.934 ( -9.644 -8.217 -18.443) 22.375 8.934 ( -9.644 -8.217 18.443) 22.375 9.264 ( -2.796 0.664 -19.985) 20.191 9.264 ( -2.796 0.664 19.985) 20.191 9.971 ( -6.432 7.973 -3.582) 10.852 9.971 ( -6.432 7.973 3.582) 10.852 10.340 ( 9.416 -9.662 -7.211) 15.297 10.340 ( 9.416 -9.662 7.211) 15.297 10.600 ( 1.465 6.532 -2.775) 7.247 10.600 ( 1.465 6.532 2.775) 7.247 12.034 ( -5.446 6.289 -14.770) 16.951 12.034 ( -5.446 6.289 14.770) 16.951 12.556 ( -4.261 7.434 -8.329) 11.949 12.556 ( -4.261 7.434 8.329) 11.949 12.932 ( 2.535 -0.521 -3.695) 4.511 12.932 ( 2.535 -0.521 3.695) 4.511 13.323 ( -2.426 -0.369 -9.592) 9.901 13.323 ( -2.426 -0.369 9.592) 9.901 13.608 ( 8.367 0.639 -3.830) 9.224 13.608 ( 8.367 0.639 3.830) 9.224 13.986 ( -8.181 -3.429 -6.225) 10.837 13.986 ( -8.181 -3.429 6.225) 10.837 14.503 ( 3.124 -3.529 -3.524) 5.884 14.503 ( 3.124 -3.529 3.524) 5.884 14.701 ( 8.899 -3.719 -4.538) 10.659 14.701 ( 8.899 -3.719 4.538) 10.659 15.212 ( 2.232 3.024 -5.355) 6.542 15.212 ( 2.232 3.024 5.355) 6.542 15.477 ( -5.488 -5.617 -0.962) 7.912 15.477 ( -5.488 -5.617 0.962) 7.912 16.264 ( 2.784 0.013 -5.164) 5.867 16.264 ( 2.784 0.013 5.164) 5.867 16.641 ( -6.475 1.936 -0.746) 6.799 16.641 ( -6.475 1.936 0.746) 6.799 16.933 ( 6.313 -1.032 -1.497) 6.569 16.933 ( 6.313 -1.032 1.497) 6.569 17.745 ( 15.713 -5.412 -2.845) 16.861 17.745 ( 15.713 -5.412 2.845) 16.861 19.393 ( -11.837 2.851 -7.315) 14.204 19.393 ( -11.837 2.851 7.315) 14.204 ======================= Grid point 338 (104/125) ======================= q-point: ( 0.33 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 203 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.712 ( 1.184 0.100 -5.200) 5.334 1.712 ( 1.184 0.100 5.200) 5.334 2.383 ( 6.669 -6.546 -8.570) 12.680 2.383 ( 6.669 -6.546 8.570) 12.680 2.939 ( 2.126 -2.624 -6.968) 7.743 2.939 ( 2.126 -2.624 6.968) 7.743 5.070 ( 0.034 -4.119 -9.643) 10.486 5.070 ( 0.034 -4.119 9.643) 10.486 5.810 ( 3.544 7.249 -17.284) 19.075 5.810 ( 3.544 7.249 17.284) 19.075 6.995 ( -3.836 -6.735 -2.915) 8.281 6.995 ( -3.836 -6.735 2.915) 8.281 7.858 ( 2.230 4.648 -16.491) 17.278 7.858 ( 2.230 4.648 16.491) 17.278 8.867 ( -9.614 2.072 -5.466) 11.252 8.867 ( -9.614 2.072 5.466) 11.252 9.185 ( -5.593 -0.942 -20.870) 21.627 9.185 ( -5.593 -0.942 20.870) 21.627 9.811 ( -2.580 3.502 -17.439) 17.973 9.811 ( -2.580 3.502 17.439) 17.973 10.474 ( -0.041 2.566 -3.713) 4.514 10.474 ( -0.041 2.566 3.713) 4.514 10.676 ( 10.260 -6.745 -9.289) 15.397 10.676 ( 10.260 -6.745 9.289) 15.397 11.892 ( -3.541 4.188 -14.863) 15.842 11.892 ( -3.541 4.188 14.863) 15.842 12.377 ( -4.453 7.222 -8.965) 12.343 12.377 ( -4.453 7.222 8.965) 12.343 12.972 ( 2.316 -0.480 -2.809) 3.673 12.972 ( 2.316 -0.480 2.809) 3.673 13.254 ( -4.279 1.827 -4.220) 6.282 13.254 ( -4.279 1.827 4.220) 6.282 13.732 ( 6.302 -2.369 -3.753) 7.708 13.732 ( 6.302 -2.369 3.753) 7.708 13.946 ( -3.430 -1.546 -10.071) 10.751 13.946 ( -3.430 -1.546 10.071) 10.751 14.545 ( 0.341 0.015 -1.964) 1.994 14.545 ( 0.341 0.015 1.964) 1.994 14.884 ( 7.077 -4.041 -4.072) 9.110 14.884 ( 7.077 -4.041 4.072) 9.110 15.205 ( 1.738 0.984 -7.158) 7.431 15.205 ( 1.738 0.984 7.158) 7.431 15.516 ( -0.871 -4.200 -2.326) 4.879 15.516 ( -0.871 -4.200 2.326) 4.879 16.274 ( 0.062 0.485 -4.162) 4.190 16.274 ( 0.062 0.485 4.162) 4.190 16.525 ( -6.223 1.588 -0.078) 6.423 16.525 ( -6.223 1.588 0.078) 6.423 17.037 ( 6.082 -0.961 -1.767) 6.406 17.037 ( 6.082 -0.961 1.767) 6.406 18.044 ( 15.937 -4.987 -2.151) 16.837 18.044 ( 15.937 -4.987 2.151) 16.837 19.179 ( -13.298 2.563 -4.642) 14.316 19.179 ( -13.298 2.563 4.642) 14.316 ======================= Grid point 340 (105/125) ======================= q-point: ( 0.44 0.00 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 203 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.731 ( 0.890 -0.164 -6.264) 6.329 1.731 ( 0.890 -0.164 6.264) 6.329 2.529 ( 2.868 -2.897 -2.936) 5.024 2.529 ( 2.868 -2.897 2.936) 5.024 2.997 ( 1.396 -1.237 -7.538) 7.765 2.997 ( 1.396 -1.237 7.538) 7.765 5.132 ( 0.096 -3.257 -5.595) 6.474 5.132 ( 0.096 -3.257 5.595) 6.474 5.680 ( -1.611 6.743 -11.211) 13.182 5.680 ( -1.611 6.743 11.211) 13.182 7.202 ( 7.243 -11.500 -3.689) 14.083 7.202 ( 7.243 -11.500 3.689) 14.083 7.718 ( -6.190 8.385 -6.851) 12.472 7.718 ( -6.190 8.385 6.851) 12.472 8.699 ( -3.947 3.609 -4.197) 6.799 8.699 ( -3.947 3.609 4.197) 6.799 9.168 ( -1.959 -1.923 -14.359) 14.619 9.168 ( -1.959 -1.923 14.359) 14.619 9.770 ( -0.347 0.402 -20.295) 20.302 9.770 ( -0.347 0.402 20.295) 20.302 10.433 ( -0.022 1.583 -3.381) 3.734 10.433 ( -0.022 1.583 3.381) 3.734 10.869 ( 4.251 -3.550 -8.949) 10.524 10.869 ( 4.251 -3.550 8.949) 10.524 11.815 ( -1.264 1.516 -14.973) 15.102 11.815 ( -1.264 1.516 14.973) 15.102 12.245 ( -2.121 3.186 -9.149) 9.918 12.245 ( -2.121 3.186 9.149) 9.918 13.005 ( 1.346 -0.298 -1.969) 2.404 13.005 ( 1.346 -0.298 1.969) 2.404 13.182 ( -2.344 0.908 -1.381) 2.868 13.182 ( -2.344 0.908 1.381) 2.868 13.822 ( 2.439 -1.181 -3.731) 4.611 13.822 ( 2.439 -1.181 3.731) 4.611 13.936 ( -0.833 -0.524 -12.834) 12.872 13.936 ( -0.833 -0.524 12.834) 12.872 14.537 ( -0.221 0.489 -0.808) 0.970 14.537 ( -0.221 0.489 0.808) 0.970 14.985 ( 2.076 -1.127 -3.734) 4.418 14.985 ( 2.076 -1.127 3.734) 4.418 15.224 ( 1.194 -0.236 -8.941) 9.023 15.224 ( 1.194 -0.236 8.941) 9.023 15.562 ( 0.324 -1.548 -2.971) 3.366 15.562 ( 0.324 -1.548 2.971) 3.366 16.266 ( -0.093 0.244 -1.664) 1.684 16.266 ( -0.093 0.244 1.664) 1.684 16.443 ( -2.809 0.669 -0.503) 2.931 16.443 ( -2.809 0.669 0.503) 2.931 17.107 ( 2.365 -0.403 -1.410) 2.783 17.107 ( 2.365 -0.403 1.410) 2.783 18.282 ( 8.751 -2.387 -1.701) 9.228 18.282 ( 8.751 -2.387 1.701) 9.228 18.993 ( -7.837 1.388 -1.998) 8.206 18.993 ( -7.837 1.388 1.998) 8.206 ======================= Grid point 352 (106/125) ======================= q-point: ( 0.11 0.11 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 115 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.756 ( -3.436 -0.000 -0.230) 3.443 1.756 ( -3.436 -0.000 0.230) 3.443 2.080 ( 5.643 0.000 -7.655) 9.510 2.080 ( 5.643 0.000 7.655) 9.510 2.822 ( 0.306 0.000 -1.202) 1.241 2.822 ( 0.306 0.000 1.202) 1.241 4.930 ( 5.499 0.000 -7.503) 9.302 4.930 ( 5.499 0.000 7.503) 9.302 5.781 ( 7.019 0.000 -17.378) 18.742 5.781 ( 7.019 0.000 17.378) 18.742 7.147 ( -7.619 -0.000 -7.988) 11.039 7.147 ( -7.619 -0.000 7.988) 11.039 8.008 ( -4.098 -0.000 -9.238) 10.106 8.008 ( -4.098 -0.000 9.238) 10.106 8.726 ( -9.004 -0.000 -26.739) 28.214 8.726 ( -9.004 -0.000 26.739) 28.214 9.273 ( 2.676 0.000 -17.738) 17.939 9.273 ( 2.676 0.000 17.738) 17.939 10.138 ( 4.673 0.000 -8.673) 9.852 10.138 ( 4.673 0.000 8.673) 9.852 10.165 ( 0.111 0.000 -8.783) 8.784 10.165 ( 0.111 0.000 8.783) 8.784 10.713 ( -3.381 -0.000 -1.794) 3.828 10.713 ( -3.381 -0.000 1.794) 3.828 12.139 ( -11.950 -0.000 -14.101) 18.483 12.139 ( -11.950 -0.000 14.101) 18.483 12.672 ( -5.618 -0.000 -5.878) 8.131 12.672 ( -5.618 -0.000 5.878) 8.131 12.917 ( 1.738 0.000 -7.904) 8.093 12.917 ( 1.738 0.000 7.904) 8.093 13.309 ( 8.247 0.000 -12.188) 14.717 13.309 ( 8.247 0.000 12.188) 14.717 13.755 ( -8.291 -0.000 -2.604) 8.690 13.755 ( -8.291 -0.000 2.604) 8.690 13.830 ( 7.277 0.000 -7.976) 10.797 13.830 ( 7.277 0.000 7.976) 10.797 14.410 ( 6.853 0.000 -1.514) 7.018 14.410 ( 6.853 0.000 1.514) 7.018 14.652 ( 5.650 0.000 -6.512) 8.621 14.652 ( 5.650 0.000 6.512) 8.621 15.260 ( -5.700 -0.000 -4.569) 7.305 15.260 ( -5.700 -0.000 4.569) 7.305 15.385 ( 2.144 0.000 -0.472) 2.196 15.385 ( 2.144 0.000 0.472) 2.196 16.265 ( 3.943 0.000 -6.600) 7.688 16.265 ( 3.943 0.000 6.600) 7.688 16.673 ( -7.805 -0.000 -1.486) 7.946 16.673 ( -7.805 -0.000 1.486) 7.946 16.909 ( 5.727 0.000 -0.706) 5.770 16.909 ( 5.727 0.000 0.706) 5.770 17.657 ( 17.650 0.000 -1.119) 17.685 17.657 ( 17.650 0.000 1.119) 17.685 19.447 ( -12.263 -0.000 -10.948) 16.439 19.447 ( -12.263 -0.000 10.948) 16.439 ======================= Grid point 354 (107/125) ======================= q-point: ( 0.22 0.11 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 203 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.722 ( -0.691 0.257 -2.740) 2.838 1.722 ( -0.691 0.257 2.740) 2.838 2.199 ( 7.486 -3.883 -7.447) 11.250 2.199 ( 7.486 -3.883 7.447) 11.250 2.845 ( 0.623 -2.260 -2.863) 3.701 2.845 ( 0.623 -2.260 2.863) 3.701 5.002 ( 3.314 -0.767 -8.232) 8.907 5.002 ( 3.314 -0.767 8.232) 8.907 5.909 ( 11.206 0.099 -14.148) 18.048 5.909 ( 11.206 0.099 14.148) 18.048 6.990 ( -10.179 4.000 -2.304) 11.176 6.990 ( -10.179 4.000 2.304) 11.176 7.933 ( -4.702 -0.803 -13.478) 14.297 7.933 ( -4.702 -0.803 13.478) 14.297 8.684 ( -6.307 -5.553 -26.079) 27.399 8.684 ( -6.307 -5.553 26.079) 27.399 9.280 ( 0.284 2.822 -13.081) 13.385 9.280 ( 0.284 2.822 13.081) 13.385 9.969 ( -10.037 3.854 -10.647) 15.131 9.969 ( -10.037 3.854 10.647) 15.131 10.394 ( 14.562 -2.986 -12.918) 19.694 10.394 ( 14.562 -2.986 12.918) 19.694 10.642 ( -3.587 0.897 -2.639) 4.543 10.642 ( -3.587 0.897 2.639) 4.543 11.961 ( -12.558 0.595 -13.436) 18.401 11.961 ( -12.558 0.595 13.436) 18.401 12.565 ( -6.521 3.276 -8.334) 11.078 12.565 ( -6.521 3.276 8.334) 11.078 12.941 ( 0.981 -0.766 -7.616) 7.717 12.941 ( 0.981 -0.766 7.616) 7.717 13.341 ( -0.564 4.526 -8.259) 9.434 13.341 ( -0.564 4.526 8.259) 9.434 13.660 ( -3.259 -3.572 -2.896) 5.636 13.660 ( -3.259 -3.572 2.896) 5.636 13.966 ( 10.361 2.019 -4.796) 11.594 13.966 ( 10.361 2.019 4.796) 11.594 14.533 ( 7.325 -0.946 -5.756) 9.364 14.533 ( 7.325 -0.946 5.756) 9.364 14.750 ( 6.629 -3.187 -4.709) 8.734 14.750 ( 6.629 -3.187 4.709) 8.734 15.172 ( -6.790 -2.026 -3.752) 8.018 15.172 ( -6.790 -2.026 3.752) 8.018 15.479 ( 9.639 0.754 -2.147) 9.904 15.479 ( 9.639 0.754 2.147) 9.904 16.287 ( 0.040 0.257 -7.148) 7.153 16.287 ( 0.040 0.257 7.148) 7.153 16.558 ( -8.171 0.566 -0.546) 8.208 16.558 ( -8.171 0.566 0.546) 8.208 16.991 ( 4.324 -1.324 -1.687) 4.827 16.991 ( 4.324 -1.324 1.687) 4.827 17.928 ( 19.390 -2.045 -1.153) 19.532 17.928 ( 19.390 -2.045 1.153) 19.532 19.255 ( -13.632 1.703 -10.607) 17.356 19.255 ( -13.632 1.703 10.607) 17.356 ======================= Grid point 356 (108/125) ======================= q-point: ( 0.33 0.11 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 203 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.730 ( 1.511 -0.058 -3.575) 3.882 1.730 ( 1.511 -0.058 3.575) 3.882 2.380 ( 7.554 -5.444 -6.458) 11.332 2.380 ( 7.554 -5.444 6.458) 11.332 2.904 ( 0.780 -3.752 -5.721) 6.886 2.904 ( 0.780 -3.752 5.721) 6.886 5.043 ( 1.010 -1.584 -9.102) 9.294 5.043 ( 1.010 -1.584 9.102) 9.294 5.969 ( 3.032 8.585 -14.814) 17.388 5.969 ( 3.032 8.585 14.814) 17.388 6.899 ( 2.725 -4.447 -2.116) 5.629 6.899 ( 2.725 -4.447 2.116) 5.629 7.902 ( -4.478 -0.971 -13.495) 14.251 7.902 ( -4.478 -0.971 13.495) 14.251 8.661 ( -10.418 -3.937 -12.023) 16.389 8.661 ( -10.418 -3.937 12.023) 16.389 9.199 ( -0.133 5.181 -19.426) 20.106 9.199 ( -0.133 5.181 19.426) 20.106 9.819 ( -4.467 2.265 -22.609) 23.157 9.819 ( -4.467 2.265 22.609) 23.157 10.479 ( -2.885 0.896 -7.719) 8.289 10.479 ( -2.885 0.896 7.719) 8.289 10.734 ( 11.147 -4.383 -11.491) 16.598 10.734 ( 11.147 -4.383 11.491) 16.598 11.808 ( -11.146 -1.610 -13.637) 17.686 11.808 ( -11.146 -1.610 13.637) 17.686 12.407 ( -6.275 5.464 -9.911) 12.940 12.407 ( -6.275 5.464 9.911) 12.940 12.965 ( -0.007 -1.425 -6.996) 7.139 12.965 ( -0.007 -1.425 6.996) 7.139 13.225 ( -4.785 3.398 -5.069) 7.755 13.225 ( -4.785 3.398 5.069) 7.755 13.720 ( -1.320 -5.850 -4.376) 7.424 13.720 ( -1.320 -5.850 4.376) 7.424 14.049 ( 12.152 6.262 -5.961) 14.914 14.049 ( 12.152 6.262 5.961) 14.914 14.589 ( 3.425 2.313 -4.861) 6.381 14.589 ( 3.425 2.313 4.861) 6.381 14.903 ( 4.973 -4.120 -5.341) 8.380 14.903 ( 4.973 -4.120 5.341) 8.380 15.155 ( -1.980 -3.217 -5.820) 6.939 15.155 ( -1.980 -3.217 5.820) 6.939 15.593 ( 10.936 2.668 -2.588) 11.550 15.593 ( 10.936 2.668 2.588) 11.550 16.273 ( -1.083 0.134 -6.142) 6.239 16.273 ( -1.083 0.134 6.142) 6.239 16.451 ( -6.649 0.062 -0.212) 6.652 16.451 ( -6.649 0.062 0.212) 6.652 17.054 ( 0.272 -2.538 -1.569) 2.996 17.054 ( 0.272 -2.538 1.569) 2.996 18.199 ( 14.296 -2.408 -1.907) 14.622 18.199 ( 14.296 -2.408 1.907) 14.622 19.061 ( -9.110 2.462 -9.798) 13.604 19.061 ( -9.110 2.462 9.798) 13.604 ======================= Grid point 358 (109/125) ======================= q-point: ( 0.44 0.11 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 203 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.744 ( 0.731 0.619 -5.567) 5.649 1.744 ( 0.731 0.619 5.567) 5.649 2.527 ( 3.621 -2.652 -2.897) 5.343 2.527 ( 3.621 -2.652 2.897) 5.343 2.962 ( -1.006 -3.117 -6.735) 7.489 2.962 ( -1.006 -3.117 6.735) 7.489 5.109 ( 3.160 -4.035 -9.659) 10.935 5.109 ( 3.160 -4.035 9.659) 10.935 5.761 ( -5.174 11.547 -12.753) 17.965 5.761 ( -5.174 11.547 12.753) 17.965 7.175 ( 13.960 -10.381 -4.843) 18.058 7.175 ( 13.960 -10.381 4.843) 18.058 7.788 ( -5.095 6.957 -6.152) 10.593 7.788 ( -5.095 6.957 6.152) 10.593 8.543 ( -12.596 -4.218 -6.197) 14.658 8.543 ( -12.596 -4.218 6.197) 14.658 9.187 ( 4.334 0.529 -17.681) 18.212 9.187 ( 4.334 0.529 17.681) 18.212 9.765 ( -1.528 0.276 -23.910) 23.960 9.765 ( -1.528 0.276 23.910) 23.961 10.420 ( -4.211 -0.258 -6.688) 7.908 10.420 ( -4.211 -0.258 6.688) 7.908 10.913 ( 7.394 -0.606 -11.471) 13.661 10.913 ( 7.394 -0.606 11.471) 13.661 11.720 ( -8.780 -4.287 -13.685) 16.815 11.720 ( -8.780 -4.287 13.685) 16.815 12.260 ( -3.870 3.599 -9.973) 11.287 12.260 ( -3.870 3.599 9.973) 11.287 12.979 ( -1.485 -1.415 -6.288) 6.614 12.979 ( -1.485 -1.415 6.288) 6.614 13.142 ( -3.249 -0.225 -5.445) 6.344 13.142 ( -3.249 -0.225 5.445) 6.344 13.778 ( -2.587 -4.606 -4.553) 6.974 13.778 ( -2.587 -4.606 4.553) 6.974 14.099 ( 12.383 8.469 -9.020) 17.505 14.099 ( 12.383 8.469 9.020) 17.505 14.578 ( 1.916 2.998 -2.303) 4.239 14.578 ( 1.916 2.998 2.303) 4.239 14.974 ( -0.631 -1.814 -4.081) 4.511 14.974 ( -0.631 -1.814 4.081) 4.511 15.192 ( 0.345 -1.389 -7.290) 7.429 15.192 ( 0.345 -1.389 7.290) 7.429 15.671 ( 8.960 4.754 -1.991) 10.337 15.671 ( 8.960 4.754 1.991) 10.337 16.261 ( -0.756 -0.177 -3.570) 3.654 16.261 ( -0.756 -0.177 3.570) 3.654 16.402 ( -1.886 -1.797 -0.969) 2.780 16.402 ( -1.886 -1.797 0.969) 2.780 17.069 ( -4.185 -2.685 -0.977) 5.067 17.069 ( -4.185 -2.685 0.977) 5.067 18.320 ( -0.968 -0.021 -1.297) 1.618 18.320 ( -0.968 -0.021 1.297) 1.618 18.992 ( 4.861 1.267 -6.390) 8.128 18.992 ( 4.861 1.267 6.390) 8.128 ======================= Grid point 360 (110/125) ======================= q-point: (-0.44 0.11 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 203 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.727 ( -0.892 1.154 -6.054) 6.228 1.727 ( -0.892 1.154 6.054) 6.228 2.534 ( -2.841 2.604 -2.559) 4.626 2.534 ( -2.841 2.604 2.559) 4.626 2.963 ( -3.291 -1.074 -6.939) 7.755 2.963 ( -3.291 -1.074 6.939) 7.755 5.219 ( 6.133 1.070 -3.038) 6.927 5.219 ( 6.133 1.070 3.038) 6.927 5.592 ( -3.776 -0.271 -6.875) 7.848 5.592 ( -3.776 -0.271 6.875) 7.848 7.292 ( -3.899 7.232 -0.294) 8.222 7.292 ( -3.899 7.232 0.294) 8.222 7.752 ( 9.411 -0.626 -6.098) 11.232 7.752 ( 9.411 -0.626 6.098) 11.232 8.550 ( -3.035 -12.187 -7.514) 14.636 8.550 ( -3.035 -12.187 7.514) 14.636 9.251 ( 4.531 -0.032 -17.207) 17.793 9.251 ( 4.531 -0.032 17.207) 17.793 9.763 ( 0.282 -1.117 -20.307) 20.339 9.763 ( 0.282 -1.117 20.307) 20.339 10.380 ( -4.276 -1.908 -5.045) 6.883 10.380 ( -4.276 -1.908 5.045) 6.883 10.914 ( -0.450 6.711 -10.668) 12.611 10.914 ( -0.450 6.711 10.668) 12.611 11.711 ( -5.678 -7.028 -13.697) 16.408 11.711 ( -5.678 -7.028 13.697) 16.408 12.222 ( 0.383 -2.014 -9.408) 9.629 12.222 ( 0.383 -2.014 9.408) 9.629 12.964 ( -2.750 -0.520 -5.734) 6.381 12.964 ( -2.750 -0.520 5.734) 6.381 13.151 ( -0.775 -3.912 -6.355) 7.503 13.151 ( -0.775 -3.912 6.355) 7.503 13.788 ( -3.335 -1.605 -4.741) 6.015 13.788 ( -3.335 -1.605 4.741) 6.015 14.116 ( 11.829 9.927 -11.396) 19.192 14.116 ( 11.829 9.927 11.396) 19.192 14.563 ( 1.585 1.696 -1.103) 2.570 14.563 ( 1.585 1.696 1.103) 2.570 14.956 ( -4.078 0.309 -3.316) 5.265 14.956 ( -4.078 0.309 3.316) 5.265 15.180 ( -2.536 0.790 -8.124) 8.547 15.180 ( -2.536 0.790 8.124) 8.547 15.685 ( 6.109 5.924 -1.309) 8.609 15.685 ( 6.109 5.924 1.309) 8.609 16.262 ( 0.341 -0.302 -0.738) 0.868 16.262 ( 0.341 -0.302 0.738) 0.868 16.454 ( 3.224 -3.073 -1.663) 4.754 16.454 ( 3.224 -3.073 1.663) 4.754 17.025 ( -7.578 -1.893 -1.685) 7.991 17.025 ( -7.578 -1.893 1.685) 7.991 18.194 ( -10.944 3.976 -5.311) 12.798 18.194 ( -10.944 3.976 5.311) 12.798 19.124 ( 12.891 -0.781 -2.213) 13.103 19.124 ( 12.891 -0.781 2.213) 13.103 ======================= Grid point 362 (111/125) ======================= q-point: (-0.33 0.11 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 203 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.700 ( -0.647 0.356 -6.233) 6.277 1.700 ( -0.647 0.356 6.233) 6.277 2.391 ( -6.887 6.113 -9.054) 12.914 2.391 ( -6.887 6.113 9.054) 12.914 2.926 ( -2.686 0.339 -6.889) 7.402 2.926 ( -2.686 0.339 6.889) 7.402 5.195 ( 3.930 8.709 -8.852) 13.025 5.195 ( 3.930 8.709 8.852) 13.025 5.642 ( -3.802 -7.764 -14.776) 17.119 5.642 ( -3.802 -7.764 14.776) 17.119 7.154 ( 3.699 4.311 -5.771) 8.098 7.154 ( 3.699 4.311 5.771) 8.098 7.792 ( -2.953 2.604 -11.858) 12.495 7.792 ( -2.953 2.604 11.858) 12.495 8.828 ( 8.903 -14.270 -9.635) 19.384 8.828 ( 8.903 -14.270 9.635) 19.384 9.295 ( 2.496 0.343 -22.478) 22.619 9.295 ( 2.496 0.343 22.478) 22.619 9.818 ( 5.266 -2.006 -14.468) 15.526 9.818 ( 5.266 -2.006 14.468) 15.526 10.369 ( -5.808 -5.423 -3.299) 8.604 10.369 ( -5.808 -5.423 3.299) 8.604 10.713 ( -5.834 12.409 -9.191) 16.508 10.713 ( -5.834 12.409 9.191) 16.508 11.783 ( -2.637 -9.336 -13.864) 16.921 11.783 ( -2.637 -9.336 13.864) 16.921 12.316 ( 2.659 -6.548 -9.004) 11.447 12.316 ( 2.659 -6.548 9.004) 11.447 12.933 ( -2.509 -0.183 -5.422) 5.977 12.933 ( -2.509 -0.183 5.422) 5.977 13.224 ( 0.113 -5.579 -6.927) 8.895 13.224 ( 0.113 -5.579 6.927) 8.895 13.731 ( -3.193 3.505 -5.746) 7.449 13.731 ( -3.193 3.505 5.746) 7.449 14.129 ( 12.334 8.286 -11.023) 18.501 14.129 ( 12.334 8.286 11.023) 18.501 14.564 ( 1.097 1.010 -0.695) 1.645 14.564 ( 1.097 1.010 0.695) 1.645 14.838 ( -9.100 3.903 -3.236) 10.417 14.838 ( -9.100 3.903 3.236) 10.417 15.132 ( -3.447 -0.802 -6.778) 7.647 15.132 ( -3.447 -0.802 6.778) 7.647 15.669 ( 5.848 5.980 -0.719) 8.395 15.669 ( 5.848 5.980 0.719) 8.395 16.269 ( 0.148 0.392 -2.581) 2.615 16.269 ( 0.148 0.392 2.581) 2.615 16.559 ( 4.225 -3.337 -1.043) 5.484 16.559 ( 4.225 -3.337 1.043) 5.484 16.940 ( -7.524 -0.905 -2.492) 7.977 16.940 ( -7.524 -0.905 2.492) 7.977 17.951 ( -11.724 6.943 -6.586) 15.134 17.951 ( -11.724 6.943 6.586) 15.134 19.313 ( 11.380 -1.924 -0.689) 11.562 19.313 ( 11.380 -1.924 0.689) 11.562 ======================= Grid point 364 (112/125) ======================= q-point: (-0.22 0.11 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 203 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.715 ( 1.304 -1.844 -9.204) 9.477 1.715 ( 1.304 -1.844 9.204) 9.477 2.204 ( -5.321 6.381 -15.054) 17.195 2.204 ( -5.321 6.381 15.054) 17.195 2.886 ( -1.292 1.380 -5.891) 6.187 2.886 ( -1.292 1.380 5.891) 6.187 5.091 ( 1.019 8.754 -10.022) 13.346 5.091 ( 1.019 8.754 10.022) 13.346 5.666 ( -4.276 -3.431 -19.792) 20.537 5.666 ( -4.276 -3.431 19.792) 20.537 7.283 ( 14.359 -1.937 -7.188) 16.174 7.283 ( 14.359 -1.937 7.188) 16.174 7.656 ( -11.891 -0.945 -13.655) 18.132 7.656 ( -11.891 -0.945 13.655) 18.132 9.082 ( 6.777 -2.548 -16.423) 17.948 9.082 ( 6.777 -2.548 16.423) 17.948 9.311 ( 0.273 0.069 -26.687) 26.689 9.311 ( 0.273 0.069 26.687) 26.689 9.985 ( 11.527 -4.204 -4.637) 13.117 9.985 ( 11.527 -4.204 4.637) 13.117 10.340 ( -12.775 0.560 -7.310) 14.729 10.340 ( -12.775 0.560 7.310) 14.729 10.476 ( -1.384 2.667 -3.396) 4.534 10.476 ( -1.384 2.667 3.396) 4.534 11.924 ( -0.185 -11.002 -14.225) 17.984 11.924 ( -0.185 -11.002 14.225) 17.984 12.467 ( 1.870 -8.382 -8.945) 12.400 12.467 ( 1.870 -8.382 8.945) 12.400 12.904 ( -1.689 0.279 -3.908) 4.267 12.904 ( -1.689 0.279 3.908) 4.267 13.318 ( 0.722 -5.814 -7.618) 9.610 13.318 ( 0.722 -5.814 7.618) 9.610 13.594 ( -3.037 8.573 -7.712) 11.924 13.594 ( -3.037 8.573 7.712) 11.924 14.202 ( 13.884 5.117 -7.544) 16.609 14.202 ( 13.884 5.117 7.544) 16.609 14.532 ( -3.040 4.557 -1.092) 5.586 14.532 ( -3.040 4.557 1.092) 5.586 14.626 ( -9.862 3.139 -4.498) 11.285 14.626 ( -9.862 3.139 4.498) 11.285 15.123 ( -2.175 -2.807 -4.548) 5.770 15.123 ( -2.175 -2.807 4.548) 5.770 15.663 ( 6.098 5.327 -0.682) 8.125 15.663 ( 6.098 5.327 0.682) 8.125 16.235 ( -2.649 2.044 -3.002) 4.496 16.235 ( -2.649 2.044 3.002) 4.496 16.652 ( 1.359 -3.461 -0.210) 3.724 16.652 ( 1.359 -3.461 0.210) 3.724 16.880 ( -2.150 -0.357 -3.216) 3.885 16.880 ( -2.150 -0.357 3.216) 3.885 17.692 ( -8.304 8.451 -7.028) 13.775 17.692 ( -8.304 8.451 7.028) 13.775 19.473 ( 6.567 -2.906 -3.819) 8.134 19.473 ( 6.567 -2.906 3.819) 8.134 ======================= Grid point 366 (113/125) ======================= q-point: (-0.11 0.11 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 115 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.772 ( -0.000 -3.143 -12.524) 12.912 1.772 ( -0.000 -3.143 12.524) 12.912 2.076 ( 0.000 5.066 -19.666) 20.308 2.076 ( 0.000 5.066 19.666) 20.308 2.852 ( 0.000 1.808 -4.638) 4.978 2.852 ( 0.000 1.808 4.638) 4.978 4.965 ( 0.000 7.350 -8.502) 11.239 4.965 ( 0.000 7.350 8.502) 11.239 5.674 ( -0.000 -1.632 -21.616) 21.678 5.674 ( -0.000 -1.632 21.616) 21.678 7.355 ( 0.000 7.311 -13.315) 15.191 7.355 ( 0.000 7.311 13.315) 15.191 7.704 ( -0.000 -16.525 -11.033) 19.869 7.704 ( -0.000 -16.525 11.033) 19.869 9.102 ( 0.000 4.769 -21.792) 22.308 9.102 ( 0.000 4.769 21.792) 22.308 9.285 ( 0.000 3.641 -26.707) 26.954 9.285 ( 0.000 3.641 26.707) 26.954 10.066 ( 0.000 9.322 -9.341) 13.197 10.066 ( 0.000 9.322 9.341) 13.197 10.216 ( -0.000 -5.178 -6.913) 8.637 10.216 ( -0.000 -5.178 6.913) 8.637 10.561 ( -0.000 -9.843 -1.877) 10.021 10.561 ( -0.000 -9.843 1.877) 10.021 12.104 ( -0.000 -11.377 -15.223) 19.005 12.104 ( -0.000 -11.377 15.223) 19.005 12.611 ( -0.000 -8.227 -8.514) 11.839 12.611 ( -0.000 -8.227 8.514) 11.839 12.883 ( 0.000 0.783 -0.517) 0.939 12.883 ( 0.000 0.783 0.517) 0.939 13.397 ( 0.000 12.028 -11.522) 16.656 13.397 ( 0.000 12.028 11.522) 16.656 13.434 ( -0.000 -7.758 -8.386) 11.424 13.434 ( -0.000 -7.758 8.386) 11.424 14.282 ( 0.000 10.729 -5.032) 11.851 14.282 ( 0.000 10.729 5.032) 11.851 14.330 ( 0.000 0.969 -2.646) 2.818 14.330 ( 0.000 0.969 2.646) 2.818 14.556 ( 0.000 1.064 -6.548) 6.634 14.556 ( 0.000 1.064 6.548) 6.634 15.158 ( -0.000 -3.477 -3.602) 5.007 15.158 ( -0.000 -3.477 3.602) 5.007 15.639 ( 0.000 4.532 -2.575) 5.213 15.639 ( 0.000 4.532 2.575) 5.213 16.165 ( 0.000 2.648 -1.950) 3.289 16.165 ( 0.000 2.648 1.950) 3.289 16.706 ( -0.000 -2.789 -0.048) 2.790 16.706 ( -0.000 -2.789 0.048) 2.790 16.881 ( -0.000 -0.304 -4.063) 4.074 16.881 ( -0.000 -0.304 4.063) 4.074 17.503 ( 0.000 7.493 -6.957) 10.224 17.503 ( 0.000 7.493 6.957) 10.224 19.567 ( -0.000 -3.228 -7.381) 8.056 19.567 ( -0.000 -3.228 7.381) 8.056 ======================= Grid point 372 (114/125) ======================= q-point: ( 0.22 0.22 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 115 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.725 ( 1.480 0.000 -1.027) 1.801 1.725 ( 1.480 0.000 1.027) 1.801 2.281 ( 9.143 0.000 -3.645) 9.843 2.281 ( 9.143 0.000 3.645) 9.843 2.835 ( 0.766 0.000 -1.712) 1.875 2.835 ( 0.766 0.000 1.712) 1.875 5.024 ( 0.177 0.000 -7.286) 7.288 5.024 ( 0.177 0.000 7.286) 7.288 6.093 ( 15.105 0.000 -5.375) 16.033 6.093 ( 15.105 0.000 5.375) 16.033 6.911 ( -7.141 -0.000 -2.493) 7.564 6.911 ( -7.141 -0.000 2.493) 7.564 7.767 ( -13.165 -0.000 -10.118) 16.604 7.767 ( -13.165 -0.000 10.118) 16.604 8.619 ( -0.582 -0.000 -32.517) 32.522 8.619 ( -0.582 -0.000 32.517) 32.522 9.330 ( 2.295 0.000 -7.292) 7.644 9.330 ( 2.295 0.000 7.292) 7.644 9.840 ( -11.399 -0.000 -19.570) 22.648 9.840 ( -11.399 -0.000 19.570) 22.648 10.546 ( -8.205 -0.000 -1.112) 8.280 10.546 ( -8.205 -0.000 1.112) 8.280 10.611 ( 17.043 0.000 -15.833) 23.263 10.611 ( 17.043 0.000 15.833) 23.263 11.769 ( -15.021 -0.000 -11.796) 19.099 11.769 ( -15.021 -0.000 11.796) 19.099 12.497 ( -7.276 -0.000 -8.924) 11.514 12.497 ( -7.276 -0.000 8.924) 11.514 12.946 ( 0.539 0.000 -6.935) 6.956 12.946 ( 0.539 0.000 6.935) 6.956 13.361 ( -5.884 -0.000 -5.274) 7.902 13.361 ( -5.884 -0.000 5.274) 7.902 13.547 ( -2.665 -0.000 -3.733) 4.587 13.547 ( -2.665 -0.000 3.733) 4.587 14.175 ( 14.355 0.000 -7.521) 16.206 14.175 ( 14.355 0.000 7.521) 16.206 14.646 ( 7.148 0.000 -2.447) 7.556 14.646 ( 7.148 0.000 2.447) 7.556 14.796 ( 5.785 0.000 -2.258) 6.210 14.796 ( 5.785 0.000 2.258) 6.210 15.097 ( -0.176 -0.000 -1.756) 1.764 15.097 ( -0.176 -0.000 1.756) 1.764 15.649 ( 13.454 0.000 -3.858) 13.996 15.649 ( 13.454 0.000 3.858) 13.996 16.275 ( -1.819 -0.000 -7.819) 8.028 16.275 ( -1.819 -0.000 7.819) 8.028 16.452 ( -8.110 -0.000 -0.425) 8.121 16.452 ( -8.110 -0.000 0.425) 8.121 17.002 ( -0.931 -0.000 -1.333) 1.626 17.002 ( -0.931 -0.000 1.333) 1.626 18.159 ( 15.814 0.000 -3.652) 16.230 18.159 ( 15.814 0.000 3.652) 16.230 19.106 ( -9.473 -0.000 -13.292) 16.322 19.106 ( -9.473 -0.000 13.292) 16.322 ======================= Grid point 374 (115/125) ======================= q-point: ( 0.33 0.22 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 203 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.759 ( 3.028 0.192 -3.515) 4.644 1.759 ( 3.028 0.192 3.515) 4.644 2.426 ( 8.560 -2.537 -3.152) 9.469 2.426 ( 8.560 -2.537 3.152) 9.469 2.863 ( 0.409 -2.187 -3.275) 3.959 2.863 ( 0.409 -2.187 3.275) 3.959 5.017 ( -1.610 -1.377 -7.688) 7.975 5.017 ( -1.610 -1.377 7.688) 7.975 6.180 ( 4.839 11.214 -8.731) 15.013 6.180 ( 4.839 11.214 8.731) 15.013 6.909 ( 8.520 -4.820 -3.439) 10.375 6.909 ( 8.520 -4.820 3.439) 10.375 7.672 ( -12.900 -9.515 -9.338) 18.551 7.672 ( -12.900 -9.515 9.338) 18.551 8.575 ( -4.719 3.148 -21.245) 21.989 8.575 ( -4.719 3.148 21.245) 21.989 9.305 ( 2.271 6.252 -11.246) 13.066 9.305 ( 2.271 6.252 11.246) 13.066 9.737 ( -6.575 -3.077 -26.528) 27.503 9.737 ( -6.575 -3.077 26.528) 27.503 10.411 ( -8.976 0.506 -4.969) 10.272 10.411 ( -8.976 0.506 4.969) 10.272 10.859 ( 15.328 -2.101 -14.941) 21.508 10.859 ( 15.328 -2.101 14.941) 21.508 11.593 ( -13.877 -2.777 -11.238) 18.072 11.593 ( -13.877 -2.777 11.238) 18.072 12.376 ( -7.538 2.478 -10.300) 13.002 12.376 ( -7.538 2.478 10.300) 13.002 12.951 ( -0.153 -0.361 -6.172) 6.184 12.951 ( -0.153 -0.361 6.172) 6.184 13.221 ( -5.840 4.641 -5.754) 9.421 13.221 ( -5.840 4.641 5.754) 9.421 13.584 ( -2.566 -6.450 -3.709) 7.871 13.584 ( -2.566 -6.450 3.709) 7.871 14.320 ( 12.734 4.375 -5.066) 14.387 14.320 ( 12.734 4.375 5.066) 14.387 14.674 ( 1.433 2.048 -4.424) 5.081 14.674 ( 1.433 2.048 4.424) 5.081 14.900 ( 4.550 -2.031 -8.254) 9.642 14.900 ( 4.550 -2.031 8.254) 9.642 15.166 ( 8.271 -0.254 -4.294) 9.323 15.166 ( 8.271 -0.254 4.294) 9.323 15.811 ( 13.470 3.210 -4.194) 14.468 15.811 ( 13.470 3.210 4.194) 14.468 16.249 ( -2.092 -0.425 -7.755) 8.043 16.249 ( -2.092 -0.425 7.755) 8.043 16.356 ( -6.463 -0.905 -0.647) 6.558 16.356 ( -6.463 -0.905 0.647) 6.558 16.975 ( -5.640 -2.406 -0.523) 6.154 16.975 ( -5.640 -2.406 0.523) 6.154 18.301 ( 3.285 -0.671 -2.452) 4.154 18.301 ( 3.285 -0.671 2.452) 4.154 19.041 ( 2.419 1.230 -12.511) 12.801 19.041 ( 2.419 1.230 12.511) 12.801 ======================= Grid point 376 (116/125) ======================= q-point: ( 0.44 0.22 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 203 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.778 ( 1.872 1.866 -4.638) 5.339 1.778 ( 1.872 1.866 4.638) 5.339 2.546 ( 3.569 -1.197 -1.466) 4.039 2.546 ( 3.569 -1.197 1.466) 4.039 2.897 ( -1.317 -2.516 -4.335) 5.182 2.897 ( -1.317 -2.516 4.335) 5.182 5.064 ( 1.691 -5.619 -9.601) 11.252 5.064 ( 1.691 -5.619 9.601) 11.252 5.940 ( -1.951 17.079 -12.226) 21.094 5.940 ( -1.951 17.079 12.226) 21.094 7.230 ( 14.983 -8.125 -4.419) 17.608 7.230 ( 14.983 -8.125 4.419) 17.608 7.675 ( -8.557 -10.105 -5.454) 14.321 7.675 ( -8.557 -10.105 5.454) 14.321 8.407 ( -7.341 4.742 -4.875) 10.007 8.407 ( -7.341 4.742 4.875) 10.007 9.262 ( 2.497 3.039 -16.186) 16.657 9.262 ( 2.497 3.039 16.186) 16.657 9.725 ( -2.558 -2.172 -23.458) 23.697 9.725 ( -2.558 -2.172 23.458) 23.697 10.313 ( -7.851 -2.433 -7.392) 11.054 10.313 ( -7.851 -2.433 7.392) 11.054 11.047 ( 10.904 1.727 -14.610) 18.312 11.047 ( 10.904 1.727 14.610) 18.312 11.494 ( -10.990 -6.074 -11.060) 16.733 11.494 ( -10.990 -6.074 11.060) 16.733 12.242 ( -5.915 2.217 -10.644) 12.377 12.242 ( -5.915 2.217 10.644) 12.377 12.954 ( -0.444 -0.467 -6.614) 6.645 12.954 ( -0.444 -0.467 6.614) 6.645 13.101 ( -4.191 1.823 -6.629) 8.052 13.101 ( -4.191 1.823 6.629) 8.052 13.648 ( -3.094 -6.366 -3.842) 8.053 13.648 ( -3.094 -6.366 3.842) 8.053 14.394 ( 11.184 6.128 -4.063) 13.384 14.394 ( 11.184 6.128 4.063) 13.384 14.651 ( 0.686 2.498 -2.746) 3.775 14.651 ( 0.686 2.498 2.746) 3.775 14.953 ( 2.088 1.014 -6.418) 6.825 14.953 ( 2.088 1.014 6.418) 6.825 15.255 ( 6.656 3.201 -6.672) 9.953 15.255 ( 6.656 3.201 6.672) 9.953 15.876 ( 7.004 6.351 -1.456) 9.566 15.876 ( 7.004 6.351 1.456) 9.566 16.245 ( 0.214 -1.020 -4.527) 4.646 16.245 ( 0.214 -1.020 4.527) 4.646 16.343 ( -0.291 -3.752 -1.832) 4.186 16.343 ( -0.291 -3.752 1.832) 4.186 16.928 ( -8.587 -3.817 -1.592) 9.531 16.928 ( -8.587 -3.817 1.592) 9.531 18.266 ( -7.100 0.775 -4.111) 8.240 18.266 ( -7.100 0.775 4.111) 8.240 19.128 ( 11.353 0.759 -7.123) 13.424 19.128 ( 11.353 0.759 7.123) 13.424 ======================= Grid point 378 (117/125) ======================= q-point: (-0.44 0.22 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 203 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.752 ( 0.107 2.898 -4.950) 5.737 1.752 ( 0.107 2.898 4.950) 5.737 2.533 ( -3.566 2.819 -3.247) 5.586 2.533 ( -3.566 2.819 3.247) 5.586 2.904 ( -1.822 -1.345 -4.833) 5.337 2.904 ( -1.822 -1.345 4.833) 5.337 5.233 ( 5.154 -8.949 -11.540) 15.486 5.233 ( 5.154 -8.949 11.540) 15.486 5.679 ( 0.004 14.265 -13.476) 19.624 5.679 ( 0.004 14.265 13.476) 19.624 7.295 ( -7.075 3.258 -5.350) 9.450 7.295 ( -7.075 3.258 5.350) 9.450 7.845 ( 6.358 -6.183 -5.833) 10.615 7.845 ( 6.358 -6.183 5.833) 10.615 8.382 ( 5.698 -7.765 -8.211) 12.656 8.382 ( 5.698 -7.765 8.211) 12.656 9.247 ( -3.518 -1.003 -24.136) 24.412 9.247 ( -3.518 -1.003 24.136) 24.412 9.745 ( 1.237 -2.429 -25.003) 25.151 9.745 ( 1.237 -2.429 25.003) 25.151 10.264 ( -6.513 -2.998 -9.292) 11.737 10.264 ( -6.513 -2.998 9.292) 11.737 11.063 ( 3.622 9.029 -14.539) 17.493 11.063 ( 3.622 9.029 14.539) 17.493 11.493 ( -6.761 -8.834 -11.174) 15.767 11.493 ( -6.761 -8.834 11.174) 15.767 12.183 ( -1.852 -1.981 -9.969) 10.331 12.183 ( -1.852 -1.981 9.969) 10.331 12.945 ( -0.579 0.989 -8.018) 8.099 12.945 ( -0.579 0.989 8.018) 8.099 13.066 ( -2.661 -3.361 -6.207) 7.543 13.066 ( -2.661 -3.361 6.207) 7.543 13.695 ( -2.648 -4.612 -4.681) 7.085 13.695 ( -2.648 -4.612 4.681) 7.085 14.437 ( 10.995 7.294 -5.627) 14.344 14.437 ( 10.995 7.294 5.627) 14.344 14.618 ( 1.052 3.098 -1.388) 3.554 14.618 ( 1.052 3.098 1.388) 3.554 14.921 ( -2.030 3.298 -3.870) 5.475 14.921 ( -2.030 3.298 3.870) 5.475 15.229 ( 1.148 6.417 -8.689) 10.862 15.229 ( 1.148 6.417 8.689) 10.862 15.837 ( 2.270 5.137 -3.013) 6.373 15.837 ( 2.270 5.137 3.013) 6.373 16.280 ( 3.080 -0.030 -1.714) 3.525 16.280 ( 3.080 -0.030 1.714) 3.525 16.437 ( 3.090 -4.480 -3.201) 6.314 16.437 ( 3.090 -4.480 3.201) 6.314 16.868 ( -8.646 -3.645 -2.708) 9.766 16.868 ( -8.646 -3.645 2.708) 9.766 18.122 ( -8.694 3.556 -8.565) 12.711 18.122 ( -8.694 3.556 8.565) 12.711 19.280 ( 10.851 -0.313 -3.712) 11.473 19.280 ( 10.851 -0.313 3.712) 11.473 ======================= Grid point 380 (118/125) ======================= q-point: (-0.33 0.22 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 203 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.710 ( -0.123 1.784 -5.687) 5.962 1.710 ( -0.123 1.784 5.687) 5.962 2.398 ( -5.007 5.628 -8.356) 11.250 2.398 ( -5.007 5.628 8.356) 11.250 2.897 ( -1.072 -0.378 -5.603) 5.717 2.897 ( -1.072 -0.378 5.603) 5.717 5.400 ( 5.801 1.984 -3.623) 7.121 5.400 ( 5.801 1.984 3.623) 7.121 5.509 ( -2.599 2.629 -4.950) 6.178 5.509 ( -2.599 2.629 4.950) 6.178 7.177 ( -2.800 -0.686 -8.657) 9.125 7.177 ( -2.800 -0.686 8.657) 9.125 7.857 ( -1.133 6.480 -1.591) 6.768 7.857 ( -1.133 6.480 1.591) 6.768 8.755 ( 15.616 -14.935 -7.166) 22.765 8.755 ( 15.616 -14.935 7.166) 22.765 9.202 ( -9.354 -5.233 -24.891) 27.100 9.202 ( -9.354 -5.233 24.891) 27.100 9.848 ( 5.546 -5.244 -22.143) 23.421 9.848 ( 5.546 -5.244 22.143) 23.421 10.216 ( -6.529 -1.662 -8.894) 11.157 10.216 ( -6.529 -1.662 8.894) 11.157 10.886 ( -0.943 14.717 -13.151) 19.759 10.886 ( -0.943 14.717 13.151) 19.759 11.580 ( -2.974 -10.689 -11.833) 16.221 11.580 ( -2.974 -10.689 11.833) 16.221 12.244 ( 0.740 -5.832 -9.448) 11.128 12.244 ( 0.740 -5.832 9.448) 11.128 12.918 ( -0.665 1.038 -8.662) 8.749 12.918 ( -0.665 1.038 8.662) 8.749 13.120 ( -1.098 -6.173 -5.843) 8.570 13.120 ( -1.098 -6.173 5.843) 8.570 13.716 ( -1.479 -1.334 -6.005) 6.327 13.716 ( -1.479 -1.334 6.005) 6.327 14.465 ( 12.792 9.290 -6.856) 17.232 14.465 ( 12.792 9.290 6.856) 17.232 14.592 ( 0.683 1.716 -0.985) 2.093 14.592 ( 0.683 1.716 0.985) 2.093 14.781 ( -9.012 5.758 -3.219) 11.168 14.781 ( -9.012 5.758 3.219) 11.168 15.130 ( -1.043 4.627 -9.321) 10.458 15.130 ( -1.043 4.627 9.321) 10.458 15.799 ( 2.109 3.490 -3.282) 5.234 15.799 ( 2.109 3.490 3.282) 5.234 16.306 ( 2.351 2.161 -2.938) 4.339 16.306 ( 2.351 2.161 2.938) 4.339 16.531 ( 0.560 -4.246 -1.628) 4.582 16.531 ( 0.560 -4.246 1.628) 4.582 16.831 ( -3.982 -2.978 -3.428) 6.040 16.831 ( -3.982 -2.978 3.428) 6.040 17.941 ( -6.001 6.646 -10.090) 13.491 17.941 ( -6.001 6.646 10.090) 13.491 19.408 ( 6.235 -1.235 -1.776) 6.599 19.408 ( 6.235 -1.235 1.776) 6.599 ======================= Grid point 382 (119/125) ======================= q-point: (-0.22 0.22 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 115 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.702 ( -0.000 -0.625 -7.698) 7.723 1.702 ( -0.000 -0.625 7.698) 7.723 2.265 ( 0.000 6.456 -12.851) 14.382 2.265 ( 0.000 6.456 12.851) 14.382 2.889 ( 0.000 0.368 -6.028) 6.039 2.889 ( 0.000 0.368 6.028) 6.039 5.271 ( 0.000 12.412 -11.725) 17.074 5.271 ( 0.000 12.412 11.725) 17.074 5.565 ( -0.000 -5.979 -17.491) 18.485 5.565 ( -0.000 -5.979 17.491) 18.485 7.261 ( -0.000 -9.827 -9.409) 13.605 7.261 ( -0.000 -9.827 9.409) 13.605 7.686 ( 0.000 12.162 -6.343) 13.717 7.686 ( 0.000 12.162 6.343) 13.717 9.075 ( -0.000 -7.321 -10.656) 12.928 9.075 ( -0.000 -7.321 10.656) 12.928 9.218 ( -0.000 -8.139 -26.217) 27.451 9.218 ( -0.000 -8.139 26.217) 27.451 10.043 ( -0.000 -10.560 -10.884) 15.164 10.043 ( -0.000 -10.560 10.884) 15.164 10.147 ( 0.000 0.979 -7.853) 7.913 10.147 ( 0.000 0.979 7.853) 7.913 10.634 ( 0.000 15.152 -8.539) 17.392 10.634 ( 0.000 15.152 8.539) 17.392 11.737 ( -0.000 -11.767 -12.837) 17.414 11.737 ( -0.000 -11.767 12.837) 17.414 12.356 ( -0.000 -7.475 -9.366) 11.983 12.356 ( -0.000 -7.475 9.366) 11.983 12.900 ( 0.000 0.573 -7.600) 7.621 12.900 ( 0.000 0.573 7.600) 7.621 13.215 ( -0.000 -6.853 -6.343) 9.338 13.215 ( -0.000 -6.853 6.343) 9.338 13.686 ( 0.000 4.201 -7.150) 8.293 13.686 ( 0.000 4.201 7.150) 8.293 14.471 ( 0.000 9.617 -5.984) 11.327 14.471 ( 0.000 9.617 5.984) 11.327 14.547 ( 0.000 6.498 -6.771) 9.385 14.547 ( 0.000 6.498 6.771) 9.385 14.581 ( 0.000 0.391 -1.756) 1.799 14.581 ( 0.000 0.391 1.756) 1.799 15.086 ( 0.000 0.088 -6.310) 6.311 15.086 ( 0.000 0.088 6.310) 6.311 15.768 ( 0.000 3.377 -1.502) 3.696 15.768 ( 0.000 3.377 1.502) 3.696 16.269 ( 0.000 3.714 -3.010) 4.781 16.269 ( 0.000 3.714 3.010) 4.781 16.596 ( -0.000 -4.081 -0.670) 4.136 16.596 ( -0.000 -4.081 0.670) 4.136 16.849 ( -0.000 -2.052 -3.833) 4.347 16.849 ( -0.000 -2.052 3.833) 4.347 17.775 ( 0.000 8.817 -9.604) 13.038 17.775 ( 0.000 8.817 9.604) 13.038 19.477 ( -0.000 -2.146 -0.642) 2.240 19.477 ( -0.000 -2.146 0.642) 2.240 ======================= Grid point 392 (120/125) ======================= q-point: ( 0.33 0.33 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 115 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.814 ( 4.284 0.000 -4.537) 6.240 1.814 ( 4.284 0.000 4.537) 6.240 2.515 ( 6.803 0.000 -0.140) 6.805 2.515 ( 6.803 0.000 0.140) 6.805 2.851 ( 0.270 0.000 -0.559) 0.620 2.851 ( 0.270 0.000 0.559) 0.620 4.977 ( -1.408 -0.000 -5.962) 6.126 4.977 ( -1.408 -0.000 5.962) 6.126 6.338 ( -0.623 -0.000 -4.792) 4.833 6.338 ( -0.623 -0.000 4.792) 4.833 7.003 ( 15.679 0.000 -0.993) 15.711 7.003 ( 15.679 0.000 0.993) 15.711 7.425 ( -9.973 -0.000 -6.428) 11.865 7.425 ( -9.973 -0.000 6.428) 11.865 8.528 ( -7.971 -0.000 -18.581) 20.218 8.528 ( -7.971 -0.000 18.581) 20.218 9.409 ( 2.096 0.000 -15.209) 15.353 9.409 ( 2.096 0.000 15.209) 15.353 9.610 ( -4.131 -0.000 -31.832) 32.099 9.610 ( -4.131 -0.000 31.832) 32.099 10.277 ( -10.512 -0.000 -1.668) 10.644 10.277 ( -10.512 -0.000 1.668) 10.644 11.056 ( 15.507 0.000 -16.087) 22.344 11.056 ( 15.507 0.000 16.087) 22.344 11.393 ( -12.084 -0.000 -9.726) 15.512 11.393 ( -12.084 -0.000 9.726) 15.512 12.286 ( -8.485 -0.000 -10.777) 13.716 12.286 ( -8.485 -0.000 10.777) 13.716 12.941 ( -0.900 -0.000 -3.978) 4.079 12.941 ( -0.900 -0.000 3.978) 4.079 13.188 ( -5.147 -0.000 -6.768) 8.502 13.188 ( -5.147 -0.000 6.768) 8.502 13.498 ( -1.922 -0.000 -4.067) 4.498 13.498 ( -1.922 -0.000 4.067) 4.498 14.492 ( 8.106 0.000 -1.412) 8.228 14.492 ( 8.106 0.000 1.412) 8.228 14.668 ( -2.344 -0.000 -0.536) 2.404 14.668 ( -2.344 -0.000 0.536) 2.404 14.994 ( 9.462 0.000 -13.280) 16.306 14.994 ( 9.462 0.000 13.280) 16.306 15.321 ( 12.544 0.000 -7.932) 14.841 15.321 ( 12.544 0.000 7.932) 14.841 16.019 ( 11.674 0.000 -5.302) 12.822 16.019 ( 11.674 0.000 5.302) 12.822 16.205 ( -3.635 -0.000 -9.062) 9.764 16.205 ( -3.635 -0.000 9.062) 9.764 16.269 ( -3.579 -0.000 -2.198) 4.200 16.269 ( -3.579 -0.000 2.198) 4.200 16.852 ( -9.118 -0.000 -1.620) 9.261 16.852 ( -9.118 -0.000 1.620) 9.261 18.271 ( -5.804 -0.000 -1.804) 6.078 18.271 ( -5.804 -0.000 1.804) 6.078 19.145 ( 10.276 0.000 -9.697) 14.129 19.145 ( 10.276 0.000 9.697) 14.129 ======================= Grid point 394 (121/125) ======================= q-point: ( 0.44 0.33 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 203 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.848 ( 3.034 2.376 -4.712) 6.087 1.848 ( 3.034 2.376 4.712) 6.087 2.574 ( 1.173 0.259 -2.092) 2.412 2.574 ( 1.173 0.259 2.092) 2.412 2.865 ( 0.507 -0.858 -1.770) 2.031 2.865 ( 0.507 -0.858 1.770) 2.031 5.010 ( 2.407 -3.913 -5.295) 7.010 5.010 ( 2.407 -3.913 5.295) 7.010 6.166 ( -3.647 13.434 -12.454) 18.678 6.166 ( -3.647 13.434 12.454) 18.678 7.307 ( 7.950 -2.939 -3.302) 9.097 7.307 ( 7.950 -2.939 3.302) 9.097 7.404 ( 2.291 -12.609 -5.078) 13.785 7.404 ( 2.291 -12.609 5.078) 13.785 8.380 ( -8.192 2.041 -7.034) 10.989 8.380 ( -8.192 2.041 7.034) 10.989 9.337 ( -2.579 5.692 -22.586) 23.434 9.337 ( -2.579 5.692 22.586) 23.434 9.653 ( 1.111 -4.050 -22.802) 23.186 9.653 ( 1.111 -4.050 22.802) 23.186 10.164 ( -8.058 -2.298 -4.373) 9.451 10.164 ( -8.058 -2.298 4.373) 9.451 11.236 ( 11.952 2.140 -16.487) 20.476 11.236 ( 11.952 2.140 16.487) 20.476 11.281 ( -8.446 -3.731 -9.159) 13.005 11.281 ( -8.446 -3.731 9.159) 13.005 12.169 ( -7.602 0.298 -10.818) 13.225 12.169 ( -7.602 0.298 10.818) 13.225 12.934 ( -0.961 -0.948 -3.595) 3.840 12.934 ( -0.961 -0.948 3.595) 3.840 13.098 ( -3.040 3.651 -7.739) 9.081 13.098 ( -3.040 3.651 7.739) 9.081 13.520 ( -1.987 -5.176 -3.724) 6.679 13.520 ( -1.987 -5.176 3.724) 6.679 14.551 ( 3.839 1.847 -0.882) 4.351 14.551 ( 3.839 1.847 0.882) 4.351 14.653 ( -0.636 -0.798 -0.686) 1.230 14.653 ( -0.636 -0.798 0.686) 1.230 15.094 ( 9.441 4.713 -13.362) 17.026 15.094 ( 9.441 4.713 13.362) 17.026 15.434 ( 8.643 5.034 -10.885) 14.782 15.434 ( 8.643 5.034 10.885) 14.782 16.008 ( -2.584 5.714 -3.678) 7.270 16.008 ( -2.584 5.714 3.678) 7.270 16.237 ( 1.371 -3.301 -1.807) 4.005 16.237 ( 1.371 -3.301 1.807) 4.005 16.304 ( 5.333 -2.970 -7.779) 9.889 16.304 ( 5.333 -2.970 7.779) 9.889 16.749 ( -9.273 -2.892 -2.780) 10.103 16.749 ( -9.273 -2.892 2.780) 10.103 18.175 ( -7.363 0.422 -6.451) 9.798 18.175 ( -7.363 0.422 6.451) 9.798 19.283 ( 9.943 0.267 -6.082) 11.658 19.283 ( 9.943 0.267 6.082) 11.658 ======================= Grid point 396 (122/125) ======================= q-point: (-0.44 0.33 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 203 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.819 ( 0.933 4.476 -4.334) 6.300 1.819 ( 0.933 4.476 4.334) 6.300 2.533 ( -2.714 2.928 -3.737) 5.469 2.533 ( -2.714 2.928 3.737) 5.469 2.883 ( 0.402 -0.423 -2.743) 2.804 2.883 ( 0.402 -0.423 2.743) 2.804 5.150 ( 3.332 -7.963 -6.349) 10.716 5.150 ( 3.332 -7.963 6.349) 10.716 5.923 ( 0.129 14.166 -16.270) 21.573 5.923 ( 0.129 14.166 16.270) 21.573 7.244 ( -6.081 3.302 -6.646) 9.595 7.244 ( -6.081 3.302 6.646) 9.595 7.744 ( 4.818 -12.385 -5.889) 14.536 7.744 ( 4.818 -12.385 5.889) 14.536 8.387 ( 5.947 -8.036 -1.763) 10.152 8.387 ( 5.947 -8.036 1.763) 10.152 9.187 ( -7.064 5.323 -28.487) 29.828 9.187 ( -7.064 5.323 28.487) 29.828 9.723 ( 1.825 -2.872 -28.858) 29.058 9.723 ( 1.825 -2.872 28.858) 29.058 10.136 ( -4.181 -3.902 -10.703) 12.135 10.136 ( -4.181 -3.902 10.703) 12.135 11.235 ( -0.149 2.956 -14.056) 14.364 11.235 ( -0.149 2.956 14.056) 14.364 11.319 ( 0.977 -1.612 -11.243) 11.400 11.319 ( 0.977 -1.612 11.243) 11.400 12.110 ( -3.253 -2.774 -10.077) 10.946 12.110 ( -3.253 -2.774 10.077) 10.946 12.952 ( 0.301 -1.856 -4.813) 5.168 12.952 ( 0.301 -1.856 4.813) 5.168 13.012 ( -2.220 2.570 -7.869) 8.570 13.012 ( -2.220 2.570 7.869) 8.570 13.586 ( -1.265 -5.831 -3.996) 7.181 13.586 ( -1.265 -5.831 3.996) 7.181 14.561 ( 1.421 0.845 -1.902) 2.520 14.561 ( 1.421 0.845 1.902) 2.520 14.665 ( 1.144 -0.036 -1.584) 1.954 14.665 ( 1.144 -0.036 1.584) 1.954 15.069 ( 4.642 11.112 -10.796) 16.173 15.069 ( 4.642 11.112 10.796) 16.173 15.385 ( 2.199 9.754 -12.338) 15.881 15.385 ( 2.199 9.754 12.338) 15.881 15.898 ( -1.968 3.348 -5.555) 6.778 15.898 ( -1.968 3.348 5.555) 6.778 16.322 ( 3.988 -2.992 -1.544) 5.220 16.322 ( 3.988 -2.992 1.544) 5.220 16.406 ( 1.620 -2.358 -6.069) 6.710 16.406 ( 1.620 -2.358 6.069) 6.710 16.705 ( -5.431 -4.504 -3.139) 7.723 16.705 ( -5.431 -4.504 3.139) 7.723 18.073 ( -4.880 1.994 -9.684) 11.026 18.073 ( -4.880 1.994 9.684) 11.026 19.389 ( 5.798 -0.137 -3.950) 7.017 19.389 ( 5.798 -0.137 3.950) 7.017 ======================= Grid point 398 (123/125) ======================= q-point: (-0.33 0.33 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 115 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.755 ( 0.000 3.930 -4.528) 5.996 1.755 ( 0.000 3.930 4.528) 5.996 2.446 ( 0.000 4.913 -6.213) 7.921 2.446 ( 0.000 4.913 6.213) 7.921 2.888 ( -0.000 -0.142 -4.049) 4.052 2.888 ( -0.000 -0.142 4.049) 4.052 5.310 ( -0.000 -9.333 -8.786) 12.818 5.310 ( -0.000 -9.333 8.786) 12.818 5.709 ( 0.000 14.740 -15.788) 21.599 5.709 ( 0.000 14.740 15.788) 21.599 7.147 ( 0.000 1.765 -10.011) 10.166 7.147 ( 0.000 1.765 10.011) 10.166 7.882 ( -0.000 -3.087 -5.658) 6.445 7.882 ( -0.000 -3.087 5.658) 6.445 8.681 ( -0.000 -15.844 -2.128) 15.987 8.681 ( -0.000 -15.844 2.128) 15.987 9.044 ( 0.000 1.684 -31.465) 31.510 9.044 ( 0.000 1.684 31.465) 31.510 9.797 ( -0.000 -4.897 -28.232) 28.654 9.797 ( -0.000 -4.897 28.232) 28.654 10.154 ( -0.000 -1.894 -11.675) 11.827 10.154 ( -0.000 -1.894 11.675) 11.827 11.106 ( 0.000 12.966 -16.118) 20.686 11.106 ( 0.000 12.966 16.118) 20.686 11.403 ( -0.000 -8.938 -10.383) 13.700 11.403 ( -0.000 -8.938 10.383) 13.700 12.159 ( -0.000 -5.268 -9.666) 11.008 12.159 ( -0.000 -5.268 9.666) 11.008 12.944 ( 0.000 2.628 -9.298) 9.662 12.944 ( 0.000 2.628 9.298) 9.662 13.021 ( -0.000 -5.145 -4.721) 6.983 13.021 ( -0.000 -5.145 4.721) 6.983 13.659 ( -0.000 -4.450 -5.088) 6.759 13.659 ( -0.000 -4.450 5.088) 6.759 14.567 ( -0.000 -0.123 -2.584) 2.587 14.567 ( -0.000 -0.124 2.584) 2.587 14.675 ( 0.000 0.816 -2.239) 2.383 14.675 ( 0.000 0.816 2.239) 2.383 14.884 ( 0.000 14.906 -9.402) 17.623 14.884 ( 0.000 14.906 9.402) 17.623 15.238 ( 0.000 9.482 -12.342) 15.564 15.238 ( 0.000 9.482 12.342) 15.564 15.849 ( 0.000 2.144 -5.846) 6.227 15.849 ( 0.000 2.144 5.846) 6.227 16.373 ( 0.000 2.655 -4.226) 4.991 16.373 ( 0.000 2.655 4.226) 4.991 16.453 ( -0.000 -5.387 -1.537) 5.602 16.453 ( -0.000 -5.387 1.537) 5.602 16.745 ( -0.000 -4.596 -3.585) 5.829 16.745 ( -0.000 -4.596 3.585) 5.829 17.989 ( 0.000 4.495 -11.076) 11.953 17.989 ( 0.000 4.495 11.076) 11.953 19.435 ( -0.000 -0.690 -2.979) 3.058 19.435 ( -0.000 -0.690 2.979) 3.058 ======================= Grid point 412 (124/125) ======================= q-point: ( 0.44 0.44 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 115 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.907 ( 2.066 0.000 -4.864) 5.285 1.907 ( 2.066 0.000 4.864) 5.285 2.578 ( -0.948 -0.000 -3.031) 3.176 2.578 ( -0.948 -0.000 3.031) 3.176 2.875 ( 1.295 0.000 -2.033) 2.410 2.875 ( 1.295 0.000 2.033) 2.410 5.019 ( 3.216 0.000 -0.048) 3.217 5.019 ( 3.216 0.000 0.048) 3.217 6.193 ( -6.190 -0.000 -19.142) 20.118 6.193 ( -6.190 -0.000 19.142) 20.118 7.301 ( -0.154 -0.000 -1.927) 1.933 7.301 ( -0.154 -0.000 1.927) 1.933 7.469 ( 13.397 0.000 -2.818) 13.690 7.469 ( 13.397 0.000 2.818) 13.690 8.255 ( -9.259 -0.000 -10.508) 14.005 8.255 ( -9.259 -0.000 10.508) 14.005 9.335 ( -4.270 -0.000 -27.602) 27.930 9.335 ( -4.270 -0.000 27.602) 27.930 9.664 ( 3.950 0.000 -28.705) 28.975 9.664 ( 3.950 0.000 28.705) 28.975 10.050 ( -5.302 -0.000 -0.029) 5.302 10.050 ( -5.302 -0.000 0.029) 5.302 11.164 ( -4.484 -0.000 -8.284) 9.420 11.164 ( -4.484 -0.000 8.284) 9.420 11.402 ( 8.813 0.000 -17.569) 19.656 11.402 ( 8.813 0.000 17.569) 19.656 12.069 ( -6.395 -0.000 -10.411) 12.218 12.069 ( -6.395 -0.000 10.411) 12.218 12.912 ( -0.857 -0.000 -1.790) 1.985 12.912 ( -0.857 -0.000 1.790) 1.985 13.103 ( -1.429 -0.000 -8.883) 8.997 13.103 ( -1.429 -0.000 8.883) 8.997 13.455 ( -0.972 -0.000 -4.375) 4.481 13.455 ( -0.972 -0.000 4.375) 4.481 14.579 ( -0.307 -0.000 -0.094) 0.321 14.579 ( -0.307 -0.000 0.094) 0.321 14.651 ( 1.065 0.000 -2.599) 2.809 14.651 ( 1.065 0.000 2.599) 2.809 15.268 ( 8.683 0.000 -14.564) 16.956 15.268 ( 8.683 0.000 14.564) 16.956 15.576 ( 4.646 0.000 -16.635) 17.272 15.576 ( 4.646 0.000 16.635) 17.272 15.994 ( -4.863 -0.000 -3.737) 6.133 15.994 ( -4.863 -0.000 3.737) 6.133 16.196 ( -0.265 -0.000 -2.361) 2.376 16.196 ( -0.265 -0.000 2.361) 2.376 16.378 ( 5.991 0.000 -10.230) 11.855 16.378 ( 5.991 0.000 10.230) 11.855 16.622 ( -5.772 -0.000 -3.294) 6.646 16.622 ( -5.772 -0.000 3.294) 6.646 18.096 ( -4.620 -0.000 -7.944) 9.190 18.096 ( -4.620 -0.000 7.944) 9.190 19.390 ( 5.500 0.000 -4.934) 7.389 19.390 ( 5.500 0.000 4.934) 7.389 ======================= Grid point 414 (125/125) ======================= q-point: (-0.44 -0.56 -0.50) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 1.46e-03 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 1.94e-05 1.94e-05 Number of triplets: 115 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.893 ( 0.000 3.435 -4.614) 5.752 1.893 ( 0.000 3.435 4.614) 5.752 2.554 ( 0.000 1.858 -3.314) 3.799 2.554 ( 0.000 1.858 3.314) 3.799 2.885 ( -0.000 -0.078 -2.112) 2.113 2.885 ( -0.000 -0.078 2.112) 2.113 5.079 ( -0.000 -4.366 -2.744) 5.157 5.079 ( -0.000 -4.366 2.744) 5.157 6.085 ( 0.000 7.666 -21.027) 22.381 6.085 ( 0.000 7.666 21.027) 22.381 7.269 ( 0.000 3.941 -5.537) 6.796 7.269 ( 0.000 3.941 5.537) 6.796 7.630 ( -0.000 -7.575 -3.272) 8.252 7.630 ( -0.000 -7.575 3.272) 8.252 8.258 ( -0.000 -8.936 -8.893) 12.607 8.258 ( -0.000 -8.936 8.893) 12.607 9.247 ( 0.000 6.616 -27.718) 28.496 9.247 ( 0.000 6.616 27.718) 28.496 9.705 ( -0.000 -1.427 -31.360) 31.393 9.705 ( -0.000 -1.427 31.360) 31.393 10.045 ( -0.000 -3.609 -8.204) 8.962 10.045 ( -0.000 -3.609 8.204) 8.962 11.162 ( -0.000 -3.538 -8.446) 9.157 11.162 ( -0.000 -3.538 8.446) 9.157 11.428 ( 0.000 4.771 -17.654) 18.287 11.428 ( 0.000 4.771 17.654) 18.287 12.039 ( -0.000 -2.170 -9.875) 10.111 12.039 ( -0.000 -2.170 9.875) 10.111 12.917 ( -0.000 -1.551 -2.445) 2.895 12.917 ( -0.000 -1.551 2.445) 2.895 13.059 ( 0.000 3.832 -8.777) 9.577 13.059 ( 0.000 3.832 8.777) 9.577 13.491 ( -0.000 -4.830 -3.930) 6.227 13.491 ( -0.000 -4.830 3.930) 6.227 14.573 ( 0.000 0.304 -0.783) 0.840 14.573 ( 0.000 0.304 0.783) 0.840 14.664 ( -0.000 -0.606 -2.893) 2.955 14.664 ( -0.000 -0.606 2.893) 2.955 15.269 ( 0.000 7.894 -12.922) 15.142 15.269 ( 0.000 7.894 12.922) 15.142 15.543 ( 0.000 7.331 -17.370) 18.854 15.543 ( 0.000 7.331 17.370) 18.854 15.926 ( 0.000 3.086 -3.696) 4.815 15.926 ( 0.000 3.086 3.696) 4.815 16.256 ( -0.000 -6.480 -2.374) 6.901 16.256 ( -0.000 -6.480 2.374) 6.901 16.418 ( 0.000 0.249 -7.949) 7.953 16.418 ( 0.000 0.249 7.949) 7.953 16.606 ( -0.000 -3.043 -2.849) 4.168 16.606 ( -0.000 -3.043 2.849) 4.168 18.059 ( 0.000 0.640 -9.118) 9.141 18.059 ( 0.000 0.640 9.118) 9.141 19.427 ( -0.000 -0.016 -4.176) 4.176 19.427 ( -0.000 -0.016 4.176) 4.176 =================== 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 3/34992 10.0 2166.489 2180.393 2759.635 0.000 0.000 0.000 3/34992 20.0 515.182 450.039 584.708 0.000 0.000 0.000 3/34992 30.0 325.076 267.654 369.744 0.000 0.000 0.000 3/34992 40.0 238.437 188.211 273.031 0.000 0.000 0.000 3/34992 50.0 173.904 132.151 201.577 0.000 0.000 0.000 3/34992 60.0 125.484 92.960 148.116 0.000 0.000 0.000 3/34992 70.0 91.110 66.693 109.659 0.000 0.000 0.000 3/34992 80.0 67.510 49.289 82.671 0.000 0.000 0.000 3/34992 90.0 51.400 37.630 63.827 0.000 0.000 0.000 3/34992 100.0 40.268 29.638 50.549 0.000 0.000 0.000 3/34992 110.0 32.414 24.010 41.030 0.000 0.000 0.000 3/34992 120.0 26.738 19.935 34.063 0.000 0.000 0.000 3/34992 130.0 22.533 16.904 28.851 0.000 0.000 0.000 3/34992 140.0 19.346 14.594 24.868 0.000 0.000 0.000 3/34992 150.0 16.877 12.795 21.763 0.000 0.000 0.000 3/34992 160.0 14.926 11.365 19.296 0.000 0.000 0.000 3/34992 170.0 13.358 10.209 17.303 0.000 0.000 0.000 3/34992 180.0 12.076 9.259 15.668 0.000 0.000 0.000 3/34992 190.0 11.014 8.467 14.308 0.000 0.000 0.000 3/34992 200.0 10.122 7.799 13.162 0.000 0.000 0.000 3/34992 210.0 9.364 7.229 12.185 0.000 0.000 0.000 3/34992 220.0 8.712 6.737 11.345 0.000 0.000 0.000 3/34992 230.0 8.148 6.309 10.614 0.000 0.000 0.000 3/34992 240.0 7.654 5.933 9.974 0.000 0.000 0.000 3/34992 250.0 7.219 5.601 9.409 0.000 0.000 0.000 3/34992 260.0 6.833 5.306 8.907 0.000 0.000 0.000 3/34992 270.0 6.487 5.041 8.457 0.000 0.000 0.000 3/34992 280.0 6.177 4.802 8.053 0.000 0.000 0.000 3/34992 290.0 5.897 4.586 7.687 0.000 0.000 0.000 3/34992 300.0 5.642 4.390 7.355 0.000 0.000 0.000 3/34992 310.0 5.409 4.210 7.051 0.000 0.000 0.000 3/34992 320.0 5.197 4.046 6.773 0.000 0.000 0.000 3/34992 330.0 5.001 3.894 6.517 0.000 0.000 0.000 3/34992 340.0 4.820 3.754 6.280 0.000 0.000 0.000 3/34992 350.0 4.653 3.624 6.061 0.000 0.000 0.000 3/34992 360.0 4.497 3.503 5.858 0.000 0.000 0.000 3/34992 370.0 4.352 3.390 5.668 0.000 0.000 0.000 3/34992 380.0 4.217 3.285 5.491 0.000 0.000 0.000 3/34992 390.0 4.090 3.187 5.325 0.000 0.000 0.000 3/34992 400.0 3.971 3.094 5.170 0.000 0.000 0.000 3/34992 410.0 3.860 3.007 5.023 0.000 0.000 0.000 3/34992 420.0 3.754 2.925 4.886 0.000 0.000 0.000 3/34992 430.0 3.655 2.847 4.756 0.000 0.000 0.000 3/34992 440.0 3.561 2.774 4.632 0.000 0.000 0.000 3/34992 450.0 3.472 2.704 4.516 0.000 0.000 0.000 3/34992 460.0 3.387 2.639 4.405 0.000 0.000 0.000 3/34992 470.0 3.307 2.576 4.300 0.000 0.000 0.000 3/34992 480.0 3.231 2.516 4.200 0.000 0.000 0.000 3/34992 490.0 3.158 2.459 4.105 0.000 0.000 0.000 3/34992 500.0 3.088 2.405 4.014 0.000 0.000 0.000 3/34992 510.0 3.022 2.353 3.927 0.000 0.000 0.000 3/34992 520.0 2.959 2.304 3.845 0.000 0.000 0.000 3/34992 530.0 2.898 2.257 3.765 0.000 0.000 0.000 3/34992 540.0 2.840 2.211 3.689 0.000 0.000 0.000 3/34992 550.0 2.784 2.168 3.616 0.000 0.000 0.000 3/34992 560.0 2.730 2.126 3.546 0.000 0.000 0.000 3/34992 570.0 2.679 2.086 3.479 0.000 0.000 0.000 3/34992 580.0 2.629 2.047 3.414 0.000 0.000 0.000 3/34992 590.0 2.582 2.010 3.352 0.000 0.000 0.000 3/34992 600.0 2.536 1.974 3.292 0.000 0.000 0.000 3/34992 610.0 2.492 1.939 3.235 0.000 0.000 0.000 3/34992 620.0 2.449 1.906 3.179 0.000 0.000 0.000 3/34992 630.0 2.408 1.874 3.125 0.000 0.000 0.000 3/34992 640.0 2.368 1.843 3.073 0.000 0.000 0.000 3/34992 650.0 2.329 1.813 3.023 0.000 0.000 0.000 3/34992 660.0 2.292 1.784 2.975 0.000 0.000 0.000 3/34992 670.0 2.256 1.756 2.928 0.000 0.000 0.000 3/34992 680.0 2.221 1.728 2.882 0.000 0.000 0.000 3/34992 690.0 2.188 1.702 2.838 0.000 0.000 0.000 3/34992 700.0 2.155 1.677 2.796 0.000 0.000 0.000 3/34992 710.0 2.123 1.652 2.754 0.000 0.000 0.000 3/34992 720.0 2.092 1.628 2.714 0.000 0.000 0.000 3/34992 730.0 2.063 1.605 2.675 0.000 0.000 0.000 3/34992 740.0 2.034 1.582 2.637 0.000 0.000 0.000 3/34992 750.0 2.005 1.560 2.601 0.000 0.000 0.000 3/34992 760.0 1.978 1.538 2.565 0.000 0.000 0.000 3/34992 770.0 1.951 1.518 2.530 0.000 0.000 0.000 3/34992 780.0 1.925 1.497 2.496 0.000 0.000 0.000 3/34992 790.0 1.900 1.478 2.464 0.000 0.000 0.000 3/34992 800.0 1.876 1.459 2.432 0.000 0.000 0.000 3/34992 810.0 1.852 1.440 2.400 0.000 0.000 0.000 3/34992 820.0 1.828 1.422 2.370 0.000 0.000 0.000 3/34992 830.0 1.806 1.404 2.340 0.000 0.000 0.000 3/34992 840.0 1.783 1.387 2.312 0.000 0.000 0.000 3/34992 850.0 1.762 1.370 2.284 0.000 0.000 0.000 3/34992 860.0 1.741 1.353 2.256 0.000 0.000 0.000 3/34992 870.0 1.720 1.337 2.229 0.000 0.000 0.000 3/34992 880.0 1.700 1.322 2.203 0.000 0.000 0.000 3/34992 890.0 1.680 1.306 2.178 0.000 0.000 0.000 3/34992 900.0 1.661 1.292 2.153 0.000 0.000 0.000 3/34992 910.0 1.642 1.277 2.128 0.000 0.000 0.000 3/34992 920.0 1.624 1.263 2.105 0.000 0.000 0.000 3/34992 930.0 1.606 1.249 2.081 0.000 0.000 0.000 3/34992 940.0 1.589 1.235 2.059 0.000 0.000 0.000 3/34992 950.0 1.572 1.222 2.036 0.000 0.000 0.000 3/34992 960.0 1.555 1.209 2.015 0.000 0.000 0.000 3/34992 970.0 1.539 1.196 1.993 0.000 0.000 0.000 3/34992 980.0 1.523 1.183 1.972 0.000 0.000 0.000 3/34992 990.0 1.507 1.171 1.952 0.000 0.000 0.000 3/34992 1000.0 1.491 1.159 1.932 0.000 0.000 0.000 3/34992 Thermal conductivity related properties were written into "kappa-m998.hdf5". Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-08 05:07:24]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|