----------------------------- ------- calculate fc2 ------- ----------------------------- _ _ __ | |__ ___ _ __ ___ _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ | '_ \| | | | | |_) | | | | (_) | | | | (_) || |_) | |_| | | .__/|_| |_|\___/|_| |_|\___(_) .__/ \__, | |_| |_| |___/ 2.47.1 -------------------------[time 2026-01-08 10:35:34]------------------------- 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: [2 1 3] Primitive matrix: [0.5 0.5 0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/c (15) Number of symmetry operations in supercell: 48 ------------------------------ primitive cell ------------------------------ Lattice vectors: a 3.632048760004638 -5.717960545000000 0.000000000000000 b 3.632048760004638 5.717960545000000 0.000000000000000 c -3.346978018270880 0.000000000000000 3.953187320625488 Atomic positions (fractional): *1 La 0.63049252787470 0.36950747212530 0.25000000000000 138.905 2 La 0.36950747212530 0.63049252787470 0.75000000000000 138.905 *3 Nb 0.10035356332652 0.89964643667348 0.25000000000000 92.906 4 Nb 0.89964643667348 0.10035356332652 0.75000000000000 92.906 *5 O 0.79454036095987 0.73239318542376 0.80351494485770 15.999 6 O 0.26760681457624 0.20545963904013 0.69648505514230 15.999 7 O 0.20545963904013 0.26760681457624 0.19648505514230 15.999 8 O 0.73239318542376 0.79454036095987 0.30351494485769 15.999 *9 O 0.05544719218307 0.64369872765078 0.33933279269383 15.999 10 O 0.35630127234922 0.94455280781693 0.16066720730617 15.999 11 O 0.94455280781693 0.35630127234922 0.66066720730617 15.999 12 O 0.64369872765078 0.05544719218307 0.83933279269383 15.999 -------------------------------- unit cell --------------------------------- Lattice vectors: a 7.264097520009276 0.000000000000000 0.000000000000000 b 0.000000000000000 11.435921089999999 0.000000000000000 c -3.346978018270880 0.000000000000000 3.953187320625488 Atomic positions (fractional): *1 La 0.50000000000000 0.86950747212530 0.25000000000000 138.905 > 1 2 La 0.00000000000000 0.63049252787470 0.75000000000000 138.905 > 2 3 La 0.00000000000000 0.36950747212530 0.25000000000000 138.905 > 1 4 La 0.50000000000000 0.13049252787470 0.75000000000000 138.905 > 2 *5 Nb 0.00000000000000 0.89964643667348 0.25000000000000 92.906 > 3 6 Nb 0.50000000000000 0.60035356332652 0.75000000000000 92.906 > 4 7 Nb 0.50000000000000 0.39964643667348 0.25000000000000 92.906 > 3 8 Nb 0.00000000000000 0.10035356332652 0.75000000000000 92.906 > 4 *9 O 0.76346677319182 0.96892641223195 0.80351494485770 15.999 > 5 10 O 0.23653322680818 0.96892641223195 0.69648505514230 15.999 > 6 11 O 0.73653322680818 0.53107358776805 0.19648505514230 15.999 > 7 12 O 0.26346677319182 0.53107358776805 0.30351494485769 15.999 > 8 *13 O 0.84957295991693 0.79412576773386 0.33933279269383 15.999 > 9 14 O 0.15042704008307 0.79412576773386 0.16066720730617 15.999 > 10 15 O 0.65042704008307 0.70587423226614 0.66066720730617 15.999 > 11 16 O 0.34957295991693 0.70587423226614 0.83933279269383 15.999 > 12 17 O 0.26346677319182 0.46892641223195 0.80351494485770 15.999 > 5 18 O 0.73653322680818 0.46892641223195 0.69648505514230 15.999 > 6 19 O 0.23653322680818 0.03107358776805 0.19648505514230 15.999 > 7 20 O 0.76346677319182 0.03107358776805 0.30351494485769 15.999 > 8 21 O 0.34957295991693 0.29412576773386 0.33933279269383 15.999 > 9 22 O 0.65042704008307 0.29412576773386 0.16066720730617 15.999 > 10 23 O 0.15042704008307 0.20587423226614 0.66066720730617 15.999 > 11 24 O 0.84957295991693 0.20587423226614 0.83933279269383 15.999 > 12 -------------------------------- super cell -------------------------------- Lattice vectors: a 14.528195040018552 0.000000000000000 0.000000000000000 b 0.000000000000000 11.435921089999999 0.000000000000000 c -10.040934054812640 0.000000000000000 11.859561961876464 Atomic positions (fractional): *1 La 0.25000000000000 0.86950747212530 0.08333333333333 138.905 > 1 2 La 0.75000000000000 0.86950747212530 0.08333333333333 138.905 > 1 3 La 0.25000000000000 0.86950747212530 0.41666666666667 138.905 > 1 4 La 0.75000000000000 0.86950747212530 0.41666666666667 138.905 > 1 5 La 0.25000000000000 0.86950747212530 0.75000000000000 138.905 > 1 6 La 0.75000000000000 0.86950747212530 0.75000000000000 138.905 > 1 7 La 0.00000000000000 0.63049252787470 0.25000000000000 138.905 > 2 8 La 0.50000000000000 0.63049252787470 0.25000000000000 138.905 > 2 9 La 0.00000000000000 0.63049252787470 0.58333333333333 138.905 > 2 10 La 0.50000000000000 0.63049252787470 0.58333333333333 138.905 > 2 11 La 0.00000000000000 0.63049252787470 0.91666666666667 138.905 > 2 12 La 0.50000000000000 0.63049252787470 0.91666666666667 138.905 > 2 13 La 0.00000000000000 0.36950747212530 0.08333333333333 138.905 > 1 14 La 0.50000000000000 0.36950747212530 0.08333333333333 138.905 > 1 15 La 0.00000000000000 0.36950747212530 0.41666666666667 138.905 > 1 16 La 0.50000000000000 0.36950747212530 0.41666666666667 138.905 > 1 17 La 0.00000000000000 0.36950747212530 0.75000000000000 138.905 > 1 18 La 0.50000000000000 0.36950747212530 0.75000000000000 138.905 > 1 19 La 0.25000000000000 0.13049252787470 0.25000000000000 138.905 > 2 20 La 0.75000000000000 0.13049252787470 0.25000000000000 138.905 > 2 21 La 0.25000000000000 0.13049252787470 0.58333333333333 138.905 > 2 22 La 0.75000000000000 0.13049252787470 0.58333333333333 138.905 > 2 23 La 0.25000000000000 0.13049252787470 0.91666666666667 138.905 > 2 24 La 0.75000000000000 0.13049252787470 0.91666666666667 138.905 > 2 *25 Nb 0.00000000000000 0.89964643667348 0.08333333333333 92.906 > 3 26 Nb 0.50000000000000 0.89964643667348 0.08333333333333 92.906 > 3 27 Nb 0.00000000000000 0.89964643667348 0.41666666666667 92.906 > 3 28 Nb 0.50000000000000 0.89964643667348 0.41666666666667 92.906 > 3 29 Nb 0.00000000000000 0.89964643667348 0.75000000000000 92.906 > 3 30 Nb 0.50000000000000 0.89964643667348 0.75000000000000 92.906 > 3 31 Nb 0.25000000000000 0.60035356332652 0.25000000000000 92.906 > 4 32 Nb 0.75000000000000 0.60035356332652 0.25000000000000 92.906 > 4 33 Nb 0.25000000000000 0.60035356332652 0.58333333333333 92.906 > 4 34 Nb 0.75000000000000 0.60035356332652 0.58333333333333 92.906 > 4 35 Nb 0.25000000000000 0.60035356332652 0.91666666666667 92.906 > 4 36 Nb 0.75000000000000 0.60035356332652 0.91666666666667 92.906 > 4 37 Nb 0.25000000000000 0.39964643667348 0.08333333333333 92.906 > 3 38 Nb 0.75000000000000 0.39964643667348 0.08333333333333 92.906 > 3 39 Nb 0.25000000000000 0.39964643667348 0.41666666666667 92.906 > 3 40 Nb 0.75000000000000 0.39964643667348 0.41666666666667 92.906 > 3 41 Nb 0.25000000000000 0.39964643667348 0.75000000000000 92.906 > 3 42 Nb 0.75000000000000 0.39964643667348 0.75000000000000 92.906 > 3 43 Nb 0.00000000000000 0.10035356332652 0.25000000000000 92.906 > 4 44 Nb 0.50000000000000 0.10035356332652 0.25000000000000 92.906 > 4 45 Nb 0.00000000000000 0.10035356332652 0.58333333333333 92.906 > 4 46 Nb 0.50000000000000 0.10035356332652 0.58333333333333 92.906 > 4 47 Nb 0.00000000000000 0.10035356332652 0.91666666666667 92.906 > 4 48 Nb 0.50000000000000 0.10035356332652 0.91666666666667 92.906 > 4 *49 O 0.38173338659591 0.96892641223195 0.26783831495256 15.999 > 5 50 O 0.88173338659591 0.96892641223195 0.26783831495256 15.999 > 5 51 O 0.38173338659591 0.96892641223195 0.60117164828590 15.999 > 5 52 O 0.88173338659591 0.96892641223195 0.60117164828590 15.999 > 5 53 O 0.38173338659591 0.96892641223195 0.93450498161923 15.999 > 5 54 O 0.88173338659591 0.96892641223195 0.93450498161923 15.999 > 5 55 O 0.11826661340409 0.96892641223195 0.23216168504743 15.999 > 6 56 O 0.61826661340409 0.96892641223195 0.23216168504743 15.999 > 6 57 O 0.11826661340409 0.96892641223195 0.56549501838077 15.999 > 6 58 O 0.61826661340409 0.96892641223195 0.56549501838077 15.999 > 6 59 O 0.11826661340409 0.96892641223195 0.89882835171410 15.999 > 6 60 O 0.61826661340409 0.96892641223195 0.89882835171410 15.999 > 6 61 O 0.36826661340409 0.53107358776805 0.06549501838077 15.999 > 7 62 O 0.86826661340409 0.53107358776805 0.06549501838077 15.999 > 7 63 O 0.36826661340409 0.53107358776805 0.39882835171410 15.999 > 7 64 O 0.86826661340409 0.53107358776805 0.39882835171410 15.999 > 7 65 O 0.36826661340409 0.53107358776805 0.73216168504743 15.999 > 7 66 O 0.86826661340409 0.53107358776805 0.73216168504743 15.999 > 7 67 O 0.13173338659591 0.53107358776805 0.10117164828590 15.999 > 8 68 O 0.63173338659591 0.53107358776805 0.10117164828590 15.999 > 8 69 O 0.13173338659591 0.53107358776805 0.43450498161923 15.999 > 8 70 O 0.63173338659591 0.53107358776805 0.43450498161923 15.999 > 8 71 O 0.13173338659591 0.53107358776805 0.76783831495256 15.999 > 8 72 O 0.63173338659591 0.53107358776805 0.76783831495256 15.999 > 8 *73 O 0.42478647995846 0.79412576773386 0.11311093089794 15.999 > 9 74 O 0.92478647995846 0.79412576773386 0.11311093089794 15.999 > 9 75 O 0.42478647995846 0.79412576773386 0.44644426423128 15.999 > 9 76 O 0.92478647995846 0.79412576773386 0.44644426423128 15.999 > 9 77 O 0.42478647995846 0.79412576773386 0.77977759756461 15.999 > 9 78 O 0.92478647995846 0.79412576773386 0.77977759756461 15.999 > 9 79 O 0.07521352004154 0.79412576773386 0.05355573576872 15.999 > 10 80 O 0.57521352004154 0.79412576773386 0.05355573576872 15.999 > 10 81 O 0.07521352004154 0.79412576773386 0.38688906910206 15.999 > 10 82 O 0.57521352004154 0.79412576773386 0.38688906910206 15.999 > 10 83 O 0.07521352004154 0.79412576773386 0.72022240243539 15.999 > 10 84 O 0.57521352004154 0.79412576773386 0.72022240243539 15.999 > 10 85 O 0.32521352004154 0.70587423226614 0.22022240243539 15.999 > 11 86 O 0.82521352004154 0.70587423226614 0.22022240243539 15.999 > 11 87 O 0.32521352004154 0.70587423226614 0.55355573576872 15.999 > 11 88 O 0.82521352004154 0.70587423226614 0.55355573576872 15.999 > 11 89 O 0.32521352004154 0.70587423226614 0.88688906910206 15.999 > 11 90 O 0.82521352004154 0.70587423226614 0.88688906910206 15.999 > 11 91 O 0.17478647995846 0.70587423226614 0.27977759756461 15.999 > 12 92 O 0.67478647995846 0.70587423226614 0.27977759756461 15.999 > 12 93 O 0.17478647995846 0.70587423226614 0.61311093089794 15.999 > 12 94 O 0.67478647995846 0.70587423226614 0.61311093089794 15.999 > 12 95 O 0.17478647995846 0.70587423226614 0.94644426423128 15.999 > 12 96 O 0.67478647995846 0.70587423226614 0.94644426423128 15.999 > 12 97 O 0.13173338659591 0.46892641223195 0.26783831495256 15.999 > 5 98 O 0.63173338659591 0.46892641223195 0.26783831495256 15.999 > 5 99 O 0.13173338659591 0.46892641223195 0.60117164828590 15.999 > 5 100 O 0.63173338659591 0.46892641223195 0.60117164828590 15.999 > 5 101 O 0.13173338659591 0.46892641223195 0.93450498161923 15.999 > 5 102 O 0.63173338659591 0.46892641223195 0.93450498161923 15.999 > 5 103 O 0.36826661340409 0.46892641223195 0.23216168504743 15.999 > 6 104 O 0.86826661340409 0.46892641223195 0.23216168504743 15.999 > 6 105 O 0.36826661340409 0.46892641223195 0.56549501838077 15.999 > 6 106 O 0.86826661340409 0.46892641223195 0.56549501838077 15.999 > 6 107 O 0.36826661340409 0.46892641223195 0.89882835171410 15.999 > 6 108 O 0.86826661340409 0.46892641223195 0.89882835171410 15.999 > 6 109 O 0.11826661340409 0.03107358776805 0.06549501838077 15.999 > 7 110 O 0.61826661340409 0.03107358776805 0.06549501838077 15.999 > 7 111 O 0.11826661340409 0.03107358776805 0.39882835171410 15.999 > 7 112 O 0.61826661340409 0.03107358776805 0.39882835171410 15.999 > 7 113 O 0.11826661340409 0.03107358776805 0.73216168504743 15.999 > 7 114 O 0.61826661340409 0.03107358776805 0.73216168504743 15.999 > 7 115 O 0.38173338659591 0.03107358776805 0.10117164828590 15.999 > 8 116 O 0.88173338659591 0.03107358776805 0.10117164828590 15.999 > 8 117 O 0.38173338659591 0.03107358776805 0.43450498161923 15.999 > 8 118 O 0.88173338659591 0.03107358776805 0.43450498161923 15.999 > 8 119 O 0.38173338659591 0.03107358776805 0.76783831495256 15.999 > 8 120 O 0.88173338659591 0.03107358776805 0.76783831495256 15.999 > 8 121 O 0.17478647995846 0.29412576773386 0.11311093089794 15.999 > 9 122 O 0.67478647995846 0.29412576773386 0.11311093089794 15.999 > 9 123 O 0.17478647995846 0.29412576773386 0.44644426423128 15.999 > 9 124 O 0.67478647995846 0.29412576773386 0.44644426423128 15.999 > 9 125 O 0.17478647995846 0.29412576773386 0.77977759756461 15.999 > 9 126 O 0.67478647995846 0.29412576773386 0.77977759756461 15.999 > 9 127 O 0.32521352004154 0.29412576773386 0.05355573576872 15.999 > 10 128 O 0.82521352004154 0.29412576773386 0.05355573576872 15.999 > 10 129 O 0.32521352004154 0.29412576773386 0.38688906910206 15.999 > 10 130 O 0.82521352004154 0.29412576773386 0.38688906910206 15.999 > 10 131 O 0.32521352004154 0.29412576773386 0.72022240243539 15.999 > 10 132 O 0.82521352004154 0.29412576773386 0.72022240243539 15.999 > 10 133 O 0.07521352004154 0.20587423226614 0.22022240243539 15.999 > 11 134 O 0.57521352004154 0.20587423226614 0.22022240243539 15.999 > 11 135 O 0.07521352004154 0.20587423226614 0.55355573576872 15.999 > 11 136 O 0.57521352004154 0.20587423226614 0.55355573576872 15.999 > 11 137 O 0.07521352004154 0.20587423226614 0.88688906910206 15.999 > 11 138 O 0.57521352004154 0.20587423226614 0.88688906910206 15.999 > 11 139 O 0.42478647995846 0.20587423226614 0.27977759756461 15.999 > 12 140 O 0.92478647995846 0.20587423226614 0.27977759756461 15.999 > 12 141 O 0.42478647995846 0.20587423226614 0.61311093089794 15.999 > 12 142 O 0.92478647995846 0.20587423226614 0.61311093089794 15.999 > 12 143 O 0.42478647995846 0.20587423226614 0.94644426423128 15.999 > 12 144 O 0.92478647995846 0.20587423226614 0.94644426423128 15.999 > 12 ---------------------------------------------------------------------------- NAC parameters were read from "phonopy_mlp_eval_fc2_dataset.yaml.xz". --------------------------- Dielectric constant ---------------------------- 5.2024327 0.0000000 -0.2749362 0.0000000 4.8115764 0.0000000 -0.2748448 0.0000000 5.0515469 -------------------------- Born effective charges -------------------------- 1 La 4.9607340 0.0000000 0.0468100 0.0000000 4.3628525 0.0000000 0.5849969 0.0000000 4.7093940 2 La 4.9607340 0.0000000 0.0468100 0.0000000 4.3628525 0.0000000 0.5849969 0.0000000 4.7093940 3 Nb 5.7041568 0.0000000 -0.8309393 0.0000000 5.2670674 0.0000000 -1.3490591 0.0000000 5.5173555 4 Nb 5.7041568 0.0000000 -0.8309393 0.0000000 5.2670674 0.0000000 -1.3490591 0.0000000 5.5173555 5 O -1.8500986 -0.0926774 -0.0349956 0.0104997 -2.1408523 0.6432356 -0.0762324 0.6674394 -3.6452986 6 O -1.8500986 0.0926774 -0.0349956 -0.0104997 -2.1408523 -0.6432356 -0.0762324 -0.6674394 -3.6452986 7 O -1.8500986 -0.0926774 -0.0349956 0.0104997 -2.1408523 0.6432356 -0.0762324 0.6674394 -3.6452986 8 O -1.8500986 0.0926774 -0.0349956 -0.0104997 -2.1408523 -0.6432356 -0.0762324 -0.6674394 -3.6452986 9 O -3.4823468 -1.1117447 0.4270603 -1.0416710 -2.6741077 0.7072538 0.4582635 0.6340933 -1.4680762 10 O -3.4823468 1.1117447 0.4270603 1.0416710 -2.6741077 -0.7072538 0.4582635 -0.6340933 -1.4680762 11 O -3.4823468 -1.1117447 0.4270603 -1.0416710 -2.6741077 0.7072538 0.4582635 0.6340933 -1.4680762 12 O -3.4823468 1.1117447 0.4270603 1.0416710 -2.6741077 -0.7072538 0.4582635 -0.6340933 -1.4680762 ---------------------------------------------------------------------------- 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: 9972/9972 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 2074 Number of blocks in projector: 2074 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: 440 Use standard eigh solver. --- Eigsh_solver_block: 2 / 6 --- Block_size: 424 Use standard eigh solver. --- Eigsh_solver_block: 3 / 6 --- Block_size: 424 Use standard eigh solver. --- Eigsh_solver_block: 4 / 6 --- Block_size: 262 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 262 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 262 Use standard eigh solver. Tree of FC basis block matrices: - (2074, 2047), data: False |-- (262, 258), data: True |-- (262, 258), data: True |-- (262, 258), data: True |-- (424, 420), data: True |-- (424, 420), data: True |-- (440, 433), data: True ----- Solver_atoms: 1 -- 144 / 144 Time (Solver_compr_matrix_reshape): 0.012 Solver_block: 100 / 400 - Time: 2.031 Solver_block: 200 / 400 - Time: 1.737 Solver_block: 300 / 400 - Time: 1.108 Solver_block: 400 / 400 - Time: 1.401 Solver: Calculate X.T @ X and X.T @ y (disp @ compr @ eigvecs).T @ (disp @ compr @ eigvecs): 6.695 --------------------------------- Symfc end -------------------------------- Max drift of force constants: -0.00000000 (xx) -0.00000000 (xx) Permutation basis: 432/432 Permutation basis: 9972/9972 Construct permutation basis matrix. Finding block diagonal structure in projector. Using scipy connected_components. Rank of projector: 2074 Number of blocks in projector: 2074 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: 440 Use standard eigh solver. --- Eigsh_solver_block: 2 / 6 --- Block_size: 424 Use standard eigh solver. --- Eigsh_solver_block: 3 / 6 --- Block_size: 424 Use standard eigh solver. --- Eigsh_solver_block: 4 / 6 --- Block_size: 262 Use standard eigh solver. --- Eigsh_solver_block: 5 / 6 --- Block_size: 262 Use standard eigh solver. --- Eigsh_solver_block: 6 / 6 --- Block_size: 262 Use standard eigh solver. Tree of FC basis block matrices: - (2074, 2047), data: False |-- (262, 258), data: True |-- (262, 258), data: True |-- (262, 258), data: True |-- (424, 420), data: True |-- (424, 420), data: True |-- (440, 433), 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 10:36:22]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate fc3 ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 10:36:23]------------------------- Compiled with OpenMP support (max 128 threads). Running in phono3py.load mode. Python version 3.14.2 Spglib version 2.6.1 ----------------------------- General settings ----------------------------- Run mode: force constants HDF5 data compression filter: gzip Crystal structure was read from "phono3py_mlp_eval_fc3_disp.yaml.xz". Supercell (dim): [2 1 3] Primitive matrix: [0.5 0.5 0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/c (15) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 3.632048760004638 -5.717960545000000 0.000000000000000 b 3.632048760004638 5.717960545000000 0.000000000000000 c -3.346978018270880 0.000000000000000 3.953187320625488 Atomic positions (fractional): 1 La 0.63049252787470 0.36950747212530 0.25000000000000 138.905 2 La 0.36950747212530 0.63049252787470 0.75000000000000 138.905 3 Nb 0.10035356332652 0.89964643667348 0.25000000000000 92.906 4 Nb 0.89964643667348 0.10035356332652 0.75000000000000 92.906 5 O 0.79454036095987 0.73239318542376 0.80351494485770 15.999 6 O 0.26760681457624 0.20545963904013 0.69648505514230 15.999 7 O 0.20545963904013 0.26760681457624 0.19648505514230 15.999 8 O 0.73239318542376 0.79454036095987 0.30351494485769 15.999 9 O 0.05544719218307 0.64369872765078 0.33933279269383 15.999 10 O 0.35630127234922 0.94455280781693 0.16066720730617 15.999 11 O 0.94455280781693 0.35630127234922 0.66066720730617 15.999 12 O 0.64369872765078 0.05544719218307 0.83933279269383 15.999 -------------------------------- supercell --------------------------------- Lattice vectors: a 14.528195040018552 0.000000000000000 0.000000000000000 b 0.000000000000000 11.435921089999999 0.000000000000000 c -10.040934054812640 0.000000000000000 11.859561961876464 Atomic positions (fractional): 1 La 0.25000000000000 0.86950747212530 0.08333333333333 138.905 > 1 2 La 0.75000000000000 0.86950747212530 0.08333333333333 138.905 > 1 3 La 0.25000000000000 0.86950747212530 0.41666666666667 138.905 > 1 4 La 0.75000000000000 0.86950747212530 0.41666666666667 138.905 > 1 5 La 0.25000000000000 0.86950747212530 0.75000000000000 138.905 > 1 6 La 0.75000000000000 0.86950747212530 0.75000000000000 138.905 > 1 7 La 0.00000000000000 0.63049252787470 0.25000000000000 138.905 > 7 8 La 0.50000000000000 0.63049252787470 0.25000000000000 138.905 > 7 9 La 0.00000000000000 0.63049252787470 0.58333333333333 138.905 > 7 10 La 0.50000000000000 0.63049252787470 0.58333333333333 138.905 > 7 11 La 0.00000000000000 0.63049252787470 0.91666666666667 138.905 > 7 12 La 0.50000000000000 0.63049252787470 0.91666666666667 138.905 > 7 13 La 0.00000000000000 0.36950747212530 0.08333333333333 138.905 > 1 14 La 0.50000000000000 0.36950747212530 0.08333333333333 138.905 > 1 15 La 0.00000000000000 0.36950747212530 0.41666666666667 138.905 > 1 16 La 0.50000000000000 0.36950747212530 0.41666666666667 138.905 > 1 17 La 0.00000000000000 0.36950747212530 0.75000000000000 138.905 > 1 18 La 0.50000000000000 0.36950747212530 0.75000000000000 138.905 > 1 19 La 0.25000000000000 0.13049252787470 0.25000000000000 138.905 > 7 20 La 0.75000000000000 0.13049252787470 0.25000000000000 138.905 > 7 21 La 0.25000000000000 0.13049252787470 0.58333333333333 138.905 > 7 22 La 0.75000000000000 0.13049252787470 0.58333333333333 138.905 > 7 23 La 0.25000000000000 0.13049252787470 0.91666666666667 138.905 > 7 24 La 0.75000000000000 0.13049252787470 0.91666666666667 138.905 > 7 25 Nb 0.00000000000000 0.89964643667348 0.08333333333333 92.906 > 25 26 Nb 0.50000000000000 0.89964643667348 0.08333333333333 92.906 > 25 27 Nb 0.00000000000000 0.89964643667348 0.41666666666667 92.906 > 25 28 Nb 0.50000000000000 0.89964643667348 0.41666666666667 92.906 > 25 29 Nb 0.00000000000000 0.89964643667348 0.75000000000000 92.906 > 25 30 Nb 0.50000000000000 0.89964643667348 0.75000000000000 92.906 > 25 31 Nb 0.25000000000000 0.60035356332652 0.25000000000000 92.906 > 31 32 Nb 0.75000000000000 0.60035356332652 0.25000000000000 92.906 > 31 33 Nb 0.25000000000000 0.60035356332652 0.58333333333333 92.906 > 31 34 Nb 0.75000000000000 0.60035356332652 0.58333333333333 92.906 > 31 35 Nb 0.25000000000000 0.60035356332652 0.91666666666667 92.906 > 31 36 Nb 0.75000000000000 0.60035356332652 0.91666666666667 92.906 > 31 37 Nb 0.25000000000000 0.39964643667348 0.08333333333333 92.906 > 25 38 Nb 0.75000000000000 0.39964643667348 0.08333333333333 92.906 > 25 39 Nb 0.25000000000000 0.39964643667348 0.41666666666667 92.906 > 25 40 Nb 0.75000000000000 0.39964643667348 0.41666666666667 92.906 > 25 41 Nb 0.25000000000000 0.39964643667348 0.75000000000000 92.906 > 25 42 Nb 0.75000000000000 0.39964643667348 0.75000000000000 92.906 > 25 43 Nb 0.00000000000000 0.10035356332652 0.25000000000000 92.906 > 31 44 Nb 0.50000000000000 0.10035356332652 0.25000000000000 92.906 > 31 45 Nb 0.00000000000000 0.10035356332652 0.58333333333333 92.906 > 31 46 Nb 0.50000000000000 0.10035356332652 0.58333333333333 92.906 > 31 47 Nb 0.00000000000000 0.10035356332652 0.91666666666667 92.906 > 31 48 Nb 0.50000000000000 0.10035356332652 0.91666666666667 92.906 > 31 49 O 0.38173338659591 0.96892641223195 0.26783831495256 15.999 > 49 50 O 0.88173338659591 0.96892641223195 0.26783831495256 15.999 > 49 51 O 0.38173338659591 0.96892641223195 0.60117164828590 15.999 > 49 52 O 0.88173338659591 0.96892641223195 0.60117164828590 15.999 > 49 53 O 0.38173338659591 0.96892641223195 0.93450498161923 15.999 > 49 54 O 0.88173338659591 0.96892641223195 0.93450498161923 15.999 > 49 55 O 0.11826661340409 0.96892641223195 0.23216168504743 15.999 > 55 56 O 0.61826661340409 0.96892641223195 0.23216168504743 15.999 > 55 57 O 0.11826661340409 0.96892641223195 0.56549501838077 15.999 > 55 58 O 0.61826661340409 0.96892641223195 0.56549501838077 15.999 > 55 59 O 0.11826661340409 0.96892641223195 0.89882835171410 15.999 > 55 60 O 0.61826661340409 0.96892641223195 0.89882835171410 15.999 > 55 61 O 0.36826661340409 0.53107358776805 0.06549501838077 15.999 > 61 62 O 0.86826661340409 0.53107358776805 0.06549501838077 15.999 > 61 63 O 0.36826661340409 0.53107358776805 0.39882835171410 15.999 > 61 64 O 0.86826661340409 0.53107358776805 0.39882835171410 15.999 > 61 65 O 0.36826661340409 0.53107358776805 0.73216168504743 15.999 > 61 66 O 0.86826661340409 0.53107358776805 0.73216168504743 15.999 > 61 67 O 0.13173338659591 0.53107358776805 0.10117164828590 15.999 > 67 68 O 0.63173338659591 0.53107358776805 0.10117164828590 15.999 > 67 69 O 0.13173338659591 0.53107358776805 0.43450498161923 15.999 > 67 70 O 0.63173338659591 0.53107358776805 0.43450498161923 15.999 > 67 71 O 0.13173338659591 0.53107358776805 0.76783831495256 15.999 > 67 72 O 0.63173338659591 0.53107358776805 0.76783831495256 15.999 > 67 73 O 0.42478647995846 0.79412576773386 0.11311093089794 15.999 > 73 74 O 0.92478647995846 0.79412576773386 0.11311093089794 15.999 > 73 75 O 0.42478647995846 0.79412576773386 0.44644426423128 15.999 > 73 76 O 0.92478647995846 0.79412576773386 0.44644426423128 15.999 > 73 77 O 0.42478647995846 0.79412576773386 0.77977759756461 15.999 > 73 78 O 0.92478647995846 0.79412576773386 0.77977759756461 15.999 > 73 79 O 0.07521352004154 0.79412576773386 0.05355573576872 15.999 > 79 80 O 0.57521352004154 0.79412576773386 0.05355573576872 15.999 > 79 81 O 0.07521352004154 0.79412576773386 0.38688906910206 15.999 > 79 82 O 0.57521352004154 0.79412576773386 0.38688906910206 15.999 > 79 83 O 0.07521352004154 0.79412576773386 0.72022240243539 15.999 > 79 84 O 0.57521352004154 0.79412576773386 0.72022240243539 15.999 > 79 85 O 0.32521352004154 0.70587423226614 0.22022240243539 15.999 > 85 86 O 0.82521352004154 0.70587423226614 0.22022240243539 15.999 > 85 87 O 0.32521352004154 0.70587423226614 0.55355573576872 15.999 > 85 88 O 0.82521352004154 0.70587423226614 0.55355573576872 15.999 > 85 89 O 0.32521352004154 0.70587423226614 0.88688906910206 15.999 > 85 90 O 0.82521352004154 0.70587423226614 0.88688906910206 15.999 > 85 91 O 0.17478647995846 0.70587423226614 0.27977759756461 15.999 > 91 92 O 0.67478647995846 0.70587423226614 0.27977759756461 15.999 > 91 93 O 0.17478647995846 0.70587423226614 0.61311093089794 15.999 > 91 94 O 0.67478647995846 0.70587423226614 0.61311093089794 15.999 > 91 95 O 0.17478647995846 0.70587423226614 0.94644426423128 15.999 > 91 96 O 0.67478647995846 0.70587423226614 0.94644426423128 15.999 > 91 97 O 0.13173338659591 0.46892641223195 0.26783831495256 15.999 > 49 98 O 0.63173338659591 0.46892641223195 0.26783831495256 15.999 > 49 99 O 0.13173338659591 0.46892641223195 0.60117164828590 15.999 > 49 100 O 0.63173338659591 0.46892641223195 0.60117164828590 15.999 > 49 101 O 0.13173338659591 0.46892641223195 0.93450498161923 15.999 > 49 102 O 0.63173338659591 0.46892641223195 0.93450498161923 15.999 > 49 103 O 0.36826661340409 0.46892641223195 0.23216168504743 15.999 > 55 104 O 0.86826661340409 0.46892641223195 0.23216168504743 15.999 > 55 105 O 0.36826661340409 0.46892641223195 0.56549501838077 15.999 > 55 106 O 0.86826661340409 0.46892641223195 0.56549501838077 15.999 > 55 107 O 0.36826661340409 0.46892641223195 0.89882835171410 15.999 > 55 108 O 0.86826661340409 0.46892641223195 0.89882835171410 15.999 > 55 109 O 0.11826661340409 0.03107358776805 0.06549501838077 15.999 > 61 110 O 0.61826661340409 0.03107358776805 0.06549501838077 15.999 > 61 111 O 0.11826661340409 0.03107358776805 0.39882835171410 15.999 > 61 112 O 0.61826661340409 0.03107358776805 0.39882835171410 15.999 > 61 113 O 0.11826661340409 0.03107358776805 0.73216168504743 15.999 > 61 114 O 0.61826661340409 0.03107358776805 0.73216168504743 15.999 > 61 115 O 0.38173338659591 0.03107358776805 0.10117164828590 15.999 > 67 116 O 0.88173338659591 0.03107358776805 0.10117164828590 15.999 > 67 117 O 0.38173338659591 0.03107358776805 0.43450498161923 15.999 > 67 118 O 0.88173338659591 0.03107358776805 0.43450498161923 15.999 > 67 119 O 0.38173338659591 0.03107358776805 0.76783831495256 15.999 > 67 120 O 0.88173338659591 0.03107358776805 0.76783831495256 15.999 > 67 121 O 0.17478647995846 0.29412576773386 0.11311093089794 15.999 > 73 122 O 0.67478647995846 0.29412576773386 0.11311093089794 15.999 > 73 123 O 0.17478647995846 0.29412576773386 0.44644426423128 15.999 > 73 124 O 0.67478647995846 0.29412576773386 0.44644426423128 15.999 > 73 125 O 0.17478647995846 0.29412576773386 0.77977759756461 15.999 > 73 126 O 0.67478647995846 0.29412576773386 0.77977759756461 15.999 > 73 127 O 0.32521352004154 0.29412576773386 0.05355573576872 15.999 > 79 128 O 0.82521352004154 0.29412576773386 0.05355573576872 15.999 > 79 129 O 0.32521352004154 0.29412576773386 0.38688906910206 15.999 > 79 130 O 0.82521352004154 0.29412576773386 0.38688906910206 15.999 > 79 131 O 0.32521352004154 0.29412576773386 0.72022240243539 15.999 > 79 132 O 0.82521352004154 0.29412576773386 0.72022240243539 15.999 > 79 133 O 0.07521352004154 0.20587423226614 0.22022240243539 15.999 > 85 134 O 0.57521352004154 0.20587423226614 0.22022240243539 15.999 > 85 135 O 0.07521352004154 0.20587423226614 0.55355573576872 15.999 > 85 136 O 0.57521352004154 0.20587423226614 0.55355573576872 15.999 > 85 137 O 0.07521352004154 0.20587423226614 0.88688906910206 15.999 > 85 138 O 0.57521352004154 0.20587423226614 0.88688906910206 15.999 > 85 139 O 0.42478647995846 0.20587423226614 0.27977759756461 15.999 > 91 140 O 0.92478647995846 0.20587423226614 0.27977759756461 15.999 > 91 141 O 0.42478647995846 0.20587423226614 0.61311093089794 15.999 > 91 142 O 0.92478647995846 0.20587423226614 0.61311093089794 15.999 > 91 143 O 0.42478647995846 0.20587423226614 0.94644426423128 15.999 > 91 144 O 0.92478647995846 0.20587423226614 0.94644426423128 15.999 > 91 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py_mlp_eval_fc3_disp.yaml.xz". --------------------------- Dielectric constant ---------------------------- 5.2024327 0.0000000 -0.2749362 0.0000000 4.8115764 0.0000000 -0.2748448 0.0000000 5.0515469 -------------------------- Born effective charges -------------------------- 1 La 4.9607340 0.0000000 0.0468100 0.0000000 4.3628525 0.0000000 0.5849969 0.0000000 4.7093940 2 La 4.9607340 0.0000000 0.0468100 0.0000000 4.3628525 0.0000000 0.5849969 0.0000000 4.7093940 3 Nb 5.7041568 0.0000000 -0.8309393 0.0000000 5.2670674 0.0000000 -1.3490591 0.0000000 5.5173555 4 Nb 5.7041568 0.0000000 -0.8309393 0.0000000 5.2670674 0.0000000 -1.3490591 0.0000000 5.5173555 5 O -1.8500986 -0.0926774 -0.0349956 0.0104997 -2.1408523 0.6432356 -0.0762324 0.6674394 -3.6452986 6 O -1.8500986 0.0926774 -0.0349956 -0.0104997 -2.1408523 -0.6432356 -0.0762324 -0.6674394 -3.6452986 7 O -1.8500986 -0.0926774 -0.0349956 0.0104997 -2.1408523 0.6432356 -0.0762324 0.6674394 -3.6452986 8 O -1.8500986 0.0926774 -0.0349956 -0.0104997 -2.1408523 -0.6432356 -0.0762324 -0.6674394 -3.6452986 9 O -3.4823468 -1.1117447 0.4270603 -1.0416710 -2.6741077 0.7072538 0.4582635 0.6340933 -1.4680762 10 O -3.4823468 1.1117447 0.4270603 1.0416710 -2.6741077 -0.7072538 0.4582635 -0.6340933 -1.4680762 11 O -3.4823468 -1.1117447 0.4270603 -1.0416710 -2.6741077 0.7072538 0.4582635 0.6340933 -1.4680762 12 O -3.4823468 1.1117447 0.4270603 1.0416710 -2.6741077 -0.7072538 0.4582635 -0.6340933 -1.4680762 ---------------------------------------------------------------------------- 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] [-0.0065 0.0000 0.0076] [ 0.0065 0.0000 -0.0076] Computing fc3[ 25, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0065 0.0000 0.0076] [ 0.0065 0.0000 -0.0076] Computing fc3[ 49, x, x ] using numpy.linalg.pinv. Displacements (in Angstrom): [ 0.0100 0.0000 0.0000] [-0.0100 0.0000 0.0000] [ 0.0000 0.0100 0.0000] [ 0.0000 -0.0100 0.0000] [-0.0065 0.0000 0.0076] [ 0.0065 0.0000 -0.0076] 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] [-0.0065 0.0000 0.0076] [ 0.0065 0.0000 -0.0076] Expanding fc3. Symmetrizing fc3 by traditional approach (N=3). Symmetrizing fc2 by traditional approach (N=3). Max drift of fc3: 0.00000000 (xyx) 0.00000000 (xyx) 0.00000000 (xxy) fc3 was written into "fc3.hdf5". Max drift of fc2: 0.00000000 (zx) 0.00000000 (zx) 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 10:36:48]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_| ---------------------------- ------ calculate LTC ------- ---------------------------- _ _____ _ __ | |__ ___ _ __ ___|___ / _ __ _ _ | '_ \| '_ \ / _ \| '_ \ / _ \ |_ \| '_ \| | | | | |_) | | | | (_) | | | | (_) |__) | |_) | |_| | | .__/|_| |_|\___/|_| |_|\___/____/| .__/ \__, | |_| |_| |___/ 3.23.0 -------------------------[time 2026-01-08 10:36:49]------------------------- 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): [2 1 3] Primitive matrix: [0.5 0.5 0. ] [-0.5 0.5 0. ] [0. 0. 1.] Spacegroup: C2/c (15) ------------------------------ primitive cell ------------------------------ Lattice vectors: a 3.632048760004638 -5.717960545000000 0.000000000000000 b 3.632048760004638 5.717960545000000 0.000000000000000 c -3.346978018270880 0.000000000000000 3.953187320625488 Atomic positions (fractional): 1 La 0.63049252787470 0.36950747212530 0.25000000000000 138.905 2 La 0.36950747212530 0.63049252787470 0.75000000000000 138.905 3 Nb 0.10035356332652 0.89964643667348 0.25000000000000 92.906 4 Nb 0.89964643667348 0.10035356332652 0.75000000000000 92.906 5 O 0.79454036095987 0.73239318542376 0.80351494485770 15.999 6 O 0.26760681457624 0.20545963904013 0.69648505514230 15.999 7 O 0.20545963904013 0.26760681457624 0.19648505514230 15.999 8 O 0.73239318542376 0.79454036095987 0.30351494485769 15.999 9 O 0.05544719218307 0.64369872765078 0.33933279269383 15.999 10 O 0.35630127234922 0.94455280781693 0.16066720730617 15.999 11 O 0.94455280781693 0.35630127234922 0.66066720730617 15.999 12 O 0.64369872765078 0.05544719218307 0.83933279269383 15.999 -------------------------------- supercell --------------------------------- Lattice vectors: a 14.528195040018552 0.000000000000000 0.000000000000000 b 0.000000000000000 11.435921089999999 0.000000000000000 c -10.040934054812640 0.000000000000000 11.859561961876464 Atomic positions (fractional): 1 La 0.25000000000000 0.86950747212530 0.08333333333333 138.905 > 1 2 La 0.75000000000000 0.86950747212530 0.08333333333333 138.905 > 1 3 La 0.25000000000000 0.86950747212530 0.41666666666667 138.905 > 1 4 La 0.75000000000000 0.86950747212530 0.41666666666667 138.905 > 1 5 La 0.25000000000000 0.86950747212530 0.75000000000000 138.905 > 1 6 La 0.75000000000000 0.86950747212530 0.75000000000000 138.905 > 1 7 La 0.00000000000000 0.63049252787470 0.25000000000000 138.905 > 7 8 La 0.50000000000000 0.63049252787470 0.25000000000000 138.905 > 7 9 La 0.00000000000000 0.63049252787470 0.58333333333333 138.905 > 7 10 La 0.50000000000000 0.63049252787470 0.58333333333333 138.905 > 7 11 La 0.00000000000000 0.63049252787470 0.91666666666667 138.905 > 7 12 La 0.50000000000000 0.63049252787470 0.91666666666667 138.905 > 7 13 La 0.00000000000000 0.36950747212530 0.08333333333333 138.905 > 1 14 La 0.50000000000000 0.36950747212530 0.08333333333333 138.905 > 1 15 La 0.00000000000000 0.36950747212530 0.41666666666667 138.905 > 1 16 La 0.50000000000000 0.36950747212530 0.41666666666667 138.905 > 1 17 La 0.00000000000000 0.36950747212530 0.75000000000000 138.905 > 1 18 La 0.50000000000000 0.36950747212530 0.75000000000000 138.905 > 1 19 La 0.25000000000000 0.13049252787470 0.25000000000000 138.905 > 7 20 La 0.75000000000000 0.13049252787470 0.25000000000000 138.905 > 7 21 La 0.25000000000000 0.13049252787470 0.58333333333333 138.905 > 7 22 La 0.75000000000000 0.13049252787470 0.58333333333333 138.905 > 7 23 La 0.25000000000000 0.13049252787470 0.91666666666667 138.905 > 7 24 La 0.75000000000000 0.13049252787470 0.91666666666667 138.905 > 7 25 Nb 0.00000000000000 0.89964643667348 0.08333333333333 92.906 > 25 26 Nb 0.50000000000000 0.89964643667348 0.08333333333333 92.906 > 25 27 Nb 0.00000000000000 0.89964643667348 0.41666666666667 92.906 > 25 28 Nb 0.50000000000000 0.89964643667348 0.41666666666667 92.906 > 25 29 Nb 0.00000000000000 0.89964643667348 0.75000000000000 92.906 > 25 30 Nb 0.50000000000000 0.89964643667348 0.75000000000000 92.906 > 25 31 Nb 0.25000000000000 0.60035356332652 0.25000000000000 92.906 > 31 32 Nb 0.75000000000000 0.60035356332652 0.25000000000000 92.906 > 31 33 Nb 0.25000000000000 0.60035356332652 0.58333333333333 92.906 > 31 34 Nb 0.75000000000000 0.60035356332652 0.58333333333333 92.906 > 31 35 Nb 0.25000000000000 0.60035356332652 0.91666666666667 92.906 > 31 36 Nb 0.75000000000000 0.60035356332652 0.91666666666667 92.906 > 31 37 Nb 0.25000000000000 0.39964643667348 0.08333333333333 92.906 > 25 38 Nb 0.75000000000000 0.39964643667348 0.08333333333333 92.906 > 25 39 Nb 0.25000000000000 0.39964643667348 0.41666666666667 92.906 > 25 40 Nb 0.75000000000000 0.39964643667348 0.41666666666667 92.906 > 25 41 Nb 0.25000000000000 0.39964643667348 0.75000000000000 92.906 > 25 42 Nb 0.75000000000000 0.39964643667348 0.75000000000000 92.906 > 25 43 Nb 0.00000000000000 0.10035356332652 0.25000000000000 92.906 > 31 44 Nb 0.50000000000000 0.10035356332652 0.25000000000000 92.906 > 31 45 Nb 0.00000000000000 0.10035356332652 0.58333333333333 92.906 > 31 46 Nb 0.50000000000000 0.10035356332652 0.58333333333333 92.906 > 31 47 Nb 0.00000000000000 0.10035356332652 0.91666666666667 92.906 > 31 48 Nb 0.50000000000000 0.10035356332652 0.91666666666667 92.906 > 31 49 O 0.38173338659591 0.96892641223195 0.26783831495256 15.999 > 49 50 O 0.88173338659591 0.96892641223195 0.26783831495256 15.999 > 49 51 O 0.38173338659591 0.96892641223195 0.60117164828590 15.999 > 49 52 O 0.88173338659591 0.96892641223195 0.60117164828590 15.999 > 49 53 O 0.38173338659591 0.96892641223195 0.93450498161923 15.999 > 49 54 O 0.88173338659591 0.96892641223195 0.93450498161923 15.999 > 49 55 O 0.11826661340409 0.96892641223195 0.23216168504743 15.999 > 55 56 O 0.61826661340409 0.96892641223195 0.23216168504743 15.999 > 55 57 O 0.11826661340409 0.96892641223195 0.56549501838077 15.999 > 55 58 O 0.61826661340409 0.96892641223195 0.56549501838077 15.999 > 55 59 O 0.11826661340409 0.96892641223195 0.89882835171410 15.999 > 55 60 O 0.61826661340409 0.96892641223195 0.89882835171410 15.999 > 55 61 O 0.36826661340409 0.53107358776805 0.06549501838077 15.999 > 61 62 O 0.86826661340409 0.53107358776805 0.06549501838077 15.999 > 61 63 O 0.36826661340409 0.53107358776805 0.39882835171410 15.999 > 61 64 O 0.86826661340409 0.53107358776805 0.39882835171410 15.999 > 61 65 O 0.36826661340409 0.53107358776805 0.73216168504743 15.999 > 61 66 O 0.86826661340409 0.53107358776805 0.73216168504743 15.999 > 61 67 O 0.13173338659591 0.53107358776805 0.10117164828590 15.999 > 67 68 O 0.63173338659591 0.53107358776805 0.10117164828590 15.999 > 67 69 O 0.13173338659591 0.53107358776805 0.43450498161923 15.999 > 67 70 O 0.63173338659591 0.53107358776805 0.43450498161923 15.999 > 67 71 O 0.13173338659591 0.53107358776805 0.76783831495256 15.999 > 67 72 O 0.63173338659591 0.53107358776805 0.76783831495256 15.999 > 67 73 O 0.42478647995846 0.79412576773386 0.11311093089794 15.999 > 73 74 O 0.92478647995846 0.79412576773386 0.11311093089794 15.999 > 73 75 O 0.42478647995846 0.79412576773386 0.44644426423128 15.999 > 73 76 O 0.92478647995846 0.79412576773386 0.44644426423128 15.999 > 73 77 O 0.42478647995846 0.79412576773386 0.77977759756461 15.999 > 73 78 O 0.92478647995846 0.79412576773386 0.77977759756461 15.999 > 73 79 O 0.07521352004154 0.79412576773386 0.05355573576872 15.999 > 79 80 O 0.57521352004154 0.79412576773386 0.05355573576872 15.999 > 79 81 O 0.07521352004154 0.79412576773386 0.38688906910206 15.999 > 79 82 O 0.57521352004154 0.79412576773386 0.38688906910206 15.999 > 79 83 O 0.07521352004154 0.79412576773386 0.72022240243539 15.999 > 79 84 O 0.57521352004154 0.79412576773386 0.72022240243539 15.999 > 79 85 O 0.32521352004154 0.70587423226614 0.22022240243539 15.999 > 85 86 O 0.82521352004154 0.70587423226614 0.22022240243539 15.999 > 85 87 O 0.32521352004154 0.70587423226614 0.55355573576872 15.999 > 85 88 O 0.82521352004154 0.70587423226614 0.55355573576872 15.999 > 85 89 O 0.32521352004154 0.70587423226614 0.88688906910206 15.999 > 85 90 O 0.82521352004154 0.70587423226614 0.88688906910206 15.999 > 85 91 O 0.17478647995846 0.70587423226614 0.27977759756461 15.999 > 91 92 O 0.67478647995846 0.70587423226614 0.27977759756461 15.999 > 91 93 O 0.17478647995846 0.70587423226614 0.61311093089794 15.999 > 91 94 O 0.67478647995846 0.70587423226614 0.61311093089794 15.999 > 91 95 O 0.17478647995846 0.70587423226614 0.94644426423128 15.999 > 91 96 O 0.67478647995846 0.70587423226614 0.94644426423128 15.999 > 91 97 O 0.13173338659591 0.46892641223195 0.26783831495256 15.999 > 49 98 O 0.63173338659591 0.46892641223195 0.26783831495256 15.999 > 49 99 O 0.13173338659591 0.46892641223195 0.60117164828590 15.999 > 49 100 O 0.63173338659591 0.46892641223195 0.60117164828590 15.999 > 49 101 O 0.13173338659591 0.46892641223195 0.93450498161923 15.999 > 49 102 O 0.63173338659591 0.46892641223195 0.93450498161923 15.999 > 49 103 O 0.36826661340409 0.46892641223195 0.23216168504743 15.999 > 55 104 O 0.86826661340409 0.46892641223195 0.23216168504743 15.999 > 55 105 O 0.36826661340409 0.46892641223195 0.56549501838077 15.999 > 55 106 O 0.86826661340409 0.46892641223195 0.56549501838077 15.999 > 55 107 O 0.36826661340409 0.46892641223195 0.89882835171410 15.999 > 55 108 O 0.86826661340409 0.46892641223195 0.89882835171410 15.999 > 55 109 O 0.11826661340409 0.03107358776805 0.06549501838077 15.999 > 61 110 O 0.61826661340409 0.03107358776805 0.06549501838077 15.999 > 61 111 O 0.11826661340409 0.03107358776805 0.39882835171410 15.999 > 61 112 O 0.61826661340409 0.03107358776805 0.39882835171410 15.999 > 61 113 O 0.11826661340409 0.03107358776805 0.73216168504743 15.999 > 61 114 O 0.61826661340409 0.03107358776805 0.73216168504743 15.999 > 61 115 O 0.38173338659591 0.03107358776805 0.10117164828590 15.999 > 67 116 O 0.88173338659591 0.03107358776805 0.10117164828590 15.999 > 67 117 O 0.38173338659591 0.03107358776805 0.43450498161923 15.999 > 67 118 O 0.88173338659591 0.03107358776805 0.43450498161923 15.999 > 67 119 O 0.38173338659591 0.03107358776805 0.76783831495256 15.999 > 67 120 O 0.88173338659591 0.03107358776805 0.76783831495256 15.999 > 67 121 O 0.17478647995846 0.29412576773386 0.11311093089794 15.999 > 73 122 O 0.67478647995846 0.29412576773386 0.11311093089794 15.999 > 73 123 O 0.17478647995846 0.29412576773386 0.44644426423128 15.999 > 73 124 O 0.67478647995846 0.29412576773386 0.44644426423128 15.999 > 73 125 O 0.17478647995846 0.29412576773386 0.77977759756461 15.999 > 73 126 O 0.67478647995846 0.29412576773386 0.77977759756461 15.999 > 73 127 O 0.32521352004154 0.29412576773386 0.05355573576872 15.999 > 79 128 O 0.82521352004154 0.29412576773386 0.05355573576872 15.999 > 79 129 O 0.32521352004154 0.29412576773386 0.38688906910206 15.999 > 79 130 O 0.82521352004154 0.29412576773386 0.38688906910206 15.999 > 79 131 O 0.32521352004154 0.29412576773386 0.72022240243539 15.999 > 79 132 O 0.82521352004154 0.29412576773386 0.72022240243539 15.999 > 79 133 O 0.07521352004154 0.20587423226614 0.22022240243539 15.999 > 85 134 O 0.57521352004154 0.20587423226614 0.22022240243539 15.999 > 85 135 O 0.07521352004154 0.20587423226614 0.55355573576872 15.999 > 85 136 O 0.57521352004154 0.20587423226614 0.55355573576872 15.999 > 85 137 O 0.07521352004154 0.20587423226614 0.88688906910206 15.999 > 85 138 O 0.57521352004154 0.20587423226614 0.88688906910206 15.999 > 85 139 O 0.42478647995846 0.20587423226614 0.27977759756461 15.999 > 91 140 O 0.92478647995846 0.20587423226614 0.27977759756461 15.999 > 91 141 O 0.42478647995846 0.20587423226614 0.61311093089794 15.999 > 91 142 O 0.92478647995846 0.20587423226614 0.61311093089794 15.999 > 91 143 O 0.42478647995846 0.20587423226614 0.94644426423128 15.999 > 91 144 O 0.92478647995846 0.20587423226614 0.94644426423128 15.999 > 91 ---------------------------------------------------------------------------- NAC parameters were read from "phono3py.yaml". --------------------------- Dielectric constant ---------------------------- 5.2024327 0.0000000 -0.2749362 0.0000000 4.8115764 0.0000000 -0.2748448 0.0000000 5.0515469 -------------------------- Born effective charges -------------------------- 1 La 4.9607340 0.0000000 0.0468100 0.0000000 4.3628525 0.0000000 0.5849969 0.0000000 4.7093940 2 La 4.9607340 0.0000000 0.0468100 0.0000000 4.3628525 0.0000000 0.5849969 0.0000000 4.7093940 3 Nb 5.7041568 0.0000000 -0.8309393 0.0000000 5.2670674 0.0000000 -1.3490591 0.0000000 5.5173555 4 Nb 5.7041568 0.0000000 -0.8309393 0.0000000 5.2670674 0.0000000 -1.3490591 0.0000000 5.5173555 5 O -1.8500986 -0.0926774 -0.0349956 0.0104997 -2.1408523 0.6432356 -0.0762324 0.6674394 -3.6452986 6 O -1.8500986 0.0926774 -0.0349956 -0.0104997 -2.1408523 -0.6432356 -0.0762324 -0.6674394 -3.6452986 7 O -1.8500986 -0.0926774 -0.0349956 0.0104997 -2.1408523 0.6432356 -0.0762324 0.6674394 -3.6452986 8 O -1.8500986 0.0926774 -0.0349956 -0.0104997 -2.1408523 -0.6432356 -0.0762324 -0.6674394 -3.6452986 9 O -3.4823468 -1.1117447 0.4270603 -1.0416710 -2.6741077 0.7072538 0.4582635 0.6340933 -1.4680762 10 O -3.4823468 1.1117447 0.4270603 1.0416710 -2.6741077 -0.7072538 0.4582635 -0.6340933 -1.4680762 11 O -3.4823468 -1.1117447 0.4270603 -1.0416710 -2.6741077 0.7072538 0.4582635 0.6340933 -1.4680762 12 O -3.4823468 1.1117447 0.4270603 1.0416710 -2.6741077 -0.7072538 0.4582635 -0.6340933 -1.4680762 ---------------------------------------------------------------------------- fc3 was read from "fc3.hdf5". fc2 was read from "fc2.hdf5". ----------------------------- Force constants ------------------------------ Max drift of fc3: 0.00000000 (xyx) 0.00000000 (xyx) 0.00000000 (xxy) 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 ... [ 10 10 13 ] 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: 0.76, Number of G-points: 299, Lambda: 0.18 Running harmonic phonon calculations... -------------------- Lattice thermal conductivity (RTA) -------------------- ======================= Grid point 0 (1/361) ======================= q-point: ( 0.00 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| -0.000 ( 0.000 0.000 0.000) 0.000 -0.000 ( 0.000 0.000 0.000) 0.000 0.000 ( 0.000 0.000 0.000) 0.000 3.372 ( 0.000 0.000 0.000) 0.000 3.505 ( 0.000 0.000 0.000) 0.000 3.775 ( 0.000 0.000 0.000) 0.000 3.804 ( 0.000 0.000 0.000) 0.000 4.534 ( 0.000 0.000 0.000) 0.000 4.902 ( 0.000 0.000 0.000) 0.000 5.307 ( 0.000 0.000 0.000) 0.000 5.362 ( 0.000 0.000 0.000) 0.000 5.409 ( 0.000 0.000 0.000) 0.000 6.071 ( 0.000 0.000 0.000) 0.000 6.101 ( 0.000 0.000 0.000) 0.000 6.458 ( 0.000 0.000 0.000) 0.000 7.109 ( 0.000 0.000 0.000) 0.000 7.439 ( 0.000 0.000 0.000) 0.000 8.274 ( 0.000 0.000 0.000) 0.000 9.124 ( 0.000 0.000 0.000) 0.000 9.218 ( 0.000 0.000 0.000) 0.000 9.353 ( 0.000 0.000 0.000) 0.000 10.020 ( 0.000 0.000 0.000) 0.000 10.449 ( 0.000 0.000 0.000) 0.000 11.476 ( 0.000 0.000 0.000) 0.000 11.717 ( 0.000 0.000 0.000) 0.000 12.018 ( 0.000 0.000 0.000) 0.000 12.533 ( 0.000 0.000 0.000) 0.000 14.790 ( 0.000 0.000 0.000) 0.000 16.704 ( 0.000 0.000 0.000) 0.000 18.076 ( 0.000 0.000 0.000) 0.000 18.242 ( 0.000 0.000 0.000) 0.000 18.927 ( 0.000 0.000 0.000) 0.000 19.002 ( 0.000 0.000 0.000) 0.000 19.616 ( 0.000 0.000 0.000) 0.000 22.712 ( 0.000 0.000 0.000) 0.000 23.329 ( 0.000 0.000 0.000) 0.000 ======================= Grid point 1 (2/361) ======================= q-point: ( 0.10 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.512 ( 14.462 -13.726 16.476) 25.865 0.658 ( 8.888 -24.764 26.765) 37.531 1.238 ( 48.358 -13.878 36.463) 62.134 3.397 ( 3.776 3.439 -3.271) 6.065 3.428 ( 3.017 -0.425 -7.125) 7.749 3.764 ( -3.631 2.379 1.037) 4.463 3.884 ( 9.169 1.184 0.920) 9.291 4.568 ( -0.084 -4.456 -2.872) 5.302 5.232 ( -0.737 3.707 -3.184) 4.942 5.307 ( 6.709 8.087 -10.022) 14.520 5.365 ( -1.893 2.998 -0.134) 3.548 5.508 ( 4.905 1.828 2.940) 6.004 5.981 ( -1.416 4.866 -8.112) 9.565 6.329 ( 3.303 17.760 -0.160) 18.065 6.826 ( 19.529 16.239 8.346) 26.735 7.364 ( -3.099 0.631 -6.833) 7.529 7.559 ( -14.804 -47.402 -20.088) 53.569 8.304 ( 3.063 5.588 4.678) 7.905 9.106 ( -0.506 1.556 -1.396) 2.151 9.313 ( -3.635 -5.243 -5.776) 8.606 9.977 ( 4.213 9.894 -2.278) 10.992 10.259 ( 53.550 19.585 -39.511) 69.371 10.585 ( -16.466 13.198 36.940) 42.543 11.496 ( 3.305 -0.536 -0.841) 3.452 11.735 ( 1.391 -6.253 -3.029) 7.086 12.346 ( -11.755 -43.666 -18.424) 48.830 12.507 ( -3.222 -1.013 -1.482) 3.688 14.690 ( -7.230 0.597 -10.035) 12.383 17.526 ( -30.067 39.551 70.401) 86.166 18.227 ( -9.156 -3.514 5.474) 11.231 18.343 ( -30.343 -27.794 12.042) 42.874 18.991 ( -3.281 -3.218 -1.710) 4.903 19.678 ( 5.554 -0.449 4.729) 7.308 22.097 ( 52.129 58.735 -17.255) 80.405 23.241 ( -4.761 -48.071 -34.264) 59.224 23.350 ( 2.020 -0.710 -0.276) 2.159 ======================= Grid point 2 (3/361) ======================= q-point: ( 0.20 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.016 ( 12.741 -13.289 17.007) 25.063 1.298 ( 9.669 -22.309 25.744) 35.411 2.393 ( 43.943 -11.498 31.822) 55.460 3.325 ( 0.163 2.071 -4.200) 4.686 3.447 ( 7.830 6.355 -6.091) 11.781 3.749 ( -0.086 0.675 5.692) 5.733 3.992 ( 4.422 2.192 4.580) 6.734 4.541 ( 0.646 0.640 -6.006) 6.075 5.148 ( 0.864 5.302 -6.592) 8.504 5.173 ( -0.741 8.201 -4.642) 9.453 5.301 ( -4.026 1.137 -0.663) 4.236 5.593 ( -0.921 0.635 6.975) 7.064 5.860 ( 6.086 2.517 -7.901) 10.286 6.256 ( 0.639 6.522 -0.145) 6.554 6.939 ( 4.190 8.247 -1.483) 9.369 7.219 ( -0.369 0.262 -11.726) 11.735 7.565 ( -10.778 -26.436 -3.055) 28.712 8.347 ( 3.327 8.685 5.593) 10.853 9.044 ( -2.989 2.231 -2.793) 4.660 9.249 ( -1.407 -6.280 -5.799) 8.663 9.936 ( 0.492 3.170 -0.506) 3.247 10.367 ( 26.076 7.940 -16.580) 31.905 10.681 ( -10.092 1.845 21.281) 23.625 11.560 ( 6.536 -1.158 -1.134) 6.734 11.799 ( 2.651 -12.716 -4.925) 13.892 12.358 ( -3.528 -7.627 -0.431) 8.414 12.430 ( -6.953 -2.953 -1.652) 7.733 14.387 ( -11.196 4.166 -15.277) 19.394 17.603 ( -10.468 16.034 31.757) 37.084 18.177 ( -9.520 -0.189 5.457) 10.975 18.303 ( -9.778 -10.345 0.753) 14.254 18.901 ( -6.765 -1.120 -5.361) 8.704 19.896 ( 10.003 -4.338 9.665) 14.570 22.095 ( 26.976 27.620 -12.022) 40.436 23.190 ( -4.507 -23.070 -16.744) 28.860 23.381 ( 0.410 1.198 2.941) 3.202 ======================= Grid point 3 (4/361) ======================= q-point: ( 0.30 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.474 ( 9.243 -11.899 15.947) 21.939 1.912 ( 11.153 -18.596 24.227) 32.514 3.230 ( -4.205 4.950 2.977) 7.144 3.338 ( 35.373 -4.433 13.214) 38.019 3.397 ( 4.671 6.476 -4.662) 9.246 3.845 ( 5.230 3.693 3.392) 7.246 4.117 ( 5.394 -2.160 6.905) 9.024 4.464 ( 4.601 0.989 -7.739) 9.058 4.940 ( -4.003 6.551 -10.833) 13.277 5.130 ( -2.357 5.650 5.687) 8.356 5.230 ( -5.805 -1.647 1.990) 6.354 5.624 ( -0.098 -0.324 1.687) 1.721 5.941 ( 10.329 0.520 1.003) 10.391 6.207 ( -1.296 1.426 -2.343) 3.033 6.789 ( -3.873 9.417 -7.855) 12.860 7.082 ( 0.511 0.280 -11.404) 11.419 7.630 ( -9.521 -19.505 1.788) 21.778 8.380 ( 3.152 7.721 5.120) 9.786 8.920 ( -5.413 1.929 -4.679) 7.410 9.275 ( 4.855 -3.185 -0.921) 5.879 9.919 ( -2.726 -5.308 -1.464) 6.143 10.408 ( 10.449 12.253 -6.103) 17.221 10.786 ( -1.564 -5.325 9.343) 10.867 11.661 ( 7.537 -1.169 -0.625) 7.652 11.901 ( 1.594 -15.558 -5.054) 16.436 12.267 ( -5.987 3.603 -4.495) 8.309 12.459 ( -1.039 -1.270 11.814) 11.927 13.983 ( -12.609 4.982 -17.844) 22.410 17.675 ( -4.860 6.754 14.700) 16.892 18.123 ( -7.340 2.293 8.375) 11.370 18.280 ( -1.451 -3.316 -1.826) 4.054 18.718 ( -8.348 -0.344 -8.093) 11.632 20.205 ( 9.407 -5.790 10.413) 15.181 22.073 ( 16.614 16.070 -10.399) 25.346 23.138 ( -3.216 -12.872 -9.588) 16.370 23.407 ( -0.991 0.992 3.688) 3.945 ======================= Grid point 4 (5/361) ======================= q-point: ( 0.40 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.825 ( 5.031 -8.101 10.917) 14.496 2.475 ( 11.235 -12.635 20.456) 26.539 3.113 ( -5.201 1.706 -1.699) 5.731 3.311 ( 0.766 5.955 -3.799) 7.105 3.669 ( 2.519 11.672 -8.408) 14.604 3.977 ( 19.503 0.948 2.964) 19.750 4.327 ( 3.154 -8.415 9.114) 12.800 4.542 ( 10.756 0.105 -3.701) 11.376 4.709 ( -8.605 2.753 -5.262) 10.455 5.092 ( -3.924 6.317 5.868) 9.473 5.318 ( 1.575 -8.274 12.432) 15.016 5.649 ( 1.874 -0.629 -0.471) 2.032 6.028 ( 6.347 14.360 -6.525) 17.002 6.152 ( -5.117 -11.912 -0.322) 12.969 6.558 ( -3.396 8.197 -6.489) 10.992 6.984 ( 0.660 -0.074 -5.880) 5.917 7.664 ( -6.993 -11.180 0.724) 13.207 8.420 ( 2.319 3.941 3.865) 5.987 8.777 ( -4.120 1.918 -4.503) 6.397 9.393 ( 7.206 0.150 2.739) 7.711 9.921 ( -4.563 -12.172 -2.633) 13.263 10.306 ( 0.737 14.565 -2.036) 14.725 10.941 ( 4.817 -5.989 2.942) 8.229 11.752 ( 4.778 -0.435 -0.264) 4.805 11.972 ( -3.373 -9.965 -0.509) 10.533 12.096 ( -2.986 4.021 -6.107) 7.898 12.659 ( 4.674 -0.824 15.279) 15.999 13.567 ( -11.084 4.344 -16.872) 20.650 17.689 ( -2.177 2.164 3.649) 4.768 18.141 ( -9.699 -1.211 14.584) 17.556 18.277 ( 10.196 6.952 -5.972) 13.710 18.518 ( -9.056 -4.243 -7.690) 12.616 20.454 ( 5.187 -3.725 6.655) 9.224 22.036 ( 8.324 8.040 -6.707) 13.376 23.109 ( -1.406 -6.154 -4.349) 7.666 23.421 ( -1.130 0.494 2.414) 2.711 ======================= Grid point 5 (6/361) ======================= q-point: (-0.50 0.00 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 326 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.968 ( -0.000 -0.000 0.000) 0.000 2.785 ( 0.000 -0.000 -0.000) 0.000 3.063 ( 0.000 -0.000 0.000) 0.000 3.259 ( 0.000 -0.000 0.000) 0.000 3.489 ( 0.000 -0.000 0.000) 0.000 4.170 ( 0.000 -0.000 0.000) 0.000 4.475 ( 0.000 -0.000 0.000) 0.000 4.544 ( 0.000 -0.000 0.000) 0.000 4.591 ( 0.000 0.000 0.000) 0.000 5.075 ( 0.000 -0.000 0.000) 0.000 5.570 ( 0.000 -0.000 0.000) 0.000 5.701 ( 0.000 -0.000 0.000) 0.000 5.789 ( 0.000 0.000 -0.000) 0.000 6.201 ( 0.000 -0.000 0.000) 0.000 6.457 ( 0.000 0.000 0.000) 0.000 6.959 ( 0.000 -0.000 0.000) 0.000 7.666 ( 0.000 -0.000 0.000) 0.000 8.448 ( 0.000 -0.000 0.000) 0.000 8.704 ( 0.000 -0.000 0.000) 0.000 9.473 ( 0.000 -0.000 0.000) 0.000 9.936 ( 0.000 -0.000 0.000) 0.000 10.211 ( 0.000 -0.000 0.000) 0.000 11.032 ( 0.000 -0.000 0.000) 0.000 11.784 ( 0.000 -0.000 0.000) 0.000 11.968 ( 0.000 -0.000 0.000) 0.000 12.032 ( 0.000 0.000 -0.000) 0.000 12.846 ( 0.000 -0.000 0.000) 0.000 13.314 ( 0.000 -0.000 0.000) 0.000 17.683 ( 0.000 -0.000 0.000) 0.000 18.173 ( 0.000 -0.000 0.000) 0.000 18.297 ( -0.000 -0.000 0.000) 0.000 18.407 ( 0.000 0.000 0.000) 0.000 20.547 ( 0.000 -0.000 0.000) 0.000 22.018 ( 0.000 -0.000 0.000) 0.000 23.102 ( 0.000 -0.000 0.000) 0.000 23.425 ( 0.000 -0.000 0.000) 0.000 ======================= Grid point 12 (7/361) ======================= q-point: ( 0.10 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.972 ( 21.250 0.000 19.328) 28.725 0.992 ( 1.583 0.000 37.520) 37.553 2.296 ( 48.620 0.000 33.660) 59.135 3.348 ( 4.058 0.000 -5.371) 6.731 3.504 ( 8.118 0.000 -6.841) 10.616 3.748 ( -2.234 -0.000 5.569) 6.000 4.011 ( 2.239 0.000 5.530) 5.966 4.544 ( 0.822 0.000 -3.158) 3.263 5.194 ( -0.559 -0.000 -5.395) 5.424 5.260 ( 2.640 0.000 -11.570) 11.867 5.300 ( -7.044 -0.000 -0.384) 7.054 5.614 ( 1.816 0.000 8.009) 8.212 5.839 ( -5.217 -0.000 -7.409) 9.062 6.425 ( 7.689 0.000 -8.911) 11.770 7.071 ( 4.960 0.000 -9.367) 10.599 7.146 ( -9.925 -0.000 3.254) 10.445 7.257 ( -1.718 -0.000 -1.293) 2.150 8.428 ( 3.400 0.000 3.830) 5.121 9.058 ( -5.280 -0.000 -3.150) 6.148 9.185 ( 1.466 0.000 -5.519) 5.710 9.967 ( -3.215 -0.000 -1.235) 3.444 10.426 ( 28.017 0.000 -24.250) 37.054 10.840 ( -10.349 -0.000 20.556) 23.014 11.515 ( 6.744 0.000 -7.992) 10.457 11.611 ( 1.876 0.000 -2.962) 3.506 12.243 ( 1.717 0.000 12.755) 12.870 12.433 ( -4.601 -0.000 -2.971) 5.477 14.421 ( -11.918 -0.000 -14.745) 18.959 17.846 ( -35.268 -0.000 44.369) 56.679 18.012 ( -4.542 -0.000 -0.245) 4.549 18.282 ( 6.020 0.000 -4.117) 7.293 18.892 ( -5.474 -0.000 -3.817) 6.673 19.860 ( 7.698 0.000 11.557) 13.886 22.575 ( 21.593 0.000 -35.336) 41.411 22.752 ( 2.012 0.000 0.418) 2.055 23.394 ( 1.126 0.000 2.832) 3.047 ======================= Grid point 13 (8/361) ======================= q-point: ( 0.20 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.392 ( 7.210 2.858 28.234) 29.280 1.593 ( 13.760 -15.778 25.789) 33.217 3.265 ( 33.002 -0.835 26.827) 42.538 3.366 ( 9.490 6.466 -5.365) 12.675 3.461 ( 1.414 -0.717 -5.113) 5.353 3.855 ( 7.419 -0.487 2.666) 7.898 4.097 ( 1.580 -0.646 6.562) 6.780 4.480 ( -0.608 0.772 -6.512) 6.585 5.018 ( -0.881 2.160 -19.413) 19.553 5.186 ( -6.709 0.109 1.597) 6.897 5.218 ( -3.735 1.034 2.171) 4.442 5.666 ( -1.301 5.374 2.142) 5.930 5.815 ( -0.024 -9.750 5.056) 10.982 6.396 ( 8.794 12.108 -5.472) 15.933 6.937 ( -2.737 6.916 -8.252) 11.110 7.040 ( -5.189 -4.809 -7.371) 10.217 7.299 ( -8.057 -14.066 5.389) 17.082 8.485 ( 2.048 3.425 2.592) 4.758 8.921 ( -7.897 -0.889 -3.475) 8.674 9.225 ( 8.714 -1.487 -2.018) 9.068 9.886 ( -4.459 -0.283 -3.335) 5.576 10.554 ( 24.076 1.231 -15.154) 28.474 10.857 ( -12.185 12.978 21.150) 27.645 11.564 ( 7.606 -14.624 -10.614) 19.606 11.669 ( 2.876 -2.609 2.136) 4.431 12.309 ( -6.277 1.236 -4.166) 7.634 12.435 ( 2.210 -0.954 13.795) 14.003 14.037 ( -14.262 1.379 -17.913) 22.939 17.814 ( -10.907 9.179 14.711) 20.485 17.999 ( -15.609 -10.766 11.364) 22.106 18.330 ( 13.336 3.502 -7.516) 15.704 18.730 ( -7.851 0.892 -7.623) 10.979 20.143 ( 7.941 -1.535 15.688) 17.650 22.361 ( 12.571 14.852 -20.949) 28.591 22.867 ( 1.165 -14.890 -4.526) 15.606 23.435 ( -0.446 1.187 4.121) 4.312 ======================= Grid point 14 (9/361) ======================= q-point: ( 0.30 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.765 ( 5.123 1.395 23.340) 23.937 2.211 ( 13.429 -15.749 23.375) 31.221 3.194 ( -8.660 6.272 -3.783) 11.342 3.423 ( -1.318 5.730 -1.344) 6.031 3.848 ( 17.800 7.155 -5.982) 20.095 3.975 ( 11.530 -1.419 0.841) 11.647 4.221 ( 1.746 -1.271 8.660) 8.926 4.491 ( 11.829 -5.973 -3.658) 13.747 4.743 ( -7.180 1.051 -13.953) 15.727 5.106 ( -6.477 -4.500 -2.766) 8.358 5.251 ( -2.570 1.485 15.460) 15.743 5.653 ( 0.911 0.962 1.052) 1.692 5.971 ( -0.970 -8.037 5.743) 9.926 6.297 ( 1.826 14.793 -5.525) 15.896 6.725 ( -1.494 10.785 -7.072) 12.983 6.947 ( -4.469 -3.770 -2.468) 6.346 7.385 ( -6.479 -18.460 2.761) 19.758 8.498 ( 0.829 3.944 2.150) 4.567 8.788 ( -6.225 -0.403 -3.235) 7.027 9.385 ( 12.264 -0.754 1.426) 12.370 9.782 ( -5.068 -3.970 -5.287) 8.330 10.624 ( 11.007 17.480 -5.409) 21.353 10.870 ( -0.877 0.532 11.721) 11.766 11.707 ( 5.998 -15.898 -5.430) 17.838 11.753 ( 0.923 -2.710 3.016) 4.158 12.151 ( -5.960 2.183 -5.045) 8.108 12.649 ( 4.398 -0.423 14.188) 14.860 13.618 ( -13.661 1.583 -17.333) 22.126 17.744 ( -5.458 4.009 3.421) 7.588 18.035 ( -12.134 -7.986 13.265) 19.671 18.412 ( 16.520 6.278 -7.460) 19.182 18.498 ( -7.981 0.829 -10.361) 13.104 20.426 ( 4.473 -0.043 15.186) 15.831 22.176 ( 6.447 7.528 -16.828) 19.530 22.947 ( 1.426 -10.144 -2.682) 10.589 23.457 ( -1.294 2.368 4.527) 5.271 ======================= Grid point 15 (10/361) ======================= q-point: ( 0.40 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.019 ( 3.153 5.571 13.673) 15.098 2.724 ( 6.815 -8.354 13.477) 17.259 2.993 ( -8.027 -2.728 -0.314) 8.484 3.307 ( -4.262 5.035 -1.225) 6.709 3.641 ( -4.428 12.986 -11.201) 17.712 4.129 ( 2.045 -4.286 -6.476) 8.031 4.409 ( 7.096 -5.818 3.707) 9.897 4.547 ( -2.350 0.047 -1.929) 3.041 4.603 ( 5.577 0.159 -7.949) 9.711 5.018 ( -4.327 -5.775 -7.328) 10.285 5.502 ( -0.777 -4.625 23.684) 24.144 5.679 ( 0.016 -0.564 1.840) 1.925 5.879 ( -8.228 4.838 -14.976) 17.759 6.217 ( 1.780 2.599 7.052) 7.724 6.571 ( 1.456 12.167 -3.186) 12.661 6.925 ( -4.978 -3.472 3.711) 7.114 7.523 ( 1.343 -14.872 2.014) 15.068 8.484 ( -1.169 3.427 0.528) 3.659 8.700 ( -2.608 -0.595 -0.826) 2.800 9.495 ( 1.839 2.483 -3.837) 4.927 9.791 ( 6.026 -9.479 0.597) 11.248 10.488 ( 0.921 23.272 2.126) 23.387 11.019 ( 5.177 -1.054 3.364) 6.263 11.789 ( 0.019 0.444 0.615) 0.759 11.858 ( -0.962 -12.310 2.956) 12.697 12.033 ( 0.961 0.270 -4.970) 5.069 12.844 ( 2.768 -0.174 2.631) 3.823 13.303 ( -6.591 -1.050 -4.145) 7.857 17.692 ( -2.957 0.895 1.400) 3.391 18.104 ( -7.046 -7.358 8.529) 13.286 18.250 ( -4.635 -0.062 -12.412) 13.249 18.525 ( 16.279 7.470 -4.221) 18.402 20.588 ( -0.943 4.173 10.640) 11.468 22.016 ( -0.628 -0.181 -11.667) 11.686 23.030 ( 2.618 -6.518 -0.360) 7.034 23.466 ( -0.615 3.498 3.795) 5.197 ======================= Grid point 16 (11/361) ======================= q-point: (-0.50 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.028 ( -1.688 14.242 0.445) 14.349 2.613 ( -11.612 3.583 -12.263) 17.265 3.129 ( 1.373 0.514 4.448) 4.683 3.239 ( -4.645 -1.682 3.547) 6.082 3.497 ( 1.292 -5.610 3.603) 6.792 3.943 ( -19.514 -3.118 -5.005) 20.386 4.466 ( -1.530 6.975 -11.536) 13.567 4.507 ( -0.970 -3.210 -3.119) 4.579 4.646 ( 4.053 -4.495 3.671) 7.079 4.949 ( 0.928 -8.901 -7.986) 11.995 5.463 ( -7.972 7.544 -12.050) 16.299 5.671 ( -1.313 1.502 2.697) 3.355 5.818 ( -6.863 -9.354 11.358) 16.236 6.350 ( 6.723 5.867 8.017) 11.995 6.476 ( 1.358 3.554 -1.417) 4.060 6.951 ( -5.465 -3.434 8.371) 10.571 7.708 ( 7.681 -6.792 1.281) 10.333 8.406 ( -3.601 2.940 -2.964) 5.513 8.728 ( 1.092 -3.331 3.862) 5.215 9.385 ( -3.873 -0.313 -6.715) 7.758 10.025 ( 10.867 -5.109 3.422) 12.486 10.328 ( -0.433 20.720 3.765) 21.064 11.044 ( -1.880 5.204 -0.062) 5.534 11.760 ( -4.665 0.545 0.952) 4.792 11.995 ( 2.267 -7.515 5.868) 9.800 12.063 ( 6.331 0.402 -0.329) 6.352 12.680 ( -5.594 1.490 -16.607) 17.587 13.469 ( 7.515 -6.497 16.095) 18.914 17.669 ( -0.041 -0.209 -2.780) 2.788 18.029 ( -8.688 -9.705 -8.438) 15.520 18.240 ( 6.447 0.104 3.078) 7.145 18.636 ( 14.612 7.717 -1.636) 16.605 20.564 ( -6.208 8.642 3.187) 11.107 21.896 ( -8.694 -8.067 -4.100) 12.549 23.124 ( 3.500 -3.227 2.038) 5.178 23.469 ( 1.020 4.956 2.490) 5.640 ======================= Grid point 17 (12/361) ======================= q-point: (-0.40 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.768 ( -6.754 20.348 -6.967) 22.543 2.188 ( -13.119 12.001 -17.724) 25.105 3.169 ( 1.441 -2.229 3.319) 4.249 3.269 ( -3.677 -5.791 3.475) 7.690 3.473 ( -24.552 9.024 -8.297) 27.442 3.706 ( -3.793 -11.247 -1.690) 11.989 4.162 ( -9.917 2.558 -14.044) 17.382 4.442 ( -5.301 -1.558 3.696) 6.647 4.805 ( 2.246 -8.538 5.764) 10.544 5.011 ( 3.814 -7.614 -3.647) 9.264 5.257 ( 0.714 1.444 -7.371) 7.545 5.650 ( 0.555 1.762 -2.202) 2.874 5.829 ( -15.240 -6.617 6.345) 17.785 6.350 ( 4.300 12.112 -0.365) 12.858 6.626 ( 4.711 -8.637 6.815) 11.968 7.039 ( -4.681 -4.108 12.892) 14.318 7.860 ( 10.352 2.733 0.071) 10.707 8.281 ( -5.347 -0.061 -5.116) 7.401 8.850 ( 2.141 -5.638 5.119) 7.911 9.287 ( -1.958 -1.602 -3.539) 4.351 10.136 ( 4.117 17.528 1.579) 18.074 10.265 ( -0.059 -2.029 3.724) 4.242 10.920 ( -2.778 8.452 -3.126) 9.430 11.678 ( -7.622 0.827 0.905) 7.720 12.102 ( -2.112 5.950 4.257) 7.615 12.190 ( 6.805 -3.856 3.188) 8.446 12.460 ( 3.446 -1.354 -10.931) 11.541 13.861 ( 9.998 -8.760 17.012) 21.590 17.576 ( -0.299 -4.553 -17.091) 17.689 17.990 ( -3.375 -8.703 2.584) 9.685 18.379 ( 14.591 4.384 -1.777) 15.339 18.766 ( 12.182 5.117 2.448) 13.438 20.351 ( -10.849 10.982 -3.805) 15.899 21.810 ( -17.351 -14.292 2.283) 22.596 23.233 ( 3.944 -1.382 4.384) 6.056 23.468 ( 2.953 7.505 2.313) 8.391 ======================= Grid point 18 (13/361) ======================= q-point: (-0.30 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.363 ( -9.330 24.106 -8.954) 27.355 1.664 ( -14.268 18.180 -16.709) 28.518 2.706 ( -31.897 23.569 -24.177) 46.448 3.291 ( 4.020 -2.929 5.631) 7.513 3.298 ( -7.247 -8.798 2.482) 11.666 3.699 ( -1.047 -5.329 -6.481) 8.456 3.936 ( -8.113 -4.054 -4.954) 10.334 4.508 ( -2.094 -3.304 9.776) 10.530 4.974 ( -2.070 -12.479 6.189) 14.082 5.058 ( 0.092 -5.776 -1.501) 5.969 5.249 ( 2.513 -4.836 -3.375) 6.410 5.600 ( -0.840 0.791 -5.630) 5.747 5.753 ( -9.660 -5.252 6.081) 12.564 6.309 ( 4.164 8.224 -1.379) 9.320 6.788 ( -2.363 -8.486 2.072) 9.049 7.181 ( -2.839 -3.988 13.613) 14.466 7.956 ( 12.305 14.338 3.949) 19.303 8.167 ( -5.735 -8.145 -6.156) 11.710 8.975 ( 1.437 -5.688 2.863) 6.528 9.288 ( 0.378 -3.549 1.183) 3.760 10.002 ( -2.824 15.268 0.506) 15.535 10.287 ( -5.285 -0.721 1.898) 5.662 10.773 ( 1.134 8.596 -7.227) 11.288 11.575 ( -7.169 0.698 0.932) 7.263 11.954 ( -5.615 6.471 -5.157) 10.000 12.333 ( 3.056 -5.047 4.079) 7.173 12.579 ( 13.797 6.389 8.340) 17.342 14.265 ( 9.168 -9.790 14.827) 19.993 17.365 ( -1.149 -10.805 -28.190) 30.212 18.101 ( 2.066 -5.037 5.239) 7.555 18.520 ( 22.363 10.746 -5.611) 25.437 18.937 ( 10.356 3.093 5.412) 12.088 20.019 ( -13.500 9.806 -6.803) 18.019 21.695 ( -27.217 -18.910 4.490) 33.444 23.334 ( 1.208 -2.343 1.602) 3.084 23.506 ( 7.549 12.199 9.505) 17.209 ======================= Grid point 19 (14/361) ======================= q-point: (-0.20 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.911 ( -8.538 27.059 -7.575) 29.368 1.080 ( -20.050 21.427 -14.022) 32.523 1.731 ( -23.892 39.179 -24.713) 52.120 3.295 ( -5.738 -8.304 0.702) 10.118 3.432 ( 3.389 0.187 6.517) 7.348 3.684 ( 0.425 -6.333 -2.733) 6.911 3.841 ( -6.168 -3.852 -2.579) 7.715 4.622 ( 1.322 0.103 8.736) 8.836 5.070 ( -10.562 -15.013 1.739) 18.438 5.122 ( 0.941 -8.340 1.124) 8.468 5.286 ( -0.484 -6.431 -1.481) 6.617 5.490 ( -6.375 -0.262 -2.083) 6.711 5.827 ( 2.220 -6.715 3.767) 8.013 6.287 ( 4.559 6.300 -1.799) 7.982 6.700 ( -14.772 -4.128 -6.399) 16.619 7.335 ( 1.188 -2.936 8.508) 9.078 8.113 ( 10.579 17.898 22.138) 30.370 8.132 ( 3.404 -11.750 -10.135) 15.886 9.055 ( 1.590 -4.456 0.045) 4.732 9.339 ( -5.705 -8.717 0.840) 10.452 9.788 ( -11.590 9.909 -3.100) 15.561 10.188 ( -7.469 4.325 0.589) 8.651 10.631 ( 2.570 8.480 -8.404) 12.213 11.503 ( -3.930 0.264 0.678) 3.997 11.792 ( -3.109 2.734 -4.401) 6.043 12.452 ( 1.914 -3.793 3.009) 5.206 12.882 ( 17.174 12.793 23.100) 31.499 14.611 ( 6.490 -9.154 11.414) 16.006 17.067 ( -1.028 -14.446 -40.773) 43.269 18.212 ( 2.868 -1.589 1.691) 3.689 18.709 ( 32.172 13.737 -6.432) 35.569 19.085 ( 7.297 6.755 4.254) 10.815 19.710 ( -10.687 3.739 -4.368) 12.136 21.461 ( -39.910 -20.853 2.981) 45.128 23.343 ( -0.409 -0.443 -1.142) 1.291 23.700 ( 10.947 11.405 18.518) 24.348 ======================= Grid point 20 (15/361) ======================= q-point: (-0.10 0.10 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.490 ( 0.000 27.818 0.000) 27.818 0.541 ( 0.000 30.750 0.000) 30.750 0.963 ( 0.000 54.276 0.000) 54.276 3.319 ( -0.000 -6.003 -0.000) 6.003 3.512 ( 0.000 0.743 0.000) 0.743 3.720 ( -0.000 -5.459 -0.000) 5.459 3.792 ( -0.000 -1.974 -0.000) 1.974 4.860 ( -0.000 -4.912 -0.000) 4.912 4.876 ( -0.000 -3.173 -0.000) 3.173 5.226 ( -0.000 -8.286 -0.000) 8.286 5.319 ( -0.000 -4.959 -0.000) 4.959 5.421 ( 0.000 0.880 0.000) 0.880 5.938 ( -0.000 -7.011 -0.000) 7.011 6.263 ( 0.000 10.022 0.000) 10.022 6.461 ( 0.000 0.405 0.000) 0.405 7.422 ( -0.000 -1.766 -0.000) 1.766 8.174 ( -0.000 -10.591 -0.000) 10.591 8.502 ( -0.000 -0.712 -0.000) 0.712 9.131 ( 0.000 0.446 0.000) 0.446 9.142 ( -0.000 -7.666 -0.000) 7.666 9.508 ( 0.000 17.209 0.000) 17.209 10.080 ( 0.000 6.098 0.000) 6.098 10.522 ( 0.000 7.636 0.000) 7.636 11.478 ( 0.000 0.149 0.000) 0.149 11.727 ( 0.000 1.204 0.000) 1.204 12.511 ( -0.000 -2.549 -0.000) 2.549 13.280 ( -0.000 -3.329 -0.000) 3.329 14.852 ( -0.000 -9.743 -0.000) 9.743 16.708 ( 0.000 0.440 0.000) 0.440 18.243 ( 0.000 0.066 0.000) 0.066 18.951 ( 0.000 2.688 0.000) 2.688 19.082 ( 0.000 8.817 0.000) 8.817 19.609 ( -0.000 -0.844 -0.000) 0.844 21.121 ( -0.000 -3.196 -0.000) 3.196 23.331 ( 0.000 0.167 0.000) 0.167 23.947 ( -0.000 -0.639 -0.000) 0.639 ======================= Grid point 23 (16/361) ======================= q-point: ( 0.20 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.822 ( -2.085 -0.000 34.445) 34.508 2.023 ( 21.514 0.000 18.184) 28.169 3.267 ( -11.469 -0.000 -5.942) 12.917 3.474 ( -0.067 -0.000 2.571) 2.572 3.904 ( 30.482 0.000 -4.931) 30.878 3.948 ( 4.202 0.000 -3.256) 5.316 4.274 ( 5.588 0.000 17.939) 18.789 4.385 ( -0.145 -0.000 -6.751) 6.752 4.749 ( -1.426 -0.000 -22.337) 22.383 5.056 ( -8.205 -0.000 -1.846) 8.410 5.274 ( -3.454 -0.000 12.822) 13.279 5.667 ( -1.019 -0.000 0.479) 1.126 5.894 ( 1.751 0.000 8.812) 8.984 6.454 ( -1.161 -0.000 -8.550) 8.629 6.888 ( 3.604 0.000 -2.425) 4.344 6.892 ( -4.853 -0.000 -0.701) 4.903 7.146 ( -10.793 -0.000 2.340) 11.043 8.536 ( 0.344 0.000 1.507) 1.546 8.781 ( -6.808 -0.000 -2.192) 7.152 9.378 ( 14.377 0.000 1.187) 14.426 9.752 ( -5.551 -0.000 -7.035) 8.961 10.735 ( 21.188 0.000 -8.491) 22.826 11.004 ( -13.505 -0.000 22.139) 25.933 11.465 ( 8.877 0.000 -10.253) 13.562 11.745 ( 3.710 0.000 2.071) 4.249 12.170 ( -6.770 -0.000 -4.693) 8.238 12.645 ( 4.467 0.000 13.860) 14.562 13.630 ( -14.545 -0.000 -17.473) 22.735 17.801 ( -9.592 -0.000 1.672) 9.736 17.939 ( -7.182 -0.000 13.373) 15.179 18.470 ( 17.477 0.000 -8.143) 19.281 18.509 ( -9.145 -0.000 -10.573) 13.980 20.430 ( 4.325 0.000 18.681) 19.175 22.257 ( 4.451 0.000 -23.345) 23.766 22.838 ( 3.616 0.000 1.026) 3.759 23.480 ( -1.330 -0.000 4.839) 5.018 ======================= Grid point 24 (17/361) ======================= q-point: ( 0.30 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.136 ( 0.568 6.116 25.483) 26.213 2.543 ( 15.899 -8.778 16.849) 24.774 2.996 ( -14.884 1.171 -5.962) 16.076 3.405 ( -6.935 4.491 -1.436) 8.386 3.823 ( -9.564 5.282 -7.823) 13.438 4.058 ( 8.475 -2.232 -16.700) 18.860 4.351 ( 7.530 1.078 0.098) 7.607 4.476 ( -2.652 -7.288 -0.420) 7.767 4.620 ( 9.536 1.275 -6.978) 11.885 4.926 ( -6.651 -3.233 -5.688) 9.330 5.454 ( -1.981 -1.145 23.036) 23.149 5.676 ( -0.097 -0.040 1.450) 1.453 5.919 ( -5.594 0.543 -8.219) 9.957 6.277 ( -4.426 2.776 0.329) 5.235 6.850 ( 4.495 18.345 -1.922) 18.985 6.864 ( -9.537 -1.923 8.463) 12.895 7.203 ( 2.469 -20.318 2.442) 20.613 8.540 ( -1.026 2.213 1.588) 2.910 8.685 ( -4.665 -0.849 -0.896) 4.826 9.553 ( 0.487 3.803 -6.850) 7.850 9.658 ( 11.171 -5.644 0.734) 12.537 10.870 ( 9.669 13.644 -1.362) 16.778 11.035 ( -2.254 6.133 13.939) 15.395 11.578 ( 5.128 -16.353 -2.191) 17.278 11.797 ( 1.228 0.241 0.571) 1.376 12.039 ( -3.179 0.240 -4.025) 5.135 12.841 ( 4.118 -0.114 4.252) 5.920 13.287 ( -10.149 -0.602 -6.760) 12.209 17.709 ( -6.267 0.804 3.048) 7.015 17.995 ( -2.992 -3.734 2.057) 5.209 18.265 ( -7.032 0.837 -7.817) 10.548 18.615 ( 18.560 2.573 -7.921) 20.343 20.660 ( -1.114 2.890 17.789) 18.057 22.012 ( -1.673 -0.193 -20.725) 20.793 22.931 ( 4.588 -3.550 1.687) 6.041 23.514 ( -0.783 1.552 4.871) 5.172 ======================= Grid point 25 (18/361) ======================= q-point: (-0.60 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.283 ( 0.482 13.395 10.383) 16.955 2.644 ( -13.435 0.797 -7.389) 15.353 3.041 ( 6.555 -8.516 13.841) 17.524 3.247 ( -8.004 1.614 0.665) 8.192 3.516 ( -10.246 4.925 -7.277) 13.498 3.870 ( -12.406 -4.508 -10.172) 16.664 4.446 ( 5.552 -3.124 -6.383) 9.018 4.546 ( 0.645 -3.030 -0.147) 3.102 4.584 ( 1.246 3.243 -7.352) 8.131 4.812 ( -2.243 -6.285 -6.303) 9.179 5.571 ( -12.673 4.670 -11.056) 17.454 5.689 ( -0.553 0.378 1.635) 1.767 5.699 ( -5.413 -4.418 14.049) 15.690 6.338 ( 3.606 -1.647 6.374) 7.507 6.691 ( -2.833 14.078 0.702) 14.378 6.893 ( -4.060 -1.646 7.809) 8.954 7.482 ( 7.647 -16.409 2.699) 18.303 8.492 ( -3.117 5.521 0.686) 6.377 8.668 ( -1.616 -3.478 2.473) 4.563 9.390 ( -2.639 0.640 -10.209) 10.564 9.939 ( 14.989 -3.496 3.889) 15.875 10.768 ( 0.514 26.002 6.379) 26.778 11.116 ( 1.092 3.158 2.522) 4.186 11.753 ( -6.346 -6.306 5.846) 10.687 11.813 ( 5.127 -8.485 -1.540) 10.033 12.041 ( 7.425 -1.853 -0.478) 7.667 12.706 ( -5.945 1.319 -17.207) 18.253 13.363 ( 4.452 -4.883 15.310) 16.675 17.680 ( -1.785 1.361 0.432) 2.286 17.878 ( -7.814 -6.957 -11.207) 15.331 18.245 ( 4.525 0.369 5.532) 7.157 18.746 ( 17.761 4.360 -7.267) 19.679 20.734 ( -6.791 9.547 12.397) 17.057 21.758 ( -8.406 -7.192 -15.351) 18.921 23.054 ( 4.946 -3.671 2.409) 6.614 23.548 ( 1.113 3.442 4.385) 5.684 ======================= Grid point 26 (19/361) ======================= q-point: (-0.50 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.141 ( -4.354 20.921 -1.849) 21.449 2.332 ( -13.078 5.270 -11.017) 17.894 3.108 ( -9.633 -4.306 3.199) 11.026 3.246 ( -2.627 2.517 3.933) 5.358 3.469 ( 0.847 -14.024 0.412) 14.055 3.610 ( -16.755 3.643 -1.207) 17.189 4.236 ( -10.151 7.326 -20.821) 24.294 4.411 ( -2.266 -1.774 -3.003) 4.159 4.654 ( -2.419 -8.170 4.980) 9.869 4.870 ( 4.615 -8.543 -2.520) 10.032 5.276 ( -7.032 0.527 -9.345) 11.707 5.670 ( 1.635 0.792 -3.776) 4.190 5.763 ( -12.628 -1.570 11.399) 17.084 6.486 ( 3.188 -3.476 1.756) 5.033 6.577 ( 1.057 9.306 3.464) 9.986 6.966 ( -4.644 -3.163 11.684) 12.965 7.723 ( 7.215 -13.979 -2.701) 15.961 8.390 ( -3.665 8.933 1.472) 9.767 8.743 ( -0.440 -6.073 4.842) 7.779 9.260 ( -0.069 -0.900 -8.403) 8.451 10.180 ( 10.505 -1.937 2.006) 10.869 10.610 ( 0.190 28.405 6.490) 29.137 11.054 ( -3.008 6.409 -1.541) 7.245 11.690 ( -8.156 0.498 1.512) 8.310 12.008 ( 2.650 -11.714 5.163) 13.073 12.221 ( 9.059 1.938 2.898) 9.707 12.425 ( -0.468 -1.671 -14.658) 14.760 13.699 ( 7.600 -8.851 15.606) 19.485 17.514 ( -4.782 -2.573 -19.268) 20.019 17.863 ( -0.759 -5.480 7.269) 9.135 18.424 ( 12.311 1.350 5.151) 13.413 18.863 ( 16.267 4.935 -5.395) 17.835 20.582 ( -11.514 14.998 2.068) 19.020 21.563 ( -15.902 -14.143 -5.930) 22.092 23.181 ( 4.448 -3.297 2.823) 6.215 23.590 ( 3.614 5.611 4.285) 7.931 ======================= Grid point 27 (20/361) ======================= q-point: (-0.40 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.805 ( -5.910 25.371 -7.929) 27.231 1.932 ( -15.878 13.075 -9.119) 22.499 3.072 ( -13.062 -1.930 0.635) 13.219 3.150 ( -19.180 5.422 -1.605) 19.996 3.304 ( 4.797 8.136 -4.161) 10.321 3.572 ( 1.559 -8.293 -4.491) 9.559 3.870 ( -9.159 -2.188 -10.083) 13.796 4.430 ( -3.615 -5.119 8.682) 10.708 4.754 ( -5.024 -12.007 5.344) 14.070 4.953 ( 1.279 -6.956 -3.212) 7.768 5.142 ( -2.685 -6.537 -7.042) 9.976 5.613 ( -5.711 1.083 -1.541) 6.014 5.717 ( -2.744 0.041 2.504) 3.716 6.454 ( 2.637 7.116 -3.042) 8.175 6.666 ( -1.064 -4.688 4.584) 6.642 7.094 ( -3.822 -5.347 13.564) 15.073 7.853 ( 4.298 -14.374 -9.841) 17.942 8.300 ( -0.817 12.691 6.860) 14.450 8.853 ( -0.720 -7.613 4.185) 8.717 9.210 ( 1.417 -3.452 -5.606) 6.734 10.293 ( 3.917 1.277 -0.274) 4.129 10.423 ( -0.932 28.983 5.020) 29.429 10.925 ( -1.276 7.974 -4.076) 9.045 11.584 ( -7.909 0.337 0.840) 7.960 12.051 ( -6.009 4.684 -9.383) 12.087 12.209 ( 2.776 -9.478 3.223) 10.389 12.615 ( 15.518 -1.390 8.952) 17.968 14.063 ( 7.034 -12.378 12.829) 19.164 17.224 ( -5.806 -5.606 -23.350) 24.706 18.028 ( 3.660 -3.167 9.057) 10.269 18.658 ( 19.505 5.433 1.704) 20.319 19.000 ( 14.543 3.617 -0.262) 14.989 20.236 ( -15.040 14.788 -5.777) 21.869 21.399 ( -23.102 -15.717 0.123) 27.942 23.287 ( 2.509 -2.699 1.808) 4.105 23.665 ( 6.600 6.421 6.352) 11.187 ======================= Grid point 28 (21/361) ======================= q-point: (-0.30 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.381 ( -8.278 24.886 -9.400) 27.860 1.456 ( -15.524 23.306 -6.390) 28.723 2.462 ( -13.297 41.578 -11.164) 45.057 3.111 ( -6.644 -12.494 0.235) 14.153 3.414 ( 5.844 -3.713 5.338) 8.743 3.569 ( -0.072 -5.184 -5.892) 7.849 3.754 ( -5.171 -5.620 -2.327) 7.983 4.569 ( -1.737 -5.524 12.039) 13.360 4.826 ( -7.229 -12.752 1.187) 14.706 4.972 ( -1.097 -8.197 -2.272) 8.576 5.134 ( -0.800 -10.925 -4.915) 12.006 5.495 ( -6.583 0.778 -0.397) 6.640 5.763 ( 4.564 -1.741 0.530) 4.913 6.410 ( 4.954 6.851 -2.300) 8.762 6.646 ( -9.861 -1.877 -0.753) 10.067 7.255 ( -0.941 -6.129 10.051) 11.810 7.882 ( 0.278 -14.609 -10.089) 17.757 8.352 ( 6.221 10.133 13.030) 17.640 8.940 ( -1.177 -8.137 0.798) 8.261 9.194 ( -1.911 -4.990 -4.955) 7.287 10.188 ( -1.546 29.906 2.001) 30.013 10.274 ( -1.012 4.720 -0.803) 4.893 10.792 ( 0.193 9.074 -4.361) 10.069 11.503 ( -4.573 -0.241 0.517) 4.609 11.847 ( -3.346 3.527 -6.477) 8.099 12.356 ( 1.616 -7.444 2.915) 8.156 12.956 ( 12.559 -1.283 13.022) 18.137 14.391 ( 4.524 -14.927 8.523) 17.774 16.919 ( -5.009 -4.431 -22.752) 23.714 18.188 ( 3.484 -1.049 5.149) 6.305 18.890 ( 22.637 8.157 -2.192) 24.161 19.195 ( 13.170 4.900 6.064) 15.305 19.824 ( -15.786 9.646 -7.617) 20.007 21.189 ( -25.539 -12.654 0.737) 28.512 23.331 ( 0.443 -0.869 0.039) 0.976 23.811 ( 7.371 3.245 8.291) 11.558 ======================= Grid point 29 (22/361) ======================= q-point: (-0.20 0.20 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.969 ( 0.000 26.881 0.000) 26.881 1.072 ( 0.000 29.964 0.000) 29.964 1.883 ( 0.000 50.479 0.000) 50.479 3.168 ( -0.000 -11.019 -0.000) 11.019 3.529 ( 0.000 1.128 0.000) 1.128 3.592 ( -0.000 -9.332 -0.000) 9.332 3.733 ( -0.000 -4.553 -0.000) 4.553 4.752 ( -0.000 -6.866 -0.000) 6.866 4.785 ( -0.000 -7.224 -0.000) 7.224 5.047 ( -0.000 -11.399 -0.000) 11.399 5.189 ( -0.000 -9.845 -0.000) 9.845 5.437 ( 0.000 0.907 0.000) 0.907 5.840 ( -0.000 -4.341 -0.000) 4.341 6.426 ( 0.000 8.399 0.000) 8.399 6.476 ( 0.000 1.383 0.000) 1.383 7.367 ( -0.000 -4.885 -0.000) 4.885 7.943 ( -0.000 -14.675 -0.000) 14.675 8.502 ( 0.000 1.107 0.000) 1.107 8.989 ( -0.000 -8.909 -0.000) 8.909 9.135 ( -0.000 -0.029 -0.000) 0.029 9.921 ( 0.000 28.860 0.000) 28.860 10.202 ( 0.000 6.994 0.000) 6.994 10.682 ( 0.000 9.762 0.000) 9.762 11.478 ( -0.000 -0.310 -0.000) 0.310 11.760 ( 0.000 2.566 0.000) 2.566 12.442 ( -0.000 -5.548 -0.000) 5.548 13.198 ( -0.000 -5.809 -0.000) 5.809 14.620 ( -0.000 -15.894 -0.000) 15.894 16.719 ( 0.000 0.742 0.000) 0.742 18.245 ( 0.000 0.126 0.000) 0.126 19.017 ( 0.000 4.722 0.000) 4.722 19.292 ( 0.000 14.588 0.000) 14.588 19.586 ( -0.000 -1.776 -0.000) 1.776 21.040 ( -0.000 -5.970 -0.000) 5.970 23.334 ( 0.000 0.062 0.000) 0.062 23.932 ( -0.000 -0.981 -0.000) 0.981 ======================= Grid point 34 (23/361) ======================= q-point: ( 0.30 0.30 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.423 ( -0.658 -0.000 16.763) 16.775 2.651 ( -14.391 -0.000 -6.191) 15.666 2.941 ( 12.166 0.000 12.350) 17.336 3.269 ( -11.559 -0.000 -2.077) 11.744 3.567 ( -18.561 -0.000 -4.925) 19.204 3.825 ( -5.533 -0.000 -16.579) 17.478 4.420 ( 8.159 0.000 -6.960) 10.724 4.492 ( -1.039 -0.000 5.269) 5.370 4.643 ( 5.445 0.000 -8.099) 9.759 4.744 ( -6.157 -0.000 -7.578) 9.764 5.614 ( -15.241 -0.000 -13.663) 20.469 5.662 ( -5.309 -0.000 19.554) 20.262 5.688 ( 1.540 0.000 -1.143) 1.918 6.325 ( 2.695 0.000 5.322) 5.966 6.799 ( -17.545 -0.000 12.427) 21.500 6.957 ( 7.391 0.000 -7.175) 10.301 7.267 ( 9.370 0.000 7.631) 12.085 8.561 ( -1.482 -0.000 2.926) 3.280 8.619 ( -4.021 -0.000 1.135) 4.178 9.397 ( -2.517 -0.000 -11.380) 11.655 9.909 ( 16.853 0.000 3.732) 17.261 11.056 ( 5.339 0.000 3.366) 6.312 11.178 ( -6.734 -0.000 12.908) 14.558 11.554 ( 6.482 0.000 -1.219) 6.595 11.792 ( -1.323 -0.000 -1.588) 2.067 12.022 ( 6.088 0.000 0.123) 6.089 12.719 ( -5.882 -0.000 -17.348) 18.318 13.318 ( 3.284 0.000 14.979) 15.335 17.701 ( -2.788 -0.000 6.500) 7.073 17.808 ( -6.488 -0.000 -17.371) 18.543 18.249 ( 3.310 0.000 6.506) 7.299 18.784 ( 18.507 0.000 -8.813) 20.498 20.833 ( -6.956 -0.000 17.896) 19.200 21.684 ( -8.180 -0.000 -22.091) 23.557 23.019 ( 5.587 0.000 3.043) 6.362 23.579 ( 1.114 0.000 4.756) 4.884 ======================= Grid point 35 (24/361) ======================= q-point: (-0.60 0.30 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.374 ( -14.170 2.316 -2.719) 14.613 2.463 ( -0.444 10.821 -2.091) 11.030 3.065 ( -12.669 0.288 -0.187) 12.673 3.227 ( -5.069 -11.061 -2.512) 12.423 3.300 ( -3.068 1.977 5.944) 6.975 3.621 ( -10.363 -0.949 0.809) 10.437 4.369 ( -3.641 2.126 -11.198) 11.966 4.427 ( -2.771 5.677 -10.128) 11.937 4.557 ( -4.457 0.182 2.903) 5.322 4.703 ( 2.190 -10.766 -5.214) 12.161 5.276 ( -12.004 -0.245 -9.636) 15.395 5.689 ( 2.946 1.182 -3.158) 4.478 5.744 ( -10.989 -0.944 12.398) 16.594 6.439 ( 4.294 -1.145 4.162) 6.088 6.698 ( -10.885 2.737 7.326) 13.404 6.970 ( 3.136 3.263 0.602) 4.565 7.487 ( 6.410 -9.949 1.024) 11.879 8.532 ( -2.786 7.008 3.942) 8.510 8.642 ( -2.017 -5.680 4.275) 7.390 9.254 ( 0.720 -0.009 -10.617) 10.642 10.157 ( 13.041 -0.661 1.908) 13.196 11.079 ( 1.692 19.589 7.573) 21.070 11.139 ( -6.179 5.110 2.712) 8.465 11.673 ( -7.993 -5.508 6.384) 11.618 11.771 ( 5.927 -9.899 -4.548) 12.402 12.222 ( 15.200 -0.750 5.819) 16.293 12.417 ( -6.036 0.239 -17.502) 18.515 13.583 ( 6.223 -3.673 14.564) 16.258 17.485 ( -7.439 -0.801 -20.274) 21.611 17.800 ( 1.688 -1.771 9.720) 10.023 18.438 ( 10.626 0.417 8.846) 13.833 18.921 ( 17.461 1.613 -8.681) 19.567 20.838 ( -12.051 11.885 10.996) 20.184 21.328 ( -14.046 -10.914 -17.164) 24.719 23.138 ( 5.052 -1.374 3.219) 6.146 23.656 ( 3.491 1.881 4.316) 5.862 ======================= Grid point 36 (25/361) ======================= q-point: (-0.50 0.30 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.125 ( -11.833 9.230 -4.328) 15.619 2.223 ( -3.137 20.816 -6.740) 22.104 2.910 ( -11.818 -8.466 -1.597) 14.624 3.099 ( -10.612 -9.853 -0.475) 14.489 3.460 ( 4.490 -3.464 1.346) 5.828 3.535 ( -9.893 6.237 8.566) 14.496 3.963 ( -5.683 15.180 -20.845) 26.405 4.351 ( -3.095 -3.377 3.019) 5.486 4.576 ( -7.385 -7.574 6.817) 12.585 4.776 ( 1.106 -13.463 -5.285) 14.506 5.058 ( -7.907 -2.730 -7.829) 11.458 5.643 ( -8.257 2.098 1.740) 8.695 5.719 ( 0.222 -0.318 -0.708) 0.807 6.527 ( 3.576 1.470 -0.193) 3.871 6.644 ( -4.570 1.376 5.475) 7.264 7.018 ( -1.474 -2.630 6.703) 7.350 7.616 ( 3.322 -11.449 -6.531) 13.593 8.489 ( -1.594 8.925 6.708) 11.278 8.729 ( -1.541 -6.400 4.959) 8.242 9.173 ( 2.836 -1.095 -8.457) 8.987 10.306 ( 6.851 0.468 -0.144) 6.869 10.953 ( -1.649 29.163 8.922) 30.542 11.038 ( -0.723 5.167 -4.203) 6.699 11.587 ( -8.558 0.030 0.761) 8.592 11.979 ( 3.060 -15.979 3.428) 16.626 12.123 ( -5.299 2.530 -13.912) 15.101 12.569 ( 16.408 -2.807 8.760) 18.810 13.871 ( 5.675 -8.528 11.010) 15.039 17.158 ( -7.387 -2.190 -19.925) 21.363 17.989 ( 4.874 -1.439 11.024) 12.139 18.725 ( 16.609 2.509 9.393) 19.245 19.047 ( 16.127 1.631 -5.952) 17.268 20.522 ( -15.478 17.320 -6.965) 24.250 21.125 ( -19.106 -15.939 -1.899) 24.954 23.247 ( 3.484 -1.724 2.595) 4.674 23.744 ( 5.239 2.841 4.149) 7.262 ======================= Grid point 37 (26/361) ======================= q-point: (-0.40 0.30 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.762 ( -10.373 19.818 -6.694) 23.349 1.899 ( -5.225 25.277 -4.647) 26.227 2.868 ( -6.757 -14.447 -1.366) 16.007 3.060 ( -9.114 14.637 7.302) 18.725 3.314 ( -1.109 1.902 -8.459) 8.740 3.556 ( 3.806 3.700 -0.102) 5.309 3.672 ( -3.136 -1.866 -6.336) 7.312 4.454 ( -2.579 -6.989 11.911) 14.049 4.628 ( -5.868 -9.618 3.803) 11.891 4.828 ( -1.883 -10.269 -3.827) 11.120 4.929 ( -3.023 -9.960 -8.427) 13.392 5.514 ( -7.422 1.238 -0.093) 7.525 5.742 ( 3.634 -0.855 -1.407) 3.990 6.518 ( 5.231 5.533 -3.864) 8.539 6.634 ( -6.866 0.248 4.421) 8.170 7.130 ( -1.715 -7.739 7.609) 10.988 7.649 ( 1.243 -11.297 -8.524) 14.206 8.504 ( 1.365 7.570 8.572) 11.517 8.808 ( -1.884 -6.377 2.401) 7.069 9.141 ( 2.077 -1.914 -5.851) 6.497 10.341 ( 1.705 2.834 -0.781) 3.398 10.748 ( -0.715 32.644 4.922) 33.021 10.931 ( 0.122 6.678 -4.085) 7.829 11.496 ( -5.093 -0.517 0.058) 5.120 11.907 ( -3.340 3.027 -7.753) 8.968 12.178 ( 1.448 -13.359 2.719) 13.710 12.899 ( 10.992 -4.117 8.486) 14.484 14.133 ( 3.415 -13.285 6.357) 15.118 16.874 ( -5.424 -1.282 -15.040) 16.039 18.175 ( 4.000 -0.496 7.152) 8.209 19.016 ( 18.049 6.494 2.330) 19.323 19.238 ( 14.746 -0.006 5.646) 15.790 20.036 ( -17.303 13.569 -12.330) 25.210 20.981 ( -18.205 -11.453 1.009) 21.531 23.314 ( 1.368 -0.949 1.097) 1.993 23.846 ( 4.892 1.183 3.930) 6.385 ======================= Grid point 38 (27/361) ======================= q-point: (-0.30 0.30 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.425 ( 0.000 25.092 0.000) 25.092 1.584 ( 0.000 28.371 0.000) 28.371 2.708 ( 0.000 42.950 0.000) 42.950 2.942 ( -0.000 -14.596 -0.000) 14.596 3.385 ( -0.000 -14.507 -0.000) 14.507 3.554 ( 0.000 2.193 0.000) 2.193 3.650 ( -0.000 -4.352 -0.000) 4.352 4.635 ( -0.000 -6.479 -0.000) 6.479 4.635 ( -0.000 -9.213 -0.000) 9.213 4.855 ( -0.000 -9.878 -0.000) 9.878 4.978 ( -0.000 -13.982 -0.000) 13.982 5.452 ( 0.000 0.704 0.000) 0.704 5.781 ( -0.000 -2.495 -0.000) 2.495 6.515 ( 0.000 3.276 0.000) 3.276 6.549 ( 0.000 5.496 0.000) 5.496 7.247 ( -0.000 -8.682 -0.000) 8.682 7.699 ( -0.000 -12.391 -0.000) 12.391 8.545 ( 0.000 3.707 0.000) 3.707 8.852 ( -0.000 -6.519 -0.000) 6.519 9.127 ( -0.000 -0.894 -0.000) 0.894 10.308 ( 0.000 4.958 0.000) 4.958 10.478 ( 0.000 33.735 0.000) 33.735 10.842 ( 0.000 8.060 0.000) 8.060 11.467 ( -0.000 -0.847 -0.000) 0.847 11.811 ( 0.000 3.066 0.000) 3.066 12.308 ( -0.000 -10.184 -0.000) 10.184 13.088 ( -0.000 -6.416 -0.000) 6.416 14.329 ( -0.000 -16.365 -0.000) 16.365 16.733 ( 0.000 0.779 0.000) 0.779 18.247 ( 0.000 0.143 0.000) 0.143 19.109 ( 0.000 5.608 0.000) 5.608 19.546 ( -0.000 -2.700 -0.000) 2.700 19.567 ( 0.000 16.037 0.000) 16.037 20.917 ( -0.000 -7.827 -0.000) 7.827 23.332 ( -0.000 -0.214 -0.000) 0.214 23.915 ( -0.000 -0.901 -0.000) 0.901 ======================= Grid point 45 (28/361) ======================= q-point: ( 0.40 -0.60 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.216 ( -8.795 -0.000 0.961) 8.848 2.445 ( -0.376 -0.000 -8.945) 8.953 2.841 ( -13.271 -0.000 -5.664) 14.430 2.952 ( -12.669 -0.000 -1.996) 12.825 3.436 ( 4.124 0.000 3.640) 5.501 3.562 ( -10.042 -0.000 11.547) 15.303 4.192 ( -6.075 -0.000 -9.361) 11.160 4.319 ( -0.714 -0.000 -9.387) 9.414 4.531 ( -0.849 -0.000 -5.024) 5.095 4.567 ( -7.842 -0.000 6.459) 10.159 5.037 ( -8.805 -0.000 -7.610) 11.638 5.669 ( -13.066 -0.000 5.092) 14.023 5.710 ( 4.893 0.000 -4.145) 6.413 6.539 ( 4.187 0.000 3.351) 5.362 6.659 ( -7.851 -0.000 6.734) 10.344 7.001 ( 1.361 0.000 -1.955) 2.383 7.504 ( 2.966 0.000 -2.297) 3.752 8.610 ( -2.211 -0.000 4.888) 5.365 8.631 ( -1.231 -0.000 6.764) 6.875 9.164 ( 3.005 0.000 -9.264) 9.739 10.310 ( 7.857 0.000 -0.126) 7.858 11.076 ( -3.420 -0.000 -2.285) 4.113 11.321 ( -1.496 -0.000 12.084) 12.177 11.582 ( -9.626 -0.000 2.905) 10.055 11.744 ( 6.834 0.000 -3.975) 7.906 12.147 ( -5.405 -0.000 -14.302) 15.289 12.542 ( 16.645 0.000 8.947) 18.897 13.793 ( 5.212 0.000 10.331) 11.571 17.140 ( -7.757 -0.000 -18.788) 20.327 17.976 ( 5.275 0.000 11.643) 12.782 18.748 ( 15.647 0.000 12.457) 20.001 19.060 ( 16.340 0.000 -8.114) 18.244 20.796 ( -17.477 -0.000 -22.296) 28.329 20.866 ( -15.624 -0.000 12.034) 19.722 23.231 ( 3.826 0.000 2.908) 4.806 23.768 ( 4.711 0.000 3.460) 5.845 ======================= Grid point 47 (29/361) ======================= q-point: (-0.50 0.40 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.068 ( -6.371 13.189 -1.526) 14.726 2.276 ( -1.081 14.368 -5.994) 15.606 2.639 ( -9.218 -8.493 -3.964) 13.146 2.919 ( -3.193 -13.263 3.914) 14.192 3.449 ( -1.505 2.873 -3.201) 4.557 3.576 ( -5.878 -1.261 8.281) 10.233 3.910 ( -0.312 22.561 -9.834) 24.613 4.323 ( 0.139 -9.458 3.451) 10.069 4.491 ( -2.579 -6.056 -1.618) 6.778 4.610 ( -6.211 -9.230 7.660) 13.507 4.840 ( -5.135 -1.833 -10.498) 11.830 5.532 ( -8.599 0.593 -0.328) 8.626 5.731 ( 3.287 -0.401 -2.346) 4.058 6.602 ( 3.690 3.541 -0.289) 5.122 6.641 ( -4.566 0.190 4.701) 6.556 7.010 ( -0.573 -4.709 0.669) 4.790 7.509 ( 0.810 -4.187 -3.984) 5.836 8.615 ( -0.529 4.676 5.114) 6.950 8.719 ( -1.033 -3.744 4.833) 6.200 9.117 ( 2.681 -0.806 -6.384) 6.971 10.373 ( 2.870 0.898 -0.589) 3.065 11.005 ( -1.924 2.392 -1.354) 3.355 11.287 ( 0.690 25.299 4.870) 25.773 11.488 ( -5.485 -0.291 -0.237) 5.498 11.888 ( 2.596 -17.359 0.082) 17.553 11.947 ( -3.630 0.761 -7.439) 8.313 12.842 ( 10.630 -1.884 6.986) 12.859 13.964 ( 2.946 -5.256 5.365) 8.068 16.862 ( -5.398 -0.251 -12.241) 13.381 18.169 ( 4.241 -0.142 8.058) 9.107 19.118 ( 16.782 4.970 8.295) 19.369 19.207 ( 13.802 -3.046 1.653) 14.231 20.250 ( -18.188 8.712 -18.368) 27.278 20.803 ( -13.847 -7.338 4.764) 16.379 23.302 ( 1.939 -0.420 1.699) 2.612 23.859 ( 3.644 0.330 2.198) 4.268 ======================= Grid point 48 (30/361) ======================= q-point: (-0.40 0.40 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.837 ( 0.000 21.517 0.000) 21.517 2.050 ( 0.000 23.814 0.000) 23.814 2.671 ( -0.000 -15.581 -0.000) 15.581 3.092 ( -0.000 -18.074 -0.000) 18.074 3.301 ( 0.000 19.456 0.000) 19.456 3.592 ( -0.000 -2.131 -0.000) 2.131 3.674 ( 0.000 16.390 0.000) 16.390 4.489 ( -0.000 -6.674 -0.000) 6.674 4.498 ( -0.000 -11.587 -0.000) 11.587 4.718 ( -0.000 -5.401 -0.000) 5.401 4.736 ( -0.000 -11.094 -0.000) 11.094 5.460 ( 0.000 0.317 0.000) 0.317 5.749 ( -0.000 -1.238 -0.000) 1.238 6.590 ( 0.000 5.003 0.000) 5.003 6.617 ( 0.000 2.368 0.000) 2.368 7.081 ( -0.000 -9.329 -0.000) 9.329 7.531 ( -0.000 -6.511 -0.000) 6.511 8.616 ( 0.000 3.794 0.000) 3.794 8.766 ( -0.000 -3.255 -0.000) 3.255 9.106 ( -0.000 -1.330 -0.000) 1.330 10.372 ( 0.000 2.389 0.000) 2.389 10.953 ( 0.000 4.510 0.000) 4.510 11.063 ( 0.000 31.886 0.000) 31.886 11.452 ( -0.000 -0.769 -0.000) 0.769 11.858 ( 0.000 2.037 0.000) 2.037 12.070 ( -0.000 -17.092 -0.000) 17.092 12.991 ( -0.000 -4.213 -0.000) 4.213 14.086 ( -0.000 -10.417 -0.000) 10.417 16.744 ( 0.000 0.500 0.000) 0.500 18.249 ( 0.000 0.094 0.000) 0.094 19.203 ( 0.000 4.682 0.000) 4.682 19.495 ( -0.000 -2.902 -0.000) 2.902 19.822 ( 0.000 12.061 0.000) 12.061 20.780 ( -0.000 -7.125 -0.000) 7.125 23.327 ( -0.000 -0.281 -0.000) 0.281 23.902 ( -0.000 -0.509 -0.000) 0.509 ======================= Grid point 58 (31/361) ======================= q-point: (-0.50 0.50 0.00) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 198 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.093 ( -0.000 -0.000 -0.000) 0.000 2.291 ( 0.000 0.000 0.000) 0.000 2.501 ( -0.000 -0.000 -0.000) 0.000 2.867 ( -0.000 -0.000 -0.000) 0.000 3.420 ( -0.000 -0.000 -0.000) 0.000 3.574 ( -0.000 -0.000 -0.000) 0.000 3.997 ( 0.000 0.000 0.000) 0.000 4.260 ( -0.000 -0.000 -0.000) 0.000 4.427 ( -0.000 -0.000 -0.000) 0.000 4.649 ( -0.000 -0.000 -0.000) 0.000 4.671 ( -0.000 -0.000 -0.000) 0.000 5.463 ( -0.000 -0.000 -0.000) 0.000 5.738 ( -0.000 -0.000 -0.000) 0.000 6.637 ( -0.000 -0.000 -0.000) 0.000 6.651 ( -0.000 -0.000 -0.000) 0.000 6.979 ( -0.000 -0.000 -0.000) 0.000 7.474 ( -0.000 -0.000 -0.000) 0.000 8.654 ( -0.000 -0.000 -0.000) 0.000 8.738 ( -0.000 -0.000 -0.000) 0.000 9.092 ( -0.000 -0.000 -0.000) 0.000 10.393 ( -0.000 -0.000 -0.000) 0.000 10.994 ( -0.000 -0.000 -0.000) 0.000 11.444 ( -0.000 -0.000 -0.000) 0.000 11.463 ( -0.000 -0.000 -0.000) 0.000 11.804 ( -0.000 -0.000 -0.000) 0.000 11.877 ( -0.000 -0.000 -0.000) 0.000 12.953 ( -0.000 -0.000 -0.000) 0.000 13.991 ( -0.000 -0.000 -0.000) 0.000 16.749 ( -0.000 -0.000 -0.000) 0.000 18.250 ( -0.000 -0.000 -0.000) 0.000 19.250 ( -0.000 -0.000 -0.000) 0.000 19.464 ( -0.000 -0.000 -0.000) 0.000 19.939 ( -0.000 -0.000 -0.000) 0.000 20.707 ( -0.000 -0.000 -0.000) 0.000 23.325 ( -0.000 -0.000 -0.000) 0.000 23.898 ( -0.000 -0.000 -0.000) 0.000 ======================= Grid point 105 (32/361) ======================= q-point: ( 0.00 0.00 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.586 ( 25.087 0.000 29.340) 38.602 0.589 ( -4.569 -0.000 30.521) 30.861 1.223 ( -5.046 -0.000 60.704) 60.914 3.347 ( 0.170 0.000 -2.583) 2.588 3.576 ( -3.892 -0.000 6.843) 7.872 3.860 ( -4.319 -0.000 5.331) 6.861 4.498 ( 2.533 0.000 -3.584) 4.389 4.677 ( -57.133 -0.000 2.660) 57.195 5.119 ( 5.022 0.000 2.755) 5.728 5.379 ( 1.659 0.000 -3.779) 4.127 5.416 ( -2.858 -0.000 7.637) 8.154 5.796 ( -54.405 -0.000 3.050) 54.490 6.020 ( -4.185 -0.000 -3.294) 5.326 6.392 ( -2.424 -0.000 -4.617) 5.214 6.698 ( 18.459 0.000 -0.561) 18.467 7.213 ( 2.204 0.000 9.642) 9.891 7.317 ( 0.305 0.000 -11.182) 11.186 8.354 ( -0.606 -0.000 6.829) 6.856 9.102 ( -1.994 -0.000 -2.354) 3.084 9.269 ( -0.247 -0.000 -6.184) 6.189 9.368 ( 27.350 0.000 1.571) 27.395 10.045 ( -2.226 -0.000 2.241) 3.159 11.244 ( -22.892 -0.000 9.012) 24.602 11.435 ( 0.973 0.000 -4.880) 4.976 11.581 ( 1.754 0.000 -9.746) 9.903 12.137 ( 2.761 0.000 8.670) 9.099 12.516 ( -0.572 -0.000 -1.649) 1.746 14.656 ( -0.406 -0.000 -13.202) 13.208 18.009 ( 1.614 0.000 -6.093) 6.303 18.311 ( -3.399 -0.000 5.955) 6.857 18.808 ( 36.788 0.000 -1.965) 36.841 18.986 ( 9.605 0.000 -1.332) 9.697 19.618 ( 6.912 0.000 0.592) 6.937 22.712 ( -95.708 -0.000 -5.346) 95.857 22.739 ( -1.784 -0.000 2.552) 3.114 23.331 ( 2.411 0.000 -0.040) 2.411 ======================= Grid point 106 (33/361) ======================= q-point: ( 0.10 0.00 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.966 ( 7.019 -0.956 27.619) 28.513 1.256 ( 16.532 -9.672 27.710) 33.685 2.081 ( 22.966 -10.444 46.898) 53.253 3.338 ( 5.897 2.609 -5.224) 8.300 3.509 ( -15.913 1.360 10.617) 19.178 3.843 ( -5.001 1.588 5.356) 7.498 4.265 ( -25.223 5.225 25.268) 36.083 4.491 ( 0.622 -0.277 -4.849) 4.896 5.104 ( -1.660 0.397 -5.999) 6.237 5.260 ( -6.432 6.935 -3.200) 9.986 5.319 ( -0.709 1.223 -5.469) 5.649 5.690 ( 0.755 2.707 16.301) 16.541 5.890 ( -7.311 3.838 0.286) 8.262 6.302 ( -2.022 3.570 -0.646) 4.154 6.870 ( 11.941 4.639 -3.112) 13.183 7.149 ( -1.743 1.635 -13.383) 13.595 7.455 ( -2.725 -20.015 6.211) 21.133 8.418 ( 0.601 3.510 5.506) 6.557 9.033 ( 0.183 0.241 -5.079) 5.088 9.177 ( -3.176 -4.663 -7.017) 9.004 9.762 ( 30.498 5.155 -8.700) 32.130 10.054 ( -1.985 -6.970 0.919) 7.305 11.099 ( -10.637 14.972 16.999) 25.025 11.416 ( 4.291 -5.091 -6.993) 9.656 11.608 ( 2.119 -13.192 -5.032) 14.278 12.322 ( 2.810 -6.010 6.659) 9.400 12.466 ( -3.230 -0.525 -2.496) 4.116 14.405 ( -6.144 3.192 -18.591) 19.839 17.938 ( 3.979 11.466 -0.090) 12.137 18.254 ( -6.977 5.305 -0.427) 8.775 18.670 ( -26.030 -10.917 3.848) 28.487 19.005 ( -12.541 1.002 3.270) 12.999 19.786 ( 13.434 2.338 7.171) 15.406 21.995 ( 4.588 30.473 0.412) 30.819 22.926 ( -6.278 -30.198 -5.757) 31.376 23.377 ( 3.104 0.033 1.021) 3.268 ======================= Grid point 107 (34/361) ======================= q-point: ( 0.20 0.00 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.404 ( 11.422 -1.259 22.722) 25.463 1.867 ( 11.516 -13.232 26.817) 32.045 2.956 ( 25.154 -7.974 25.857) 36.945 3.311 ( 4.722 5.514 -6.305) 9.615 3.463 ( -7.236 4.202 13.639) 16.001 3.839 ( -0.161 0.889 1.730) 1.951 4.230 ( -11.152 2.765 16.883) 20.422 4.403 ( -0.428 3.244 -7.672) 8.341 4.981 ( -6.925 -1.449 -4.568) 8.421 5.189 ( 5.879 5.504 0.679) 8.082 5.241 ( -1.023 -0.883 -4.926) 5.108 5.744 ( -9.381 3.100 7.349) 12.314 5.932 ( 2.789 1.036 15.312) 15.598 6.250 ( -2.662 4.144 1.766) 5.233 6.837 ( -0.940 6.721 -7.885) 10.404 6.974 ( 2.295 1.735 -12.034) 12.373 7.628 ( -7.640 -17.302 7.569) 20.372 8.439 ( 1.706 5.905 3.185) 6.923 8.953 ( -2.485 2.256 -5.451) 6.401 9.151 ( 2.821 -7.311 -4.043) 8.818 9.884 ( 6.381 3.198 -4.041) 8.202 10.170 ( 10.923 -5.840 -4.073) 13.039 11.024 ( -7.756 9.070 9.528) 15.271 11.488 ( 8.464 -4.274 -3.620) 10.150 11.727 ( 1.531 -14.526 -0.250) 14.609 12.345 ( -5.123 2.541 -2.894) 6.409 12.503 ( 2.770 -3.085 7.805) 8.838 14.028 ( -9.458 4.944 -20.271) 22.908 17.913 ( -2.937 9.510 6.993) 12.164 18.083 ( 3.592 6.400 -9.626) 12.104 18.531 ( -23.705 -16.101 8.930) 30.015 18.804 ( -13.608 4.091 -2.112) 14.365 20.090 ( 15.515 0.771 10.761) 18.897 21.902 ( 14.317 15.946 -8.428) 23.028 22.988 ( -3.985 -17.371 -5.746) 18.725 23.428 ( 2.550 1.016 1.377) 3.071 ======================= Grid point 108 (35/361) ======================= q-point: ( 0.30 0.00 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.793 ( 9.374 0.357 16.791) 19.234 2.423 ( 9.760 -12.251 23.458) 28.206 3.176 ( -1.506 6.579 -4.251) 7.976 3.342 ( 3.214 6.676 0.014) 7.410 3.610 ( 6.332 1.676 8.132) 10.441 3.845 ( 5.560 3.947 1.326) 6.946 4.299 ( -0.321 -4.138 -2.124) 4.662 4.355 ( 5.564 -3.090 4.269) 7.663 4.855 ( -11.095 -2.815 1.346) 11.525 5.152 ( -1.908 0.611 -5.685) 6.028 5.360 ( 6.139 -1.235 15.800) 16.996 5.710 ( -5.426 1.500 8.249) 9.987 6.123 ( 3.299 12.603 13.389) 18.681 6.158 ( -9.155 -3.960 -0.473) 9.986 6.618 ( -3.491 8.019 -9.116) 12.633 6.897 ( 4.482 2.036 -6.693) 8.309 7.716 ( -11.532 -14.453 6.692) 19.663 8.450 ( 2.702 5.184 1.940) 6.159 8.815 ( -4.013 2.985 -5.114) 7.153 9.277 ( 8.255 -5.853 0.888) 10.159 9.869 ( -3.268 -6.929 -3.406) 8.384 10.271 ( 11.050 7.033 -5.987) 14.402 10.986 ( -3.678 1.294 7.297) 8.273 11.612 ( 9.991 -2.040 -2.642) 10.534 11.878 ( 0.196 -13.534 2.117) 13.700 12.186 ( -7.942 3.510 -3.512) 9.366 12.678 ( 5.391 -1.433 8.591) 10.243 13.619 ( -9.958 5.321 -17.483) 20.812 17.801 ( -6.306 6.156 0.621) 8.835 18.096 ( 13.843 5.328 -4.767) 15.580 18.472 ( -21.626 -13.664 11.095) 27.883 18.534 ( -10.518 2.776 -8.629) 13.886 20.392 ( 12.184 3.194 9.076) 15.525 21.887 ( 11.750 5.277 -8.827) 15.615 23.012 ( -1.382 -10.536 -4.098) 11.389 23.455 ( 1.339 2.384 1.088) 2.943 ======================= Grid point 109 (36/361) ======================= q-point: ( 0.40 0.00 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.999 ( 2.682 5.763 7.053) 9.495 2.835 ( 2.330 -2.572 13.471) 13.911 3.034 ( -0.943 2.635 -5.806) 6.445 3.313 ( 0.764 4.589 3.602) 5.883 3.505 ( -1.525 7.321 -7.093) 10.307 4.079 ( 8.001 -5.116 10.041) 13.821 4.347 ( 10.170 -5.334 -11.407) 16.186 4.476 ( 0.499 -3.660 1.990) 4.196 4.756 ( -14.131 -4.478 6.404) 16.148 5.042 ( -3.275 -1.166 -6.498) 7.370 5.705 ( 1.539 -2.008 16.689) 16.880 5.756 ( 2.286 -2.128 6.977) 7.644 5.866 ( -15.207 13.425 1.826) 20.367 6.253 ( -1.748 1.529 8.292) 8.611 6.456 ( 0.196 4.043 -3.993) 5.686 6.907 ( 6.905 3.233 -1.602) 7.791 7.735 ( -10.206 -7.754 6.293) 14.279 8.455 ( 1.106 3.495 -0.420) 3.689 8.710 ( -1.012 1.590 -1.714) 2.547 9.439 ( 4.605 -2.854 1.417) 5.599 9.873 ( -3.322 -14.077 -1.855) 14.582 10.216 ( 7.928 16.286 -5.827) 19.027 11.070 ( -0.780 -2.640 8.644) 9.072 11.715 ( 7.632 -0.181 -2.779) 8.124 11.983 ( -0.255 -0.819 -2.944) 3.066 12.035 ( -5.880 -4.562 3.310) 8.145 12.812 ( 1.937 -1.323 -3.607) 4.302 13.339 ( -2.651 2.858 -2.109) 4.432 17.700 ( -1.247 3.401 -1.728) 4.014 18.126 ( 4.064 5.502 -10.913) 12.879 18.346 ( 0.953 2.299 0.674) 2.578 18.442 ( -16.962 -14.863 6.476) 23.464 20.544 ( 6.756 8.116 2.414) 10.832 21.939 ( 6.474 -4.629 -3.208) 8.581 23.048 ( 1.457 -5.863 -2.057) 6.382 23.449 ( 0.641 3.915 0.304) 3.978 ======================= Grid point 110 (37/361) ======================= q-point: (-0.50 0.00 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.918 ( -3.981 13.575 -3.555) 14.587 2.660 ( -15.931 10.205 -8.484) 20.734 3.061 ( 4.892 3.522 2.156) 6.402 3.327 ( -0.717 -0.622 3.909) 4.023 3.584 ( 6.722 -10.881 4.454) 13.543 4.152 ( -6.803 1.101 -8.364) 10.838 4.335 ( 0.141 -0.426 -6.888) 6.902 4.599 ( -0.011 -9.302 11.799) 15.025 4.715 ( -6.549 -5.298 3.397) 9.082 4.964 ( -1.964 -5.424 -3.861) 6.942 5.423 ( -12.595 12.623 -9.430) 20.172 5.736 ( -4.895 0.974 3.242) 5.951 6.114 ( -3.094 -6.418 20.166) 21.387 6.244 ( -1.227 11.847 5.798) 13.247 6.489 ( 2.638 -7.092 4.179) 8.644 6.984 ( 7.768 3.762 2.975) 9.129 7.727 ( -4.414 2.399 5.578) 7.507 8.399 ( -1.888 0.536 -4.004) 4.459 8.737 ( 3.808 -0.735 2.371) 4.546 9.441 ( -5.940 -4.260 -2.929) 7.875 9.969 ( 3.616 2.204 3.117) 5.258 10.152 ( 8.097 2.358 -5.231) 9.924 11.125 ( -8.584 2.565 9.151) 12.806 11.754 ( 3.073 0.745 -2.985) 4.348 11.942 ( 5.192 2.593 -0.157) 5.806 12.120 ( -0.692 -4.912 5.578) 7.465 12.616 ( -6.627 1.905 -16.750) 18.114 13.499 ( 10.404 -3.555 12.346) 16.532 17.638 ( -1.018 0.351 -6.054) 6.149 17.959 ( 3.860 3.732 -12.491) 13.595 18.408 ( -10.918 -10.835 3.747) 15.832 18.468 ( 5.178 -0.732 6.511) 8.351 20.495 ( 1.728 11.379 -5.636) 12.816 22.060 ( -1.230 -12.075 4.360) 12.897 23.109 ( 3.854 -1.954 0.732) 4.383 23.416 ( 1.043 5.363 -0.638) 5.500 ======================= Grid point 111 (38/361) ======================= q-point: (-0.40 0.00 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.619 ( -7.926 18.307 -7.824) 21.429 2.175 ( -19.918 17.661 -8.951) 28.085 3.144 ( 2.895 -2.418 1.167) 3.948 3.389 ( -1.514 -4.507 2.634) 5.436 3.703 ( -15.495 -1.046 -6.103) 16.686 3.822 ( -6.579 -3.810 -10.173) 12.700 4.217 ( -8.451 0.952 -0.436) 8.516 4.627 ( -11.521 -2.208 5.335) 12.887 4.891 ( 6.964 -9.027 6.469) 13.108 5.005 ( 1.906 -6.150 -0.046) 6.439 5.190 ( -3.369 2.231 3.191) 5.148 5.658 ( -4.566 0.817 -2.962) 5.503 6.181 ( -9.579 9.037 12.140) 17.911 6.221 ( -5.003 -4.043 3.881) 7.513 6.707 ( 4.057 -10.122 7.914) 13.474 7.135 ( 6.736 2.277 9.728) 12.050 7.696 ( 2.111 13.186 3.422) 13.785 8.326 ( -3.667 -5.146 -4.777) 7.921 8.846 ( 6.579 -1.057 1.611) 6.855 9.350 ( -6.114 -2.728 -1.350) 6.830 9.954 ( 4.235 12.482 -0.073) 13.181 10.268 ( 6.840 -9.891 -4.282) 12.765 11.016 ( -16.017 6.105 10.490) 20.096 11.717 ( -1.076 1.694 -3.466) 4.004 12.050 ( 5.907 7.048 6.716) 11.388 12.226 ( 1.001 -2.346 6.967) 7.419 12.328 ( -0.865 -0.335 -17.285) 17.310 13.865 ( 14.545 -5.988 11.854) 19.696 17.475 ( -1.988 -2.693 -19.631) 19.915 17.936 ( 9.575 3.373 -3.640) 10.785 18.389 ( -10.599 -7.429 5.359) 14.009 18.650 ( 8.624 -1.612 5.549) 10.381 20.280 ( -2.569 12.281 -11.372) 16.933 22.192 ( -10.121 -17.114 8.865) 21.770 23.214 ( 5.520 0.364 5.345) 7.693 23.375 ( 2.202 6.992 -0.622) 7.357 ======================= Grid point 112 (39/361) ======================= q-point: (-0.30 0.00 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.229 ( -11.920 19.886 -6.042) 23.960 1.626 ( -21.434 23.260 -4.811) 31.993 2.805 ( -31.501 11.808 -25.171) 42.016 3.423 ( -4.451 -4.933 9.093) 11.262 3.503 ( -5.066 -7.563 6.148) 10.984 3.743 ( -6.812 -4.804 -4.944) 9.691 4.106 ( -9.620 -1.268 3.934) 10.470 4.613 ( -2.210 2.028 7.144) 7.748 5.060 ( 5.618 -5.560 -2.273) 8.225 5.111 ( 6.429 -5.118 0.767) 8.253 5.315 ( -6.197 -11.374 16.026) 20.606 5.560 ( -2.000 0.105 -3.780) 4.278 6.113 ( -14.724 3.046 15.194) 21.376 6.217 ( -2.807 -5.492 -1.296) 6.303 6.898 ( 0.721 -9.086 3.043) 9.609 7.300 ( 0.890 0.697 8.433) 8.508 7.656 ( 9.875 21.516 4.197) 24.043 8.290 ( -5.099 -9.498 -1.557) 10.892 8.952 ( 7.296 -1.521 -2.497) 7.860 9.317 ( -0.374 2.334 3.320) 4.075 9.901 ( 2.107 3.213 -4.377) 5.824 10.340 ( 3.420 -5.432 -8.318) 10.507 10.884 ( -19.921 1.147 17.101) 26.279 11.629 ( -2.956 1.959 -3.405) 4.917 11.958 ( -7.904 5.180 -4.042) 10.278 12.340 ( 14.627 7.312 2.174) 16.497 12.360 ( 4.576 0.238 6.201) 7.710 14.249 ( 15.515 -6.529 8.127) 18.692 17.194 ( -0.757 -3.775 -29.815) 30.062 18.029 ( 9.846 3.902 0.660) 10.612 18.371 ( -6.265 -2.181 4.120) 7.809 18.845 ( 8.140 -1.086 5.142) 9.689 19.975 ( -4.946 10.637 -13.235) 17.685 22.279 ( -18.258 -22.607 9.974) 30.723 23.321 ( 3.229 -0.476 -4.621) 5.657 23.411 ( 5.543 10.221 18.070) 21.488 ======================= Grid point 113 (40/361) ======================= q-point: (-0.20 0.00 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.822 ( -17.547 18.444 0.682) 25.467 1.092 ( -22.857 26.608 4.595) 35.377 1.838 ( -46.461 17.725 -19.778) 53.516 3.466 ( -7.558 -6.635 2.851) 10.454 3.588 ( -9.524 -2.697 6.448) 11.814 3.693 ( 3.613 -3.160 2.521) 5.422 4.133 ( -7.436 -8.082 17.522) 20.680 4.640 ( 0.270 6.168 5.397) 8.201 5.162 ( 3.017 -5.793 1.122) 6.627 5.243 ( 6.024 -4.867 -0.467) 7.758 5.454 ( -5.328 -4.927 3.102) 7.892 5.571 ( -5.085 -10.074 10.946) 15.721 6.108 ( -9.240 0.820 15.266) 17.864 6.223 ( -6.161 -16.800 -2.562) 18.076 6.900 ( -11.334 -6.704 -3.529) 13.633 7.346 ( 2.902 0.877 0.352) 3.052 7.719 ( 17.162 23.136 5.369) 29.302 8.314 ( -5.607 -5.786 6.410) 10.296 9.006 ( 6.834 -2.357 -7.935) 10.734 9.354 ( 4.536 8.087 3.845) 10.038 9.854 ( -2.362 -11.559 -10.776) 15.979 10.248 ( -1.976 2.306 -11.134) 11.541 10.897 ( -24.776 -17.047 27.856) 40.993 11.538 ( -2.498 1.290 -2.792) 3.963 11.784 ( -4.363 1.126 -5.300) 6.957 12.463 ( 4.470 -0.665 1.371) 4.722 12.539 ( 20.932 26.246 11.945) 35.633 14.567 ( 13.908 -5.016 1.578) 14.869 16.840 ( -2.420 -1.220 -27.755) 27.887 18.135 ( 8.186 5.201 2.663) 10.058 18.337 ( -0.583 5.482 -0.058) 5.513 18.988 ( 5.268 2.502 3.515) 6.809 19.699 ( -3.323 4.920 -10.406) 11.981 22.337 ( -25.428 -33.205 11.120) 43.276 23.305 ( 3.122 1.476 -3.517) 4.929 23.685 ( 5.728 7.211 28.672) 30.115 ======================= Grid point 114 (41/361) ======================= q-point: (-0.10 0.00 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.506 ( -20.670 9.824 17.483) 28.799 0.590 ( -35.666 13.631 -3.069) 38.305 1.008 ( -34.955 27.251 33.276) 55.424 3.403 ( -6.760 -3.336 -1.411) 7.669 3.548 ( -3.570 0.599 3.288) 4.890 3.814 ( -0.090 -2.862 5.935) 6.589 4.430 ( -1.005 -16.296 9.210) 18.746 4.744 ( 11.248 6.687 20.892) 24.652 5.227 ( -3.937 -4.845 -4.861) 7.912 5.346 ( 2.023 -3.661 1.047) 4.312 5.384 ( -0.240 1.574 -4.556) 4.826 5.851 ( -0.422 -25.208 20.684) 32.611 6.142 ( 3.232 10.509 5.827) 12.443 6.325 ( -21.762 -46.069 3.879) 51.098 6.679 ( -29.288 -20.315 -2.140) 35.707 7.380 ( 4.371 -0.802 -5.622) 7.166 7.724 ( 21.158 39.067 -19.524) 48.530 8.356 ( -1.477 7.712 6.486) 10.184 9.004 ( 7.190 -0.818 -8.886) 11.459 9.349 ( 3.386 7.337 -2.927) 8.594 9.604 ( -32.021 -15.687 -24.429) 43.223 10.069 ( -2.443 6.720 0.496) 7.168 11.167 ( -25.874 -50.502 22.426) 61.015 11.475 ( -1.174 0.223 -2.727) 2.978 11.708 ( 0.355 0.597 -1.840) 1.966 12.504 ( 16.555 36.506 -15.001) 42.799 12.530 ( 6.155 19.646 -12.650) 24.163 14.718 ( 7.907 -1.764 -7.712) 11.185 16.985 ( 27.741 -15.806 62.582) 70.256 18.210 ( 14.250 20.520 0.739) 24.994 18.273 ( 1.793 6.309 1.296) 6.686 19.019 ( 0.747 4.185 0.389) 4.269 19.581 ( 1.527 -0.556 -5.020) 5.276 22.463 ( -29.062 -52.924 12.481) 61.654 23.305 ( 2.744 0.498 -1.960) 3.409 24.040 ( -2.138 -6.738 2.055) 7.362 ======================= Grid point 116 (42/361) ======================= q-point: ( 0.10 0.10 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.437 ( 12.816 0.000 27.027) 29.912 1.705 ( 6.780 0.000 30.745) 31.484 2.884 ( 30.585 0.000 27.021) 40.812 3.364 ( 6.223 0.000 -7.586) 9.812 3.503 ( -7.079 -0.000 16.799) 18.229 3.837 ( -2.620 -0.000 2.021) 3.309 4.263 ( -14.943 -0.000 16.640) 22.365 4.442 ( 0.515 0.000 -6.912) 6.931 4.948 ( -6.467 -0.000 -10.012) 11.919 5.238 ( -2.400 -0.000 -4.585) 5.175 5.243 ( 3.795 0.000 -0.220) 3.802 5.806 ( -9.255 -0.000 4.050) 10.102 5.873 ( -3.258 -0.000 16.142) 16.468 6.351 ( 3.166 0.000 4.466) 5.474 6.912 ( 2.229 0.000 -7.155) 7.494 6.974 ( -1.294 -0.000 -13.231) 13.295 7.438 ( -8.077 -0.000 12.179) 14.614 8.494 ( 1.358 0.000 2.355) 2.718 8.970 ( -3.302 -0.000 -5.128) 6.099 9.080 ( 5.074 0.000 -4.534) 6.805 9.941 ( -6.522 -0.000 -1.733) 6.749 10.096 ( 27.633 0.000 -8.923) 29.038 11.274 ( 6.698 0.000 -14.165) 15.669 11.279 ( -11.278 -0.000 20.889) 23.739 11.599 ( 6.205 0.000 -0.472) 6.223 12.369 ( -5.548 -0.000 -3.427) 6.521 12.472 ( 5.004 0.000 9.971) 11.156 14.071 ( -10.799 -0.000 -19.833) 22.582 18.028 ( 3.218 0.000 -0.122) 3.221 18.168 ( -3.853 -0.000 -5.361) 6.601 18.326 ( -22.222 -0.000 6.923) 23.276 18.844 ( -14.660 -0.000 -0.016) 14.660 20.105 ( 13.750 0.000 13.488) 19.261 22.102 ( 9.080 0.000 -17.088) 19.350 22.773 ( 0.645 0.000 1.507) 1.639 23.439 ( 3.386 0.000 1.321) 3.635 ======================= Grid point 117 (43/361) ======================= q-point: ( 0.20 0.10 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.882 ( 12.238 8.351 23.955) 28.166 2.181 ( 4.723 -13.085 27.669) 30.970 3.288 ( -0.885 5.259 -5.522) 7.677 3.396 ( 12.880 -0.515 2.904) 13.213 3.674 ( 3.798 5.108 13.413) 14.847 3.846 ( 4.126 -3.537 -2.780) 6.105 4.301 ( -0.461 0.759 8.195) 8.243 4.330 ( 1.205 2.465 -8.087) 8.540 4.750 ( -10.194 -6.657 -6.760) 13.926 5.150 ( -5.770 -0.159 -1.818) 6.052 5.366 ( 5.374 0.783 11.393) 12.622 5.743 ( -6.834 1.765 6.751) 9.767 6.005 ( -4.316 -5.223 10.267) 12.301 6.413 ( -1.256 10.230 6.535) 12.204 6.770 ( -0.292 8.940 -7.875) 11.917 6.888 ( 1.674 -3.225 -4.390) 5.699 7.460 ( -13.930 -11.312 9.352) 20.235 8.521 ( 1.702 2.410 1.100) 3.149 8.844 ( -5.712 0.568 -3.814) 6.892 9.196 ( 12.709 -2.632 -0.417) 12.985 9.803 ( -7.566 -1.476 -5.369) 9.394 10.358 ( 22.625 2.213 -5.107) 23.299 11.130 ( 0.334 14.339 0.356) 14.347 11.468 ( -0.776 -15.709 6.292) 16.940 11.702 ( 5.032 -3.424 1.168) 6.197 12.231 ( -7.391 1.389 -3.685) 8.375 12.659 ( 6.075 -0.633 7.845) 9.942 13.680 ( -12.440 1.670 -16.907) 21.056 17.928 ( -10.475 7.640 2.396) 13.184 18.164 ( 15.341 2.125 -8.415) 17.626 18.213 ( -13.840 -11.988 2.838) 18.529 18.603 ( -15.543 2.306 -2.913) 15.981 20.450 ( 11.538 2.374 15.894) 19.783 21.979 ( 7.991 3.984 -18.259) 20.325 22.839 ( 1.411 -6.867 0.314) 7.018 23.491 ( 2.390 1.217 1.328) 2.993 ======================= Grid point 118 (44/361) ======================= q-point: ( 0.30 0.10 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.158 ( 5.640 12.109 16.586) 21.296 2.676 ( 6.550 -14.038 20.545) 25.731 3.094 ( -8.714 4.196 -6.028) 11.396 3.429 ( -1.888 7.326 1.265) 7.670 3.675 ( 0.874 9.569 -9.970) 13.846 3.977 ( 5.425 -6.818 4.520) 9.816 4.250 ( 6.163 -2.774 -5.986) 9.029 4.438 ( 7.432 -1.752 -3.761) 8.512 4.644 ( -10.307 -7.699 1.250) 12.925 5.025 ( -8.870 -0.581 -2.745) 9.303 5.637 ( 5.451 -3.656 16.484) 17.743 5.734 ( -4.547 -0.605 4.517) 6.438 6.012 ( -13.920 2.514 5.947) 15.344 6.316 ( -3.578 5.233 4.268) 7.642 6.631 ( 3.123 13.492 -3.394) 14.258 6.944 ( 3.208 1.968 4.575) 5.924 7.502 ( -11.832 -16.874 8.382) 22.248 8.526 ( 0.812 3.781 0.916) 3.974 8.733 ( -3.769 0.982 -1.753) 4.271 9.411 ( 11.127 -0.384 0.866) 11.168 9.672 ( -4.379 -8.438 -5.299) 10.884 10.517 ( 16.608 14.775 -3.484) 22.500 11.080 ( 0.735 5.978 6.790) 9.077 11.662 ( 5.174 -10.260 0.687) 11.511 11.812 ( 0.333 -7.914 3.198) 8.542 12.069 ( -6.909 2.477 -3.081) 7.960 12.792 ( 4.049 -0.855 -2.559) 4.866 13.373 ( -7.878 1.074 -4.433) 9.103 17.775 ( -4.819 5.228 -0.501) 7.128 18.138 ( -7.327 -9.649 -10.252) 15.871 18.263 ( 6.431 1.918 -2.022) 7.009 18.386 ( -6.226 0.455 1.663) 6.460 20.703 ( 6.117 8.675 12.906) 16.710 21.863 ( 4.492 -3.719 -14.994) 16.088 22.931 ( 2.981 -6.178 0.481) 6.877 23.514 ( 1.514 2.936 1.242) 3.529 ======================= Grid point 119 (45/361) ======================= q-point: (-0.60 0.10 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.189 ( -0.449 16.848 4.048) 17.334 2.775 ( -14.462 3.614 -3.887) 15.405 3.103 ( 6.169 -3.579 7.792) 10.563 3.354 ( -5.306 2.925 1.659) 6.282 3.477 ( -0.138 2.234 -3.941) 4.532 4.093 ( -8.737 -7.871 3.045) 12.147 4.312 ( 8.410 -2.480 -10.885) 13.977 4.485 ( 1.382 -3.193 0.246) 3.488 4.613 ( -3.231 -5.325 1.045) 6.316 4.884 ( -7.143 -3.605 -2.466) 8.373 5.586 ( -11.017 6.012 -10.930) 16.643 5.736 ( -4.523 -1.537 -0.894) 4.860 6.031 ( -10.330 -2.025 28.350) 30.241 6.372 ( 1.589 -1.981 7.262) 7.693 6.521 ( 2.272 14.373 -0.797) 14.573 7.023 ( 1.716 1.223 6.194) 6.543 7.618 ( -4.235 -13.096 6.547) 15.241 8.476 ( -2.056 6.639 -0.485) 6.967 8.715 ( 0.752 -1.477 2.060) 2.644 9.381 ( -5.031 -2.105 -7.103) 8.955 9.836 ( 11.246 -8.821 3.864) 14.806 10.478 ( 9.265 24.708 -1.647) 26.439 11.162 ( -2.253 2.109 9.947) 10.415 11.760 ( 3.676 -0.482 -2.508) 4.476 11.947 ( 2.670 -10.269 1.378) 10.699 11.982 ( -1.287 -1.901 2.694) 3.539 12.646 ( -6.008 1.383 -15.773) 16.935 13.429 ( 6.112 -3.941 10.068) 12.420 17.661 ( -2.898 2.368 -7.479) 8.363 17.961 ( -3.815 -4.598 -10.521) 12.099 18.274 ( -4.507 -2.299 5.845) 7.730 18.469 ( 11.308 -0.062 -1.151) 11.367 20.736 ( 0.309 15.550 3.159) 15.871 21.838 ( -1.803 -13.268 -5.415) 14.443 23.041 ( 4.605 -4.606 1.345) 6.651 23.514 ( 1.700 4.956 1.258) 5.388 ======================= Grid point 120 (46/361) ======================= q-point: (-0.50 0.10 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.972 ( -4.952 21.232 -4.414) 22.244 2.428 ( -18.222 10.442 -5.058) 21.602 3.160 ( 2.199 3.816 1.560) 4.672 3.327 ( -4.337 -1.991 3.456) 5.892 3.558 ( 1.516 -12.549 -1.527) 12.732 3.879 ( -21.476 6.085 -6.390) 23.218 4.210 ( -6.515 -0.867 -7.846) 10.236 4.514 ( -7.509 -8.780 5.734) 12.898 4.735 ( 6.535 -8.029 3.111) 10.810 4.891 ( 0.734 -6.946 1.375) 7.118 5.280 ( -8.214 6.397 -4.551) 11.362 5.657 ( -3.926 -1.120 -4.437) 6.029 6.119 ( -17.490 -2.066 15.734) 23.616 6.428 ( -0.130 11.924 2.035) 12.097 6.551 ( 4.572 -6.147 8.300) 11.295 7.135 ( 0.966 -1.782 9.590) 9.802 7.739 ( 1.481 -7.865 1.080) 8.076 8.362 ( -3.131 8.824 -0.259) 9.366 8.801 ( 3.176 -3.620 2.849) 5.595 9.265 ( -4.700 -5.379 -5.160) 8.812 10.093 ( 9.359 -4.550 3.894) 11.112 10.345 ( 6.219 24.743 -1.470) 25.555 11.133 ( -11.814 6.529 8.800) 16.114 11.741 ( -1.288 1.005 -2.604) 3.074 12.096 ( 8.360 -1.484 5.075) 9.892 12.138 ( 5.801 -8.185 5.517) 11.449 12.341 ( -6.979 1.826 -15.738) 17.313 13.735 ( 12.034 -8.241 9.437) 17.371 17.438 ( -4.507 -1.468 -19.709) 20.271 17.942 ( 3.128 -2.667 0.596) 4.154 18.321 ( 0.786 0.084 4.511) 4.580 18.628 ( 11.671 -1.014 0.612) 11.731 20.537 ( -4.332 16.878 -6.635) 18.646 21.887 ( -10.648 -17.868 3.497) 21.092 23.168 ( 5.325 -3.667 2.387) 6.892 23.513 ( 3.180 7.087 2.427) 8.138 ======================= Grid point 121 (47/361) ======================= q-point: (-0.40 0.10 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.617 ( -8.250 23.498 -6.028) 25.623 1.996 ( -19.464 17.808 -2.831) 26.532 3.088 ( -13.882 19.098 -15.109) 28.031 3.308 ( -2.774 -9.488 5.801) 11.462 3.423 ( -17.291 0.881 3.227) 17.611 3.614 ( -2.174 -9.532 -5.057) 11.007 4.055 ( -12.517 -4.451 1.199) 13.339 4.601 ( -3.204 -4.165 10.833) 12.040 4.924 ( 3.376 -10.420 1.685) 11.082 4.988 ( 0.662 -7.345 1.332) 7.494 5.179 ( -3.648 -3.759 3.063) 6.068 5.567 ( -0.403 0.362 -5.212) 5.240 6.011 ( -20.787 -3.947 9.143) 23.049 6.357 ( -0.647 9.579 2.813) 10.005 6.742 ( 1.692 -7.629 4.780) 9.160 7.274 ( -1.089 -3.521 8.355) 9.131 7.820 ( 4.761 -5.485 -4.185) 8.383 8.262 ( -2.204 9.520 5.444) 11.186 8.902 ( 3.763 -3.887 -0.385) 5.424 9.244 ( -2.037 -8.299 -0.736) 8.577 10.156 ( 3.492 23.312 -0.720) 23.583 10.269 ( 4.417 -1.485 -1.045) 4.776 10.982 ( -14.631 7.741 9.304) 18.988 11.659 ( -4.258 1.315 -2.463) 5.092 12.023 ( -7.114 2.998 -11.338) 13.717 12.280 ( 2.309 -5.892 5.012) 8.073 12.449 ( 18.382 1.218 8.850) 20.438 14.091 ( 13.877 -11.153 5.298) 18.575 17.136 ( -4.264 -2.717 -24.365) 24.884 18.054 ( 5.706 -0.973 3.841) 6.947 18.394 ( 6.645 4.638 2.672) 8.533 18.824 ( 11.801 -1.359 3.203) 12.303 20.200 ( -7.809 14.799 -11.727) 20.433 21.906 ( -20.394 -20.101 6.988) 29.475 23.284 ( 3.602 -2.630 0.499) 4.488 23.568 ( 6.384 7.188 8.477) 12.817 ======================= Grid point 122 (48/361) ======================= q-point: (-0.30 0.10 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.218 ( -10.563 24.889 -2.949) 27.198 1.513 ( -22.848 20.786 -2.259) 30.971 2.314 ( -28.494 34.668 -10.650) 46.121 3.335 ( -10.281 -9.060 1.274) 13.763 3.501 ( -0.888 -6.202 11.594) 13.178 3.607 ( -1.170 -6.395 -1.333) 6.636 4.001 ( -10.277 -7.069 9.437) 15.641 4.708 ( -1.608 0.822 9.710) 9.876 5.034 ( 1.722 -8.585 -0.824) 8.795 5.076 ( -4.041 -13.146 1.867) 13.879 5.256 ( -6.303 -12.263 6.080) 15.069 5.530 ( 0.799 1.465 -1.590) 2.305 5.887 ( -16.141 -9.160 6.044) 19.519 6.310 ( 0.347 7.774 2.771) 8.260 6.791 ( -8.060 -5.154 -0.823) 9.602 7.335 ( 0.592 -2.695 -0.839) 2.884 7.878 ( 6.542 -5.290 -6.886) 10.872 8.313 ( 1.859 7.631 16.652) 18.412 8.956 ( 4.155 -2.985 -4.455) 6.784 9.309 ( -3.649 -12.311 0.639) 12.857 9.936 ( 0.684 22.186 -6.955) 23.260 10.281 ( -2.174 2.003 -0.172) 2.961 10.847 ( -14.857 5.388 13.253) 20.625 11.560 ( -4.276 0.886 -2.278) 4.925 11.812 ( -3.452 2.209 -7.422) 8.478 12.405 ( 2.252 -4.873 2.463) 5.906 12.805 ( 20.333 5.510 9.957) 23.301 14.411 ( 13.324 -12.434 -1.338) 18.273 16.825 ( -3.814 -0.414 -18.884) 19.270 18.177 ( 4.827 0.441 3.474) 5.964 18.489 ( 14.096 10.160 0.512) 17.384 19.033 ( 11.300 2.183 4.584) 12.388 19.828 ( -8.480 9.698 -12.447) 17.913 21.833 ( -31.343 -23.805 8.755) 40.320 23.318 ( 1.996 0.214 -1.897) 2.762 23.764 ( 7.375 2.483 14.149) 16.147 ======================= Grid point 123 (49/361) ======================= q-point: (-0.20 0.10 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.852 ( -11.277 24.745 4.332) 27.536 0.933 ( -22.954 24.147 -3.169) 33.467 1.667 ( -18.887 42.928 20.448) 51.163 3.299 ( -6.428 -8.329 -0.419) 10.529 3.557 ( -3.355 0.131 3.355) 4.746 3.714 ( -0.718 -8.357 5.748) 10.168 4.132 ( -11.175 -14.544 19.705) 26.920 4.806 ( 3.348 -0.051 9.176) 9.767 5.073 ( -15.604 -14.439 -0.524) 21.266 5.160 ( -4.714 -15.763 3.279) 16.776 5.320 ( -6.745 -10.943 2.781) 13.152 5.463 ( -8.834 -0.631 1.138) 8.930 5.909 ( -3.315 -9.820 4.183) 11.177 6.308 ( 3.800 7.777 4.773) 9.885 6.605 ( -16.056 -0.007 -1.304) 16.108 7.344 ( 3.539 -3.624 -7.961) 9.436 7.938 ( 9.627 -2.190 -8.340) 12.924 8.485 ( 3.076 3.006 5.596) 7.058 8.994 ( 6.881 -0.253 -0.170) 6.888 9.289 ( -16.583 -13.962 -3.667) 21.986 9.646 ( 0.919 23.244 -7.254) 24.367 10.194 ( -4.643 6.906 2.137) 8.591 10.810 ( -14.977 -1.275 19.598) 24.699 11.482 ( -1.866 0.306 -2.691) 3.289 11.727 ( 1.017 1.753 -1.472) 2.505 12.477 ( 0.682 -3.792 -0.357) 3.870 13.022 ( 16.600 9.619 -16.289) 25.167 14.608 ( 9.641 -11.005 -11.510) 18.616 16.794 ( 5.001 -5.632 22.690) 23.907 18.251 ( 0.808 -0.263 2.748) 2.876 18.635 ( 27.714 16.582 -2.762) 32.414 19.152 ( 5.010 10.241 2.893) 11.762 19.571 ( -2.300 -0.125 -8.603) 8.906 21.675 ( -45.168 -30.268 15.518) 56.543 23.316 ( 1.820 0.821 -1.424) 2.452 23.964 ( -0.586 -2.766 3.637) 4.607 ======================= Grid point 124 (50/361) ======================= q-point: (-0.10 0.10 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.713 ( -1.050 17.060 19.656) 26.048 0.768 ( 18.946 17.523 22.384) 34.162 1.563 ( -4.709 32.336 46.967) 57.216 3.300 ( 0.021 -5.377 -2.068) 5.761 3.560 ( -5.245 -1.496 5.635) 7.842 3.812 ( -3.909 -5.316 5.833) 8.807 4.283 ( -22.229 -16.456 18.095) 33.051 4.696 ( -27.791 -1.905 -4.375) 28.198 5.089 ( 2.214 -4.924 7.823) 9.505 5.285 ( -14.383 -28.390 4.163) 32.097 5.338 ( -0.360 -3.933 -1.259) 4.146 5.443 ( 4.195 -0.095 6.682) 7.890 5.946 ( -7.448 -5.515 1.490) 9.386 6.332 ( -4.163 4.119 4.113) 7.156 6.586 ( 11.857 -2.922 8.296) 14.763 7.287 ( 0.667 -3.330 -12.115) 12.582 7.814 ( 1.443 23.695 -21.102) 31.762 8.355 ( -8.200 -0.985 2.358) 8.588 9.110 ( -7.095 -0.745 -1.731) 7.341 9.257 ( 13.696 -4.923 1.696) 14.652 9.455 ( 11.307 15.335 -3.855) 19.439 10.118 ( -2.565 7.273 3.570) 8.498 10.917 ( -13.818 -11.147 22.252) 28.467 11.442 ( 1.853 0.166 -3.940) 4.357 11.735 ( 2.861 4.571 -1.456) 5.585 12.462 ( -1.680 2.057 -7.874) 8.309 12.621 ( -0.630 24.802 -20.948) 32.471 14.596 ( 1.083 -7.002 -15.488) 17.031 17.553 ( 8.934 -33.688 27.562) 44.434 18.275 ( -3.559 -3.238 2.329) 5.346 18.904 ( 19.133 7.784 -3.311) 20.920 19.076 ( 0.445 8.014 -0.947) 8.082 19.561 ( 5.645 -3.326 -0.609) 6.580 21.622 ( -33.214 -38.010 27.774) 57.613 23.327 ( 2.150 0.566 -0.782) 2.357 23.611 ( -22.560 23.611 -20.053) 38.322 ======================= Grid point 127 (51/361) ======================= q-point: ( 0.20 0.20 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.404 ( -1.801 -0.000 21.876) 21.950 2.408 ( 14.899 0.000 20.468) 25.316 3.139 ( -10.921 -0.000 -6.898) 12.917 3.507 ( -1.289 -0.000 0.160) 1.299 3.795 ( 5.236 0.000 -11.975) 13.070 3.864 ( 2.167 0.000 5.821) 6.211 4.264 ( 1.418 0.000 -5.679) 5.853 4.404 ( 9.070 0.000 -10.870) 14.157 4.556 ( -6.207 -0.000 5.888) 8.555 5.021 ( -11.325 -0.000 -0.242) 11.328 5.603 ( 4.801 0.000 14.418) 15.196 5.729 ( -4.757 -0.000 3.226) 5.748 6.024 ( -10.099 -0.000 10.680) 14.699 6.371 ( -7.436 -0.000 -1.817) 7.655 6.776 ( 6.255 0.000 -7.839) 10.029 7.013 ( 5.104 0.000 15.044) 15.887 7.274 ( -18.234 -0.000 7.973) 19.901 8.563 ( 0.928 0.000 1.382) 1.664 8.742 ( -5.035 -0.000 -1.168) 5.169 9.413 ( 17.128 0.000 3.029) 17.394 9.592 ( -8.262 -0.000 -9.383) 12.502 10.645 ( 20.747 0.000 -0.281) 20.749 11.263 ( 13.641 0.000 -10.362) 17.130 11.416 ( -12.604 -0.000 18.998) 22.799 11.770 ( 4.333 0.000 0.266) 4.341 12.091 ( -7.360 -0.000 -3.218) 8.033 12.784 ( 4.747 0.000 -2.377) 5.308 13.381 ( -9.790 -0.000 -5.016) 11.001 17.852 ( -9.190 -0.000 2.834) 9.617 18.004 ( -5.460 -0.000 -9.018) 10.541 18.308 ( 17.193 0.000 -7.654) 18.820 18.380 ( -13.680 -0.000 0.539) 13.691 20.790 ( 5.909 0.000 18.482) 19.404 21.826 ( 3.129 0.000 -21.656) 21.881 22.870 ( 3.945 0.000 2.255) 4.544 23.541 ( 1.828 0.000 1.321) 2.256 ======================= Grid point 128 (52/361) ======================= q-point: ( 0.30 0.20 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.477 ( -0.929 14.316 8.957) 16.913 2.782 ( -6.774 -4.191 1.652) 8.135 2.967 ( 1.527 -6.336 7.802) 10.166 3.405 ( -8.322 2.156 -1.394) 8.709 3.611 ( -4.087 8.416 -11.301) 14.671 3.926 ( -8.619 -8.811 5.460) 13.481 4.279 ( 7.860 -0.417 -4.214) 8.928 4.430 ( 8.379 -3.514 -7.278) 11.642 4.569 ( -1.349 -0.023 0.730) 1.534 4.841 ( -12.257 -1.266 -2.069) 12.495 5.650 ( -6.464 1.795 -8.816) 11.078 5.695 ( -3.173 -2.096 -2.416) 4.505 6.026 ( -15.586 0.407 28.294) 32.306 6.347 ( 0.396 -0.497 4.516) 4.560 6.756 ( 5.998 8.789 -5.704) 12.073 7.074 ( -8.450 6.623 11.005) 15.374 7.345 ( -2.008 -15.672 10.201) 18.807 8.576 ( -0.587 3.685 2.309) 4.388 8.690 ( -2.803 -1.156 1.766) 3.509 9.367 ( -5.781 0.115 -10.622) 12.094 9.721 ( 16.467 -3.761 4.887) 17.584 10.859 ( 14.414 13.799 2.025) 20.057 11.254 ( 2.561 11.445 5.089) 12.784 11.594 ( 0.347 -19.453 5.035) 20.097 11.809 ( 0.149 -0.896 0.349) 0.973 11.989 ( -1.564 0.323 -0.907) 1.837 12.662 ( -4.878 0.470 -15.475) 16.232 13.377 ( 2.862 -1.715 8.831) 9.440 17.722 ( -5.009 4.487 -11.123) 12.998 17.842 ( -6.001 -6.954 -3.187) 9.723 18.289 ( -3.123 1.722 5.454) 6.516 18.460 ( 16.468 -0.705 -7.217) 17.994 20.991 ( -1.095 10.958 14.981) 18.593 21.621 ( -1.989 -9.521 -18.502) 20.903 22.977 ( 5.272 -2.109 2.982) 6.414 23.575 ( 2.114 1.794 1.469) 3.138 ======================= Grid point 129 (53/361) ======================= q-point: (-0.60 0.20 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.332 ( -3.791 18.745 -2.514) 19.289 2.546 ( -16.400 3.700 -1.609) 16.889 3.207 ( -4.278 -0.825 0.518) 4.388 3.290 ( 2.000 -8.786 2.798) 9.435 3.388 ( -6.445 1.542 -5.257) 8.459 3.913 ( -17.305 -3.066 11.874) 21.209 4.255 ( -1.063 6.676 -15.654) 17.051 4.392 ( -4.144 -4.179 0.155) 5.887 4.618 ( 4.794 -4.729 0.742) 6.774 4.757 ( -2.416 -8.345 -0.042) 8.688 5.373 ( -11.897 3.558 -6.516) 14.023 5.632 ( -1.242 -1.084 -5.085) 5.346 6.108 ( -19.232 -0.047 21.652) 28.960 6.440 ( 2.541 -2.478 4.094) 5.418 6.664 ( 1.461 10.290 -1.459) 10.495 7.094 ( -4.786 -2.113 10.496) 11.728 7.540 ( 0.765 -11.999 2.672) 12.317 8.532 ( -2.296 8.654 3.823) 9.736 8.732 ( 0.094 -4.053 3.624) 5.438 9.196 ( -2.962 -2.259 -9.278) 9.998 10.018 ( 13.025 -3.247 4.749) 14.239 10.832 ( 7.593 27.608 1.459) 28.670 11.237 ( -8.482 6.035 8.411) 13.384 11.744 ( 0.183 -2.100 -3.218) 3.847 11.888 ( 1.082 -16.527 4.889) 17.269 12.084 ( 12.137 -1.381 4.833) 13.136 12.374 ( -8.035 1.521 -15.002) 17.086 13.604 ( 9.394 -5.956 7.689) 13.522 17.422 ( -6.373 -0.466 -20.631) 21.598 17.880 ( 0.184 -3.293 6.370) 7.173 18.359 ( 6.084 2.964 5.260) 8.571 18.609 ( 15.542 -1.173 -5.861) 16.652 20.861 ( -6.442 19.713 -3.212) 20.987 21.563 ( -9.823 -19.230 -1.227) 21.628 23.111 ( 5.420 -2.540 3.474) 6.921 23.607 ( 3.503 3.660 1.925) 5.420 ======================= Grid point 130 (54/361) ======================= q-point: (-0.50 0.20 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.023 ( -6.671 22.048 -6.041) 23.814 2.248 ( -17.079 11.497 0.085) 20.588 3.134 ( -8.207 -9.593 0.497) 12.635 3.269 ( -3.835 -3.948 -3.463) 6.503 3.449 ( 3.085 -4.544 0.868) 5.560 3.628 ( -20.731 21.135 -4.512) 29.947 3.969 ( -13.613 -4.339 -1.751) 14.395 4.484 ( -1.779 -7.895 9.982) 12.851 4.743 ( 1.103 -9.831 1.378) 9.988 4.843 ( 0.779 -9.422 0.561) 9.471 5.154 ( -10.019 -0.123 -2.630) 10.359 5.577 ( 2.723 1.023 -5.182) 5.943 5.993 ( -22.779 0.825 11.123) 25.363 6.472 ( -1.151 3.183 -0.698) 3.456 6.669 ( 2.412 -0.308 4.851) 5.426 7.189 ( -3.375 -5.605 8.020) 10.351 7.640 ( 0.379 -11.076 -3.188) 11.532 8.474 ( -1.119 11.587 6.722) 13.442 8.822 ( 0.845 -5.115 2.784) 5.884 9.118 ( -0.331 -5.120 -5.976) 7.877 10.228 ( 7.217 -1.277 3.496) 8.120 10.669 ( 5.165 30.830 -0.038) 31.260 11.114 ( -12.596 7.042 7.222) 16.137 11.672 ( -5.012 0.198 -2.659) 5.677 12.049 ( -1.099 -3.407 -11.184) 11.743 12.143 ( -3.775 -7.335 3.224) 8.857 12.422 ( 18.952 -2.949 9.368) 21.345 13.889 ( 11.703 -10.762 2.977) 16.176 17.101 ( -5.768 -1.301 -20.832) 21.655 18.023 ( 3.884 -1.882 8.218) 9.282 18.500 ( 13.671 6.650 1.890) 15.320 18.793 ( 15.030 -2.380 -0.539) 15.227 20.480 ( -10.229 16.778 -12.572) 23.328 21.571 ( -18.997 -18.251 6.148) 27.051 23.240 ( 3.933 -2.256 3.177) 5.537 23.666 ( 5.739 4.084 3.767) 7.988 ======================= Grid point 131 (55/361) ======================= q-point: (-0.40 0.20 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.652 ( -8.527 23.993 -3.955) 25.768 1.854 ( -19.101 19.175 -2.045) 27.142 2.932 ( -13.920 28.164 -8.490) 32.544 3.162 ( -14.464 -4.720 1.724) 15.311 3.357 ( 1.377 -11.435 6.031) 13.001 3.514 ( -0.405 -2.871 0.922) 3.042 3.882 ( -11.631 -6.391 7.479) 15.233 4.654 ( -2.903 -6.778 11.076) 13.306 4.833 ( -4.845 -12.296 1.739) 13.331 4.908 ( -2.215 -7.195 -2.219) 7.848 5.059 ( -7.144 -9.883 1.472) 12.283 5.569 ( 2.275 2.662 -1.698) 3.891 5.797 ( -15.798 -2.414 4.172) 16.517 6.412 ( -0.354 4.042 -0.699) 4.117 6.735 ( -3.422 -1.473 2.963) 4.760 7.250 ( -0.843 -6.527 -2.121) 6.915 7.706 ( -0.667 -10.899 -0.064) 10.920 8.478 ( 1.704 9.376 8.916) 13.050 8.895 ( 0.305 -4.542 1.000) 4.661 9.119 ( -0.479 -7.463 -3.538) 8.273 10.318 ( 0.905 1.935 2.992) 3.676 10.436 ( 3.347 31.933 -2.914) 32.240 10.972 ( -11.217 7.685 8.492) 16.031 11.565 ( -5.568 -0.275 -2.548) 6.129 11.859 ( -2.504 2.857 -8.193) 9.031 12.284 ( 1.094 -9.446 2.898) 9.941 12.812 ( 16.579 -2.909 8.875) 19.029 14.164 ( 11.500 -14.612 -3.199) 18.868 16.823 ( -3.918 0.090 -14.426) 14.949 18.176 ( 3.961 -0.280 5.541) 6.817 18.659 ( 19.134 9.035 -1.075) 21.187 19.053 ( 16.299 -0.040 5.431) 17.180 20.028 ( -12.516 12.655 -14.809) 23.154 21.482 ( -27.431 -17.019 7.107) 33.055 23.315 ( 1.588 -0.417 1.141) 1.999 23.792 ( 6.579 0.954 6.309) 9.165 ======================= Grid point 132 (56/361) ======================= q-point: (-0.30 0.20 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.287 ( -10.434 24.528 0.233) 26.656 1.397 ( -10.522 27.799 0.231) 29.725 2.419 ( -10.676 41.346 8.855) 43.611 3.119 ( -7.429 -11.899 0.703) 14.045 3.509 ( -2.315 -10.002 0.606) 10.284 3.576 ( 0.374 -2.745 7.388) 7.890 3.930 ( -11.858 -9.164 16.300) 22.142 4.740 ( -2.531 -8.062 -0.304) 8.456 4.803 ( -16.560 -11.726 1.097) 20.321 4.960 ( -0.563 -9.682 2.733) 10.076 5.134 ( -3.001 -11.157 4.969) 12.577 5.489 ( -6.491 1.724 0.208) 6.719 5.791 ( 1.853 -4.548 2.135) 5.355 6.399 ( 3.750 2.856 0.896) 4.798 6.642 ( -10.749 3.861 1.194) 11.484 7.249 ( 2.876 -6.981 -10.256) 12.735 7.826 ( 1.224 -9.117 4.732) 10.345 8.511 ( -0.021 2.060 -1.619) 2.620 8.947 ( -1.920 -6.187 3.165) 7.209 9.133 ( -0.806 -3.481 -0.187) 3.578 10.142 ( 2.539 31.849 -5.579) 32.433 10.306 ( -3.166 5.615 4.319) 7.759 10.885 ( -9.047 7.114 12.146) 16.733 11.480 ( -2.520 -0.580 -2.736) 3.765 11.771 ( 1.423 3.079 -1.125) 3.574 12.382 ( 0.200 -7.308 -0.353) 7.319 13.061 ( 8.811 -2.363 -4.561) 10.199 14.363 ( 8.905 -15.867 -10.873) 21.197 16.742 ( 2.073 -1.230 7.121) 7.518 18.246 ( 0.582 -0.256 0.649) 0.908 18.849 ( 22.395 9.140 -2.160) 24.285 19.331 ( 15.468 8.244 7.947) 19.245 19.602 ( -11.499 5.025 -14.123) 18.892 21.302 ( -31.302 -15.440 9.305) 36.122 23.331 ( 0.663 0.771 -0.038) 1.017 23.922 ( 1.311 -2.130 2.208) 3.336 ======================= Grid point 133 (57/361) ======================= q-point: (-0.20 0.20 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.107 ( 8.315 24.121 10.605) 27.630 1.150 ( 5.039 26.213 9.648) 28.383 2.193 ( -3.227 37.302 29.967) 47.957 3.163 ( -0.395 -10.058 -0.849) 10.101 3.524 ( -5.718 -3.379 2.397) 7.061 3.694 ( -2.271 -6.948 7.011) 10.128 4.046 ( -18.231 -10.656 22.223) 30.656 4.597 ( -14.410 -8.581 -6.692) 18.058 4.865 ( 2.776 -14.545 1.334) 14.868 5.054 ( -1.063 -6.500 1.753) 6.816 5.247 ( -0.297 -6.899 3.160) 7.594 5.456 ( 0.353 0.727 4.509) 4.581 5.855 ( -4.002 -4.432 1.828) 6.245 6.450 ( -5.153 7.606 2.110) 9.427 6.539 ( 7.422 -2.384 4.063) 8.790 7.202 ( 1.310 -6.134 -12.943) 14.383 7.979 ( 5.956 -1.423 0.815) 6.178 8.333 ( -10.822 0.723 -8.695) 13.901 9.006 ( -2.998 -9.710 -1.775) 10.316 9.213 ( 5.496 -0.093 6.258) 8.329 9.849 ( 4.561 27.905 -6.056) 28.916 10.258 ( -3.133 7.870 5.475) 10.086 10.883 ( -8.461 4.106 16.328) 18.843 11.442 ( 1.933 -0.226 -3.825) 4.292 11.802 ( 4.329 3.904 3.459) 6.778 12.408 ( -1.243 -5.409 -3.519) 6.571 12.917 ( -3.049 7.922 -20.409) 22.104 14.414 ( 3.201 -13.341 -16.713) 21.623 17.123 ( 8.316 -15.847 27.693) 32.973 18.221 ( -3.721 -2.730 -2.800) 5.398 19.020 ( 9.488 5.208 -0.388) 10.830 19.226 ( -9.772 7.328 -7.026) 14.091 19.571 ( 12.810 5.729 2.043) 14.181 21.220 ( -13.928 -14.233 14.438) 24.598 23.334 ( 0.867 0.288 -0.154) 0.926 23.821 ( -9.996 4.942 -9.644) 14.743 ======================= Grid point 134 (58/361) ======================= q-point: (-0.10 0.20 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.117 ( 7.864 16.909 15.279) 24.108 1.466 ( 21.702 12.781 21.410) 33.056 2.403 ( 12.995 24.203 39.978) 48.507 3.248 ( 5.098 -7.544 -4.372) 10.100 3.469 ( -13.530 -2.854 7.736) 15.845 3.789 ( -1.935 -4.587 5.265) 7.246 4.140 ( -17.163 -7.756 23.049) 29.766 4.463 ( -1.829 -3.949 -6.898) 8.156 5.050 ( 0.050 -13.266 -0.304) 13.269 5.079 ( 1.212 -4.379 -3.534) 5.756 5.293 ( 0.644 -1.706 -2.720) 3.275 5.618 ( 5.444 -4.737 13.384) 15.206 5.809 ( -9.264 -3.465 2.652) 10.240 6.328 ( -5.895 6.122 1.805) 8.688 6.763 ( 9.987 -7.192 -0.754) 12.330 7.093 ( -0.642 -4.591 -13.951) 14.701 7.844 ( -3.087 20.024 -4.606) 20.777 8.301 ( -1.181 -9.478 6.506) 11.557 8.999 ( -1.069 -4.476 -4.384) 6.356 9.276 ( -0.689 3.340 -4.561) 5.695 9.748 ( 15.778 8.682 -4.273) 18.509 10.204 ( -1.523 8.698 3.033) 9.337 10.946 ( -9.474 -1.900 16.305) 18.953 11.447 ( 6.636 0.528 -5.112) 8.394 11.834 ( 3.911 10.153 -0.888) 10.917 12.374 ( -1.408 -2.418 -2.908) 4.036 12.571 ( -5.008 10.407 -6.719) 13.361 14.296 ( -3.785 -9.201 -19.606) 21.986 17.654 ( 4.599 -17.550 16.159) 24.295 18.144 ( -5.314 -6.272 -5.625) 9.961 18.893 ( -23.968 9.753 9.042) 27.411 18.984 ( -9.903 0.924 -5.209) 11.227 19.774 ( 18.171 3.277 4.507) 19.006 21.533 ( 13.654 -19.748 6.865) 24.971 23.322 ( -3.327 5.414 -6.097) 8.806 23.432 ( -6.596 12.851 -5.644) 15.509 ======================= Grid point 138 (59/361) ======================= q-point: ( 0.30 -0.70 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.543 ( -5.365 -0.000 0.035) 5.365 2.567 ( -14.537 -0.000 -2.060) 14.682 3.123 ( 6.355 0.000 2.459) 6.814 3.227 ( -11.754 -0.000 -5.093) 12.810 3.441 ( -8.150 -0.000 -3.672) 8.939 3.862 ( -13.411 -0.000 16.865) 21.547 4.342 ( 2.734 0.000 -0.512) 2.781 4.361 ( 1.794 0.000 -15.157) 15.263 4.611 ( 3.711 0.000 2.708) 4.594 4.626 ( -9.996 -0.000 -4.779) 11.080 5.401 ( -13.471 -0.000 -6.934) 15.151 5.625 ( 0.758 0.000 -5.128) 5.184 6.106 ( -19.872 -0.000 23.834) 31.032 6.424 ( 2.512 0.000 4.991) 5.587 6.766 ( 2.230 0.000 -8.964) 9.237 7.078 ( -9.962 -0.000 12.347) 15.865 7.411 ( 2.444 0.000 6.265) 6.725 8.633 ( -0.158 -0.000 4.581) 4.584 8.672 ( -3.214 -0.000 4.043) 5.165 9.179 ( -2.294 -0.000 -10.793) 11.034 9.989 ( 14.490 0.000 5.100) 15.362 11.117 ( 4.023 0.000 5.517) 6.828 11.457 ( -11.654 -0.000 12.721) 17.252 11.478 ( 13.926 0.000 -6.461) 15.352 11.784 ( -3.614 -0.000 0.240) 3.622 12.070 ( 11.223 0.000 4.837) 12.221 12.387 ( -7.800 -0.000 -15.090) 16.986 13.549 ( 8.284 0.000 7.097) 10.908 17.419 ( -7.113 -0.000 -21.199) 22.360 17.849 ( 0.367 0.000 8.405) 8.414 18.391 ( 5.718 0.000 7.623) 9.529 18.595 ( 18.033 0.000 -9.952) 20.597 21.194 ( -9.229 -0.000 18.832) 20.972 21.236 ( -7.447 -0.000 -23.954) 25.085 23.088 ( 5.552 0.000 4.059) 6.877 23.640 ( 3.544 0.000 1.665) 3.916 ======================= Grid point 140 (60/361) ======================= q-point: (-0.60 0.30 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.336 ( -10.065 10.720 -2.181) 14.865 2.410 ( -9.250 7.051 1.404) 11.716 3.002 ( -12.910 -4.266 -5.278) 14.585 3.090 ( -5.882 -10.206 -7.874) 14.169 3.439 ( 0.880 0.696 5.842) 5.949 3.859 ( -15.611 -0.101 13.917) 20.913 4.076 ( -6.908 19.321 -13.993) 24.836 4.350 ( -2.939 -8.651 3.522) 9.792 4.561 ( -0.795 -9.781 -3.439) 10.399 4.710 ( 0.954 -4.048 4.484) 6.116 5.154 ( -13.746 0.022 -3.451) 14.173 5.598 ( 4.657 0.923 -5.008) 6.900 6.008 ( -25.398 0.436 13.647) 28.836 6.510 ( 2.547 1.908 2.687) 4.165 6.679 ( 0.811 -0.017 -5.570) 5.629 7.109 ( -6.697 -2.691 9.568) 11.985 7.495 ( 0.429 -4.626 1.003) 4.753 8.636 ( -2.034 6.818 6.079) 9.359 8.734 ( -0.869 -4.820 4.825) 6.875 9.065 ( 1.523 -1.281 -8.610) 8.837 10.212 ( 9.139 -0.496 4.344) 10.131 11.106 ( -2.285 10.338 1.739) 10.730 11.299 ( -4.655 20.973 6.263) 22.377 11.651 ( -1.877 -5.547 -4.686) 7.500 11.806 ( 0.700 -16.197 3.788) 16.648 12.123 ( -7.091 0.605 -10.925) 13.039 12.380 ( 18.201 -1.360 9.539) 20.594 13.750 ( 10.267 -4.359 1.864) 11.309 17.087 ( -6.244 -0.354 -19.287) 20.276 18.000 ( 4.216 -0.721 10.130) 10.996 18.606 ( 14.496 4.686 6.514) 16.568 18.741 ( 17.772 -3.014 -7.125) 19.382 20.756 ( -11.930 12.508 -19.547) 26.093 21.284 ( -17.146 -12.658 11.990) 24.453 23.211 ( 4.137 -0.889 4.462) 6.149 23.713 ( 5.177 1.350 1.789) 5.641 ======================= Grid point 141 (61/361) ======================= q-point: (-0.50 0.30 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.033 ( -9.770 18.956 -2.818) 21.511 2.187 ( -10.599 17.824 1.248) 20.775 2.858 ( -11.418 -13.054 -3.043) 17.608 3.110 ( -2.120 -15.533 1.761) 15.775 3.456 ( -6.318 3.176 -0.345) 7.079 3.626 ( -2.940 24.412 -8.329) 25.961 3.801 ( -11.600 0.173 11.217) 16.137 4.509 ( -2.407 -10.123 11.794) 15.728 4.596 ( -3.408 -14.244 -3.448) 15.047 4.796 ( -1.540 -5.038 0.588) 5.301 4.946 ( -13.849 -3.080 1.307) 14.247 5.616 ( 4.100 2.417 -1.846) 5.105 5.771 ( -19.942 -1.079 3.566) 20.287 6.483 ( 1.969 5.069 -4.138) 6.833 6.700 ( -0.075 -3.782 1.443) 4.048 7.141 ( -4.543 -4.822 2.671) 7.143 7.548 ( -1.540 -6.506 2.702) 7.211 8.619 ( -1.202 6.461 4.703) 8.082 8.807 ( -1.872 -4.566 3.002) 5.776 9.043 ( 3.653 -2.215 -3.886) 5.775 10.344 ( 2.984 0.997 4.323) 5.346 10.955 ( 0.899 20.467 -2.823) 20.680 11.131 ( -7.253 15.799 7.722) 19.022 11.555 ( -5.792 -0.759 -3.297) 6.707 11.894 ( -0.925 0.053 -7.960) 8.013 12.063 ( -0.818 -15.210 3.318) 15.589 12.750 ( 15.059 -3.189 8.679) 17.671 13.943 ( 10.218 -9.619 -4.003) 14.593 16.826 ( -3.738 0.150 -12.624) 13.167 18.171 ( 4.176 -0.197 6.675) 7.876 18.800 ( 20.276 6.831 -4.035) 21.772 19.031 ( 18.755 -2.313 7.550) 20.349 20.244 ( -14.399 10.906 -18.787) 26.062 21.229 ( -23.675 -11.568 9.178) 27.903 23.306 ( 1.530 -0.504 3.535) 3.884 23.804 ( 5.724 0.456 2.091) 6.111 ======================= Grid point 142 (62/361) ======================= q-point: (-0.40 0.30 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.703 ( -8.089 22.788 0.560) 24.188 1.878 ( -5.987 26.605 2.099) 27.351 2.839 ( -5.057 -11.283 -0.108) 12.365 3.101 ( -9.840 22.295 -2.064) 24.457 3.283 ( -0.863 -10.956 5.474) 12.278 3.562 ( 1.571 0.404 3.356) 3.727 3.816 ( -9.899 -2.705 14.296) 17.598 4.566 ( -5.859 -9.357 -3.398) 11.551 4.658 ( -9.750 -6.858 -4.973) 12.916 4.776 ( -0.277 -12.848 6.672) 14.479 4.956 ( -6.595 -7.515 10.086) 14.202 5.512 ( -8.676 0.843 0.104) 8.717 5.736 ( 3.555 -2.044 0.683) 4.157 6.439 ( 4.864 2.554 -4.549) 7.133 6.698 ( -6.001 1.150 2.300) 6.528 7.131 ( 0.106 -5.248 -6.046) 8.007 7.657 ( -2.122 -9.314 8.694) 12.917 8.574 ( -1.072 4.652 -3.282) 5.793 8.827 ( -3.613 -6.171 -0.118) 7.152 9.108 ( 3.380 -0.728 3.777) 5.120 10.385 ( -1.896 3.382 5.350) 6.607 10.704 ( 2.745 29.897 -6.308) 30.678 11.024 ( -7.428 9.364 10.099) 15.648 11.465 ( -2.597 -1.003 -2.919) 4.033 11.825 ( 1.482 2.819 -0.534) 3.229 12.208 ( -0.381 -13.071 0.075) 13.077 12.995 ( 5.968 -4.292 0.416) 7.362 14.094 ( 8.326 -13.677 -10.094) 18.928 16.733 ( 1.678 -0.082 1.503) 2.254 18.242 ( 0.700 -0.185 -0.865) 1.128 18.977 ( 19.437 5.752 -3.739) 20.613 19.400 ( 17.178 0.660 7.351) 18.696 19.760 ( -12.003 11.196 -12.893) 20.873 21.081 ( -23.996 -10.350 7.662) 27.233 23.342 ( -0.504 0.413 1.620) 1.746 23.890 ( 2.564 -1.504 0.416) 3.001 ======================= Grid point 143 (63/361) ======================= q-point: (-0.30 0.30 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.516 ( 5.934 22.742 8.362) 24.947 1.645 ( 2.180 28.906 3.799) 29.236 2.796 ( -1.210 28.093 13.335) 31.120 2.959 ( -1.617 -12.213 0.639) 12.336 3.407 ( -2.038 -9.015 3.198) 9.780 3.617 ( -1.803 -2.036 4.343) 5.124 3.900 ( -13.183 -5.320 20.592) 25.023 4.437 ( -7.511 -8.712 -9.856) 15.147 4.644 ( 1.932 -11.072 -2.698) 11.559 4.938 ( -1.641 -7.016 6.434) 9.660 5.091 ( -1.547 -10.608 8.165) 13.475 5.466 ( -0.096 0.454 2.500) 2.543 5.798 ( -0.599 -2.150 1.692) 2.801 6.485 ( 9.240 -2.009 -3.950) 10.247 6.590 ( -8.058 6.023 3.410) 10.623 7.095 ( 1.121 -5.137 -10.010) 11.307 7.849 ( 0.115 -10.992 10.784) 15.399 8.405 ( -4.308 6.418 -10.497) 13.036 8.841 ( -1.118 -8.381 -2.504) 8.818 9.214 ( 0.910 -0.212 7.493) 7.551 10.355 ( -2.284 15.103 -0.179) 15.275 10.401 ( 1.114 21.739 -1.304) 21.807 10.989 ( -6.483 7.095 12.230) 15.554 11.433 ( 2.255 -0.693 -3.570) 4.279 11.874 ( 4.813 4.090 5.827) 8.593 12.278 ( -1.353 -9.741 -2.842) 10.237 12.963 ( -4.681 -0.915 -10.819) 11.824 14.159 ( 4.427 -14.785 -15.793) 22.082 16.943 ( 7.743 -6.081 18.099) 20.603 18.182 ( -3.575 -1.687 -6.544) 7.645 19.097 ( 4.232 3.875 -0.985) 5.822 19.288 ( -9.151 0.483 -15.621) 18.111 19.767 ( 15.510 14.879 10.855) 24.078 21.017 ( -8.246 -10.115 8.762) 15.719 23.336 ( -1.107 0.021 0.282) 1.142 23.862 ( -4.382 0.801 -5.103) 6.774 ======================= Grid point 144 (64/361) ======================= q-point: (-0.20 0.30 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.509 ( 7.816 26.175 4.899) 27.753 1.695 ( 19.009 13.376 15.623) 28.006 2.837 ( 6.528 22.378 25.924) 34.863 3.084 ( 4.836 -10.616 -2.408) 11.912 3.421 ( -9.428 -2.098 5.202) 10.970 3.686 ( -0.671 -6.875 3.456) 7.723 4.022 ( -11.293 -4.846 22.719) 25.830 4.364 ( 2.043 -6.733 -8.343) 10.914 4.799 ( 4.165 -13.860 1.110) 14.514 5.013 ( 0.096 -3.736 0.993) 3.867 5.234 ( 0.472 -5.791 3.629) 6.850 5.547 ( 3.221 -2.728 6.730) 7.945 5.781 ( -6.485 -0.183 2.673) 7.016 6.458 ( -4.492 7.224 0.762) 8.541 6.632 ( 7.484 -7.123 -1.915) 10.508 7.007 ( -0.557 -4.291 -12.474) 13.204 8.085 ( 4.023 -8.761 8.672) 12.967 8.146 ( -6.869 9.039 -6.416) 13.040 8.874 ( 0.683 -8.820 -5.040) 10.182 9.288 ( -1.130 -0.229 4.126) 4.284 10.078 ( 5.422 25.606 -7.903) 27.341 10.337 ( -4.880 6.569 5.357) 9.781 10.988 ( -7.412 5.253 12.483) 15.439 11.452 ( 7.250 0.068 -4.916) 8.760 11.979 ( 5.648 6.821 4.935) 10.138 12.291 ( -1.735 -6.489 -2.035) 7.019 12.704 ( -8.890 3.946 -10.038) 13.977 14.097 ( -1.048 -12.931 -19.797) 23.669 17.389 ( 7.878 -12.101 21.095) 25.564 18.049 ( -5.320 -4.462 -8.889) 11.279 18.905 ( -18.731 -2.225 -2.287) 19.001 19.108 ( -6.916 6.996 -2.166) 10.072 19.929 ( 15.415 13.912 5.105) 21.383 21.267 ( 13.874 -12.380 6.962) 19.855 23.323 ( -1.403 -1.407 -1.118) 2.280 23.641 ( -8.171 8.506 -8.455) 14.512 ======================= Grid point 145 (65/361) ======================= q-point: (-0.10 0.30 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.546 ( 10.365 14.582 11.421) 21.225 2.075 ( 16.923 9.710 20.577) 28.356 3.105 ( 9.472 3.388 10.492) 14.536 3.209 ( 8.030 -3.232 0.696) 8.684 3.400 ( -6.522 -0.126 14.233) 15.657 3.765 ( 0.698 -7.819 -1.155) 7.935 4.203 ( -2.876 -0.246 19.143) 19.359 4.361 ( 2.117 -1.298 -5.535) 6.067 4.926 ( -5.805 -7.987 2.695) 10.235 5.092 ( 5.618 -4.841 2.026) 7.687 5.272 ( 1.222 1.819 -1.458) 2.633 5.713 ( -6.872 -1.526 4.217) 8.206 5.787 ( 4.889 -9.770 12.614) 16.687 6.328 ( -5.573 9.180 0.426) 10.748 6.704 ( -2.406 -8.099 -6.115) 10.430 6.909 ( 4.315 -4.820 -12.596) 14.160 7.918 ( -7.633 13.552 1.657) 15.642 8.304 ( 3.588 -8.563 5.400) 10.740 8.878 ( -1.010 -6.372 -5.899) 8.742 9.274 ( 0.329 5.102 -0.261) 5.119 9.936 ( 8.245 11.339 -5.352) 15.006 10.260 ( -3.021 4.271 0.096) 5.232 10.977 ( -7.407 2.659 9.477) 12.319 11.518 ( 10.530 0.653 -4.420) 11.439 11.971 ( 2.525 11.273 -1.282) 11.623 12.289 ( -5.171 -3.376 -1.458) 6.345 12.554 ( -1.022 1.955 4.773) 5.258 13.901 ( -6.435 -9.356 -20.963) 23.841 17.757 ( 0.077 -8.134 12.501) 14.915 17.956 ( 3.133 -7.615 -9.147) 12.307 18.679 ( -20.995 -4.387 5.177) 22.064 18.842 ( -14.203 13.188 -1.128) 19.414 20.120 ( 16.330 5.151 4.777) 17.777 21.655 ( 17.820 -11.910 -0.506) 21.439 23.224 ( -5.353 6.903 -7.268) 11.364 23.436 ( -0.734 3.715 -0.699) 3.850 ======================= Grid point 150 (66/361) ======================= q-point: ( 0.40 -0.60 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.249 ( -9.973 -0.000 0.885) 10.012 2.365 ( -5.628 -0.000 2.150) 6.025 2.727 ( -13.180 -0.000 -5.036) 14.110 2.914 ( -3.713 -0.000 -0.352) 3.730 3.466 ( -2.094 -0.000 0.481) 2.149 3.729 ( -9.473 -0.000 -1.536) 9.597 4.103 ( -8.656 -0.000 -1.242) 8.745 4.230 ( -0.062 -0.000 8.056) 8.056 4.487 ( -2.897 -0.000 1.539) 3.281 4.750 ( -1.731 -0.000 2.639) 3.156 4.923 ( -15.703 -0.000 1.321) 15.759 5.641 ( 6.543 0.000 -2.406) 6.972 5.759 ( -23.837 -0.000 3.928) 24.158 6.588 ( 2.854 0.000 -10.534) 10.914 6.603 ( 2.430 0.000 3.064) 3.910 7.100 ( -7.724 -0.000 8.373) 11.391 7.490 ( -1.121 -0.000 2.314) 2.572 8.684 ( -2.387 -0.000 2.144) 3.209 8.760 ( -1.637 -0.000 4.763) 5.037 9.024 ( 4.361 0.000 -3.715) 5.729 10.352 ( 3.684 0.000 4.762) 6.021 11.072 ( -6.881 -0.000 2.034) 7.175 11.502 ( -3.742 -0.000 6.223) 7.262 11.502 ( 0.051 0.000 -8.641) 8.642 11.757 ( 1.318 0.000 2.557) 2.877 11.947 ( -4.283 -0.000 -5.468) 6.946 12.720 ( 14.602 0.000 8.663) 16.978 13.855 ( 9.742 0.000 -4.199) 10.609 16.827 ( -3.642 -0.000 -12.155) 12.689 18.169 ( 4.318 0.000 7.008) 8.231 18.873 ( 20.485 0.000 -9.552) 22.603 18.996 ( 19.399 0.000 12.766) 23.222 20.354 ( -14.933 -0.000 -22.519) 27.020 21.116 ( -22.248 -0.000 12.339) 25.440 23.301 ( 1.549 0.000 4.400) 4.664 23.808 ( 5.373 0.000 0.742) 5.424 ======================= Grid point 152 (67/361) ======================= q-point: (-0.50 0.40 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.060 ( -6.272 15.970 0.832) 17.178 2.284 ( -3.784 16.354 5.356) 17.620 2.597 ( -6.870 -11.218 0.436) 13.162 2.952 ( -3.110 -14.941 -1.347) 15.321 3.429 ( -2.259 4.061 2.314) 5.191 3.597 ( -3.769 1.672 -2.811) 4.990 3.934 ( -4.223 15.524 8.685) 18.282 4.414 ( -4.250 -10.423 3.977) 11.938 4.513 ( -3.615 -8.681 9.142) 13.115 4.592 ( -5.528 -3.412 -13.733) 15.192 4.881 ( -10.659 -1.779 14.726) 18.266 5.520 ( -10.346 0.227 -0.562) 10.363 5.713 ( 4.383 -0.640 0.565) 4.465 6.496 ( 5.793 3.278 -10.563) 12.485 6.668 ( -0.263 -3.272 0.276) 3.294 7.088 ( -5.947 -0.278 5.216) 7.916 7.530 ( -2.384 -4.285 6.323) 8.002 8.647 ( -1.763 2.851 -1.919) 3.862 8.749 ( -2.205 -2.506 -2.824) 4.373 9.095 ( 3.015 -0.583 5.216) 6.052 10.424 ( -1.361 1.091 5.755) 6.014 11.003 ( -2.651 4.846 0.640) 5.560 11.327 ( -0.554 20.453 -1.198) 20.495 11.457 ( -3.327 1.528 -1.522) 3.965 11.852 ( 2.422 -1.796 -0.125) 3.017 11.935 ( -1.733 -14.403 2.023) 14.647 12.936 ( 5.048 -1.887 2.266) 5.846 13.921 ( 8.018 -5.353 -9.689) 13.669 16.733 ( 1.675 0.060 -0.411) 1.725 18.240 ( 0.846 -0.073 -1.706) 1.905 19.049 ( 18.781 2.200 -6.080) 19.862 19.396 ( 14.072 -0.444 6.915) 15.685 19.921 ( -8.019 5.613 -11.715) 15.266 20.945 ( -21.769 -4.454 8.393) 23.753 23.346 ( -1.239 0.102 2.775) 3.041 23.872 ( 3.235 -0.539 -0.827) 3.382 ======================= Grid point 153 (68/361) ======================= q-point: (-0.40 0.40 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.891 ( 1.783 19.522 4.974) 20.225 2.133 ( 1.114 26.108 5.111) 26.627 2.701 ( 0.407 -14.349 2.945) 14.654 2.995 ( -2.848 -10.740 -2.322) 11.352 3.386 ( 0.266 8.626 5.326) 10.142 3.578 ( -2.584 -3.207 2.108) 4.627 3.924 ( -5.989 9.093 18.609) 21.560 4.316 ( -4.347 -4.725 -12.149) 13.741 4.488 ( -0.398 -5.674 -0.429) 5.704 4.765 ( -0.244 -14.112 10.111) 17.362 4.937 ( -4.802 -5.051 9.905) 12.112 5.473 ( 0.975 0.328 1.721) 2.005 5.774 ( 0.611 -0.825 2.267) 2.489 6.460 ( 8.827 -0.667 -10.658) 13.855 6.648 ( -4.422 0.458 0.385) 4.463 7.058 ( -2.612 1.123 0.075) 2.844 7.654 ( -2.480 -9.914 9.796) 14.157 8.523 ( -1.916 6.542 -7.401) 10.063 8.721 ( -0.704 -5.547 -4.111) 6.940 9.205 ( -0.316 -0.693 8.474) 8.508 10.437 ( -4.625 2.427 6.392) 8.255 10.878 ( 2.891 20.031 -7.062) 21.435 11.145 ( -5.835 13.425 7.117) 16.277 11.420 ( 2.499 -0.687 -3.344) 4.231 11.934 ( 4.909 2.205 6.802) 8.673 12.060 ( -1.726 -14.737 -0.295) 14.840 12.928 ( -5.756 -2.282 -5.784) 8.473 13.936 ( 5.000 -9.668 -14.765) 18.343 16.877 ( 7.519 -1.995 12.538) 14.756 18.160 ( -3.244 -0.846 -8.931) 9.540 19.159 ( 4.141 3.193 -3.762) 6.441 19.274 ( -9.015 -1.601 -15.998) 18.433 20.025 ( 17.892 13.000 14.381) 26.381 20.853 ( -9.179 -8.376 6.636) 14.087 23.335 ( -2.827 -0.128 0.649) 2.903 23.867 ( -1.329 -0.045 -3.644) 3.879 ======================= Grid point 154 (69/361) ======================= q-point: (-0.30 0.40 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.926 ( 10.735 12.930 9.023) 19.075 1.987 ( 7.088 27.043 2.500) 28.068 2.875 ( 5.420 -11.260 -0.885) 12.528 3.065 ( 2.107 -0.945 7.636) 7.977 3.431 ( -0.371 3.292 8.701) 9.310 3.570 ( -5.000 -5.461 0.708) 7.438 4.023 ( -5.267 6.661 23.767) 25.239 4.250 ( 7.174 -5.757 -9.696) 13.365 4.586 ( 1.117 -9.741 4.290) 10.702 4.936 ( -0.182 -6.334 4.377) 7.701 5.094 ( 1.672 -8.645 8.515) 12.249 5.529 ( 3.452 0.319 2.221) 4.117 5.786 ( -3.610 0.360 2.809) 4.588 6.489 ( 8.808 -4.227 -10.873) 14.618 6.580 ( -4.368 1.286 1.862) 4.919 6.984 ( -2.464 2.552 -4.599) 5.808 7.843 ( -2.622 -14.531 8.721) 17.148 8.344 ( -0.404 10.133 -6.093) 11.831 8.728 ( 1.111 -7.333 -5.001) 8.945 9.286 ( -2.671 -0.118 8.225) 8.649 10.394 ( -6.126 4.466 2.894) 8.114 10.595 ( 2.323 27.064 -8.127) 28.353 11.093 ( -6.294 6.181 10.200) 13.486 11.450 ( 7.794 -0.397 -4.922) 9.227 12.053 ( 2.644 -1.496 0.959) 3.185 12.169 ( 1.500 -4.605 7.642) 9.047 12.721 ( -11.863 -1.122 -8.339) 14.544 13.873 ( 0.825 -11.577 -19.070) 22.324 17.232 ( 9.590 -6.106 19.454) 22.532 17.988 ( -5.296 -2.593 -11.424) 12.856 18.873 ( -16.449 -1.317 -10.046) 19.319 19.187 ( -2.395 2.593 -1.900) 4.009 20.223 ( 11.540 18.479 7.954) 23.193 21.060 ( 12.276 -12.040 7.908) 18.926 23.296 ( -3.381 -1.493 -1.021) 3.835 23.743 ( -5.135 3.739 -6.514) 9.099 ======================= Grid point 155 (70/361) ======================= q-point: (-0.20 0.40 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.873 ( 7.563 21.235 2.179) 22.646 2.208 ( 16.847 5.970 14.327) 22.907 3.013 ( 6.719 -7.800 -4.165) 11.105 3.184 ( 1.563 -2.620 1.290) 3.312 3.516 ( 0.297 8.655 17.817) 19.811 3.590 ( -2.144 -10.885 -0.742) 11.118 4.221 ( 5.194 2.624 14.855) 15.954 4.348 ( 6.935 -0.294 2.822) 7.493 4.751 ( -2.506 -10.481 7.899) 13.361 5.007 ( -0.742 -5.377 2.353) 5.916 5.274 ( 4.478 -1.773 6.180) 7.835 5.620 ( 4.139 -4.774 1.398) 6.472 5.748 ( -5.663 1.241 4.763) 7.503 6.466 ( 1.579 4.327 -4.311) 6.309 6.569 ( -2.783 -6.627 -3.867) 8.162 6.858 ( 0.217 1.064 -8.560) 8.628 7.965 ( -8.168 -10.504 1.831) 13.432 8.263 ( 5.060 6.491 2.534) 8.612 8.751 ( 0.917 -7.385 -5.375) 9.180 9.329 ( -1.710 1.984 6.344) 6.863 10.230 ( 2.880 14.394 -10.205) 17.878 10.356 ( -7.800 12.390 2.088) 14.789 11.067 ( -5.595 6.341 8.519) 12.004 11.523 ( 11.048 -0.032 -5.156) 12.192 12.059 ( -0.079 -2.590 -3.971) 4.742 12.277 ( -3.722 3.480 3.909) 6.422 12.556 ( -3.613 -1.794 4.792) 6.264 13.717 ( -3.528 -10.980 -21.130) 24.072 17.630 ( 5.626 -6.322 17.063) 19.047 17.839 ( -0.636 -5.418 -9.986) 11.379 18.592 ( -15.160 -4.396 -4.926) 16.535 19.041 ( -12.873 8.261 2.929) 15.573 20.281 ( 12.133 12.927 0.561) 17.738 21.472 ( 18.248 -9.672 6.208) 21.566 23.241 ( -3.965 -2.115 -2.988) 5.396 23.548 ( -3.967 6.763 -5.733) 9.713 ======================= Grid point 156 (71/361) ======================= q-point: (-0.10 0.40 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.878 ( 6.376 9.509 5.276) 12.606 2.564 ( 12.193 3.428 17.126) 21.301 3.078 ( 2.146 -4.594 -5.678) 7.613 3.221 ( 1.632 -5.095 -0.234) 5.355 3.547 ( -2.566 -7.002 -5.163) 9.071 3.813 ( 8.838 2.392 17.628) 19.864 4.361 ( 10.678 1.292 -8.319) 13.598 4.460 ( 0.664 8.522 11.054) 13.973 4.837 ( -10.115 -4.005 9.847) 14.673 5.091 ( -0.648 -6.452 0.871) 6.542 5.424 ( 6.690 4.989 13.835) 16.157 5.688 ( -2.689 -1.948 4.731) 5.780 5.826 ( 0.041 -13.355 3.892) 13.911 6.340 ( -6.938 9.778 -0.842) 12.019 6.497 ( -2.896 -5.095 -6.332) 8.628 6.833 ( 6.485 -4.250 -7.364) 10.693 7.875 ( -11.150 1.411 2.581) 11.532 8.372 ( 4.607 -2.237 3.184) 6.030 8.743 ( -1.175 -4.831 -4.838) 6.937 9.370 ( 3.078 4.378 4.532) 7.013 10.073 ( 5.314 15.328 -6.391) 17.437 10.168 ( -8.191 -2.394 -3.648) 9.281 11.041 ( -3.021 5.877 7.404) 9.923 11.625 ( 10.743 0.016 -3.792) 11.392 12.026 ( -0.215 -0.104 -3.136) 3.145 12.148 ( -9.138 1.829 -0.154) 9.321 12.705 ( 5.227 1.704 10.972) 12.272 13.496 ( -6.414 -8.521 -18.141) 21.044 17.714 ( -3.210 -3.905 -1.594) 5.300 17.992 ( 11.388 -6.142 2.367) 13.154 18.410 ( -13.140 -6.290 -1.101) 14.610 18.767 ( -17.085 14.575 3.645) 22.751 20.376 ( 11.371 2.188 -0.279) 11.583 21.809 ( 14.100 -3.798 1.501) 14.679 23.142 ( -2.776 3.003 -4.599) 6.154 23.437 ( -0.491 1.273 -1.610) 2.110 ======================= Grid point 162 (72/361) ======================= q-point: (-0.50 0.50 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.114 ( -0.878 -0.000 2.074) 2.252 2.434 ( -2.052 0.000 10.934) 11.124 2.553 ( 3.865 0.000 5.235) 6.507 2.774 ( -1.008 -0.000 -6.854) 6.928 3.490 ( 0.235 0.000 3.293) 3.301 3.523 ( -4.828 -0.000 0.342) 4.840 4.068 ( -0.077 -0.000 9.694) 9.695 4.275 ( -3.364 -0.000 -12.914) 13.345 4.510 ( -2.108 0.000 7.183) 7.486 4.519 ( -1.623 -0.000 11.320) 11.436 4.899 ( -5.136 -0.000 9.968) 11.213 5.476 ( 1.579 -0.000 1.654) 2.287 5.767 ( 0.805 -0.000 2.588) 2.710 6.457 ( 8.893 -0.000 -14.474) 16.988 6.642 ( -1.988 -0.000 -0.891) 2.179 7.085 ( -5.600 -0.000 7.152) 9.083 7.555 ( -2.763 -0.000 7.359) 7.860 8.609 ( -1.088 -0.000 -3.863) 4.013 8.648 ( -0.940 0.000 -7.199) 7.260 9.197 ( -0.587 -0.000 8.959) 8.978 10.458 ( -4.785 -0.000 6.443) 8.025 11.019 ( 0.120 -0.000 0.966) 0.974 11.383 ( 5.065 0.000 -5.726) 7.645 11.411 ( -4.924 -0.000 -4.096) 6.405 11.843 ( -1.597 -0.000 3.189) 3.567 11.965 ( 4.263 -0.000 8.771) 9.752 12.905 ( -6.121 -0.000 -4.374) 7.523 13.848 ( 5.160 -0.000 -14.362) 15.261 16.861 ( 7.461 -0.000 10.872) 13.186 18.153 ( -3.074 -0.000 -9.792) 10.263 19.196 ( 9.674 -0.000 -4.672) 10.744 19.251 ( -14.569 -0.000 -15.883) 21.553 20.156 ( 21.583 -0.000 16.137) 26.948 20.765 ( -12.467 -0.000 5.362) 13.571 23.334 ( -3.506 -0.000 0.793) 3.595 23.866 ( -0.295 -0.000 -3.329) 3.342 ======================= Grid point 164 (73/361) ======================= q-point: (-0.40 0.50 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.112 ( 3.787 7.046 3.339) 8.668 2.419 ( 1.734 19.464 3.427) 19.839 2.719 ( 10.107 -3.608 2.998) 11.142 2.888 ( 5.795 -15.662 2.040) 16.824 3.467 ( -2.127 0.852 1.330) 2.649 3.507 ( -5.902 -2.095 4.823) 7.905 4.167 ( 9.043 -0.655 -11.223) 14.428 4.212 ( 2.416 6.638 16.816) 18.240 4.515 ( -2.355 4.399 8.918) 10.219 4.740 ( -2.950 -14.771 11.654) 19.045 5.005 ( 4.792 -1.773 7.349) 8.951 5.540 ( 4.059 0.516 0.992) 4.210 5.790 ( -2.472 0.103 3.192) 4.039 6.429 ( 10.961 -1.867 -14.649) 18.391 6.581 ( -4.408 -0.636 -1.975) 4.872 7.072 ( -4.389 5.110 4.943) 8.355 7.625 ( -4.246 -8.475 6.257) 11.358 8.497 ( 0.331 7.462 -5.511) 9.282 8.614 ( 0.810 -6.143 -5.230) 8.108 9.283 ( -2.904 -0.117 9.953) 10.369 10.434 ( -8.151 0.980 4.925) 9.573 10.983 ( 4.361 12.082 -7.749) 15.001 11.222 ( -6.349 9.708 2.309) 11.828 11.430 ( 8.243 -2.367 -6.047) 10.493 11.897 ( -3.058 -9.899 1.495) 10.468 12.176 ( 6.340 1.409 14.675) 16.048 12.695 ( -13.670 -1.143 -7.260) 15.521 13.725 ( 1.715 -4.615 -18.369) 19.017 17.165 ( 10.190 -1.772 17.592) 20.407 17.958 ( -5.089 -0.876 -12.927) 13.920 18.858 ( -15.398 -0.365 -13.814) 20.690 19.213 ( -0.834 0.597 -1.791) 2.064 20.544 ( 11.368 17.594 10.140) 23.272 20.829 ( 10.006 -14.601 8.446) 19.613 23.276 ( -4.599 -0.629 -1.126) 4.776 23.784 ( -3.334 1.070 -5.568) 6.578 ======================= Grid point 165 (74/361) ======================= q-point: (-0.30 0.50 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.192 ( 6.894 10.127 2.537) 12.510 2.332 ( 8.410 11.593 2.007) 14.462 2.908 ( 10.793 -2.948 -1.360) 11.271 3.118 ( 8.495 -6.112 0.834) 10.499 3.394 ( -6.829 -8.597 -5.279) 12.183 3.623 ( -0.749 2.224 20.978) 21.109 4.238 ( 14.934 -2.115 -8.782) 17.454 4.414 ( 3.979 8.445 20.949) 22.934 4.602 ( -2.587 -5.077 10.791) 12.203 4.891 ( -4.675 -8.155 5.410) 10.846 5.230 ( 8.978 -2.489 10.751) 14.226 5.581 ( 3.170 -0.508 -2.535) 4.090 5.770 ( -4.638 1.005 2.972) 5.600 6.448 ( 10.499 -3.352 -12.252) 16.480 6.500 ( -4.075 -2.497 -3.812) 6.113 6.973 ( -5.066 10.327 1.221) 11.567 7.711 ( -7.083 -15.377 2.812) 17.162 8.403 ( 2.750 7.834 -1.826) 8.501 8.633 ( 1.754 -6.110 -4.145) 7.589 9.356 ( -2.582 1.064 9.957) 10.342 10.315 ( -10.989 1.424 -1.203) 11.146 10.741 ( 3.093 23.191 -11.098) 25.895 11.167 ( -4.961 4.666 8.216) 10.672 11.510 ( 11.204 -1.971 -6.654) 13.180 11.941 ( -3.383 -8.640 -0.467) 9.290 12.357 ( -6.730 4.027 2.347) 8.186 12.505 ( -1.717 -3.312 9.265) 9.988 13.548 ( -1.669 -7.432 -20.867) 22.214 17.543 ( 9.008 -3.433 18.496) 20.857 17.769 ( -2.744 -2.559 -10.935) 11.561 18.535 ( -12.888 -2.058 -9.649) 16.231 19.133 ( -8.725 2.827 2.097) 9.408 20.533 ( 6.651 14.108 -2.413) 15.783 21.305 ( 18.693 -9.144 13.240) 24.664 23.200 ( -4.922 -2.022 -2.360) 5.821 23.638 ( -3.708 3.422 -6.725) 8.408 ======================= Grid point 166 (75/361) ======================= q-point: (-0.20 0.50 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.086 ( 2.020 12.757 -6.070) 14.271 2.562 ( 11.475 -2.493 10.673) 15.868 3.013 ( 3.788 -2.014 -5.015) 6.600 3.189 ( 3.254 0.002 -1.681) 3.663 3.403 ( 4.697 -8.039 -4.297) 10.254 3.887 ( 3.275 4.581 24.825) 25.456 4.355 ( 13.681 -1.853 -10.264) 17.203 4.604 ( 0.382 7.516 12.618) 14.692 4.739 ( -6.960 -6.870 13.246) 16.465 4.950 ( -3.326 -8.297 6.605) 11.114 5.496 ( 6.053 2.639 11.508) 13.267 5.600 ( 4.788 -5.067 -2.440) 7.386 5.735 ( -4.766 -0.201 4.100) 6.290 6.378 ( -6.651 -2.893 -7.282) 10.278 6.501 ( 8.887 1.087 -6.593) 11.119 6.828 ( -2.038 6.492 -1.436) 6.954 7.744 ( -10.150 -14.435 0.760) 17.662 8.399 ( 4.128 4.347 1.432) 6.163 8.661 ( 1.268 -4.489 -3.060) 5.579 9.432 ( 0.348 2.869 8.849) 9.309 10.107 ( -9.992 -1.212 -7.162) 12.354 10.457 ( 0.844 23.161 -7.134) 24.249 11.149 ( -4.322 5.669 7.106) 10.066 11.612 ( 11.117 -1.944 -5.446) 12.531 11.942 ( -3.992 -6.448 -2.168) 7.887 12.181 ( -9.694 -0.221 -0.045) 9.697 12.738 ( 5.873 1.945 14.353) 15.629 13.341 ( -3.335 -8.333 -18.668) 20.714 17.659 ( -0.757 -2.462 -4.513) 5.196 17.897 ( 8.971 -4.346 10.245) 14.294 18.318 ( -9.479 -3.970 -5.240) 11.535 18.966 ( -14.833 7.799 4.652) 17.393 20.471 ( 7.753 7.946 -7.475) 13.384 21.745 ( 15.256 -3.588 11.061) 19.182 23.128 ( -4.072 -2.961 -2.692) 5.709 23.492 ( -1.516 3.759 -5.866) 7.130 ======================= Grid point 167 (76/361) ======================= q-point: (-0.10 0.50 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.953 ( -2.178 -0.033 -5.508) 5.923 2.811 ( -1.637 -3.189 6.080) 7.058 2.939 ( 0.846 -7.870 -8.312) 11.478 3.268 ( 3.004 -0.710 3.672) 4.797 3.498 ( 10.182 5.358 0.592) 11.521 4.154 ( 5.156 3.317 12.795) 14.188 4.380 ( 8.071 -0.736 -12.418) 14.829 4.584 ( -4.615 7.543 6.572) 11.018 4.796 ( -12.219 -0.065 12.365) 17.384 5.046 ( 0.647 -1.635 -1.272) 2.170 5.536 ( -8.418 -15.752 -3.607) 18.220 5.730 ( -3.899 -0.701 4.607) 6.076 5.853 ( 8.566 4.536 19.504) 21.780 6.222 ( -5.617 -1.539 -3.333) 6.711 6.502 ( 1.670 7.124 0.902) 7.372 6.833 ( 7.578 -4.201 -3.239) 9.250 7.724 ( -9.874 -8.979 3.305) 13.749 8.435 ( 2.123 1.378 -0.527) 2.585 8.681 ( 1.663 -1.758 -0.657) 2.507 9.504 ( 1.177 4.293 4.747) 6.508 9.947 ( -7.199 -8.299 -4.971) 12.059 10.216 ( 4.258 19.107 -6.236) 20.545 11.125 ( -5.596 3.017 7.664) 9.957 11.708 ( 8.053 -1.210 -3.829) 8.998 11.910 ( -2.223 -5.171 -2.822) 6.296 12.117 ( -3.793 1.230 4.101) 5.720 12.831 ( -1.280 0.592 -7.041) 7.181 13.279 ( 4.151 -3.555 3.102) 6.284 17.652 ( 1.644 -2.190 -2.284) 3.565 18.034 ( 1.438 -4.606 -8.485) 9.761 18.293 ( 2.207 -2.840 6.725) 7.626 18.701 ( -17.663 13.142 4.921) 22.560 20.452 ( 6.298 -1.943 -7.561) 10.031 22.017 ( 7.934 4.107 7.551) 11.698 23.090 ( -0.540 -1.714 -1.503) 2.343 23.409 ( 0.243 0.089 -3.596) 3.605 ======================= Grid point 174 (77/361) ======================= q-point: (-0.40 0.60 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.253 ( 8.795 0.000 5.030) 10.131 2.488 ( -1.150 -0.000 -8.316) 8.395 2.958 ( 19.615 0.000 -1.489) 19.672 2.962 ( 8.951 0.000 7.822) 11.887 3.324 ( -9.039 -0.000 -6.880) 11.360 3.634 ( -0.781 -0.000 22.177) 22.190 4.209 ( 17.583 0.000 -12.555) 21.605 4.482 ( -0.066 -0.000 19.255) 19.255 4.634 ( 0.245 0.000 4.549) 4.555 4.761 ( -5.525 -0.000 15.268) 16.237 5.206 ( 10.299 0.000 11.463) 15.410 5.579 ( 2.632 0.000 -3.485) 4.368 5.779 ( -4.179 -0.000 2.641) 4.944 6.417 ( 13.723 0.000 -14.561) 20.008 6.473 ( -5.615 -0.000 -3.692) 6.720 7.105 ( -4.891 -0.000 5.777) 7.570 7.536 ( -8.375 -0.000 0.855) 8.418 8.521 ( 2.042 0.000 -4.387) 4.839 8.532 ( 2.240 0.000 -2.232) 3.162 9.365 ( -2.678 -0.000 11.055) 11.375 10.326 ( -12.644 -0.000 -0.116) 12.645 10.989 ( 6.027 0.000 -14.924) 16.096 11.217 ( -5.296 -0.000 6.257) 8.197 11.467 ( 10.032 0.000 -7.131) 12.308 11.844 ( -4.191 -0.000 4.651) 6.260 12.396 ( -16.472 -0.000 -5.633) 17.408 12.469 ( 6.891 0.000 17.813) 19.099 13.480 ( -1.043 -0.000 -20.676) 20.702 17.513 ( 9.947 0.000 18.544) 21.043 17.747 ( -3.163 -0.000 -11.248) 11.684 18.518 ( -12.167 -0.000 -11.173) 16.519 19.156 ( -7.303 -0.000 1.548) 7.465 20.685 ( 3.095 0.000 -6.435) 7.140 21.203 ( 20.439 0.000 19.154) 28.011 23.181 ( -5.422 -0.000 -2.393) 5.926 23.668 ( -3.404 -0.000 -6.878) 7.675 ======================= Grid point 176 (78/361) ======================= q-point: (-0.30 0.60 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.266 ( -2.542 6.314 -15.732) 17.141 2.512 ( 13.485 -2.299 8.142) 15.920 3.026 ( -6.734 2.490 -6.595) 9.749 3.179 ( 4.110 -0.994 1.861) 4.620 3.292 ( 20.779 -4.144 -0.019) 21.188 3.949 ( 2.022 2.147 28.588) 28.739 4.314 ( 14.503 -1.866 -10.842) 18.203 4.618 ( -6.940 -4.872 9.758) 12.927 4.724 ( 1.320 5.544 12.031) 13.313 4.837 ( -5.948 -4.791 9.294) 12.030 5.511 ( -0.289 -0.201 -2.026) 2.056 5.562 ( 12.122 -0.195 11.604) 16.782 5.740 ( -4.514 0.294 1.799) 4.869 6.344 ( -5.549 -0.854 -5.856) 8.113 6.472 ( 15.707 -2.051 -12.587) 20.232 7.028 ( -6.420 12.673 3.910) 14.734 7.461 ( -11.117 -14.817 -0.453) 18.529 8.484 ( 2.960 4.652 -1.316) 5.668 8.584 ( 2.817 -4.130 -1.350) 5.178 9.468 ( -0.435 1.112 10.973) 11.038 10.097 ( -14.438 -0.194 -5.919) 15.606 10.819 ( 4.778 14.637 -13.807) 20.681 11.221 ( -5.856 2.253 7.113) 9.485 11.541 ( 8.683 -5.248 -6.344) 11.966 11.854 ( -3.842 -2.617 3.054) 5.562 12.155 ( -12.014 -1.594 -0.945) 12.156 12.766 ( 6.206 0.944 16.337) 17.501 13.233 ( -1.597 -3.419 -19.085) 19.455 17.629 ( 0.673 -0.936 -6.531) 6.632 17.846 ( 7.731 -1.427 14.820) 16.776 18.273 ( -7.361 -1.246 -7.824) 10.814 19.047 ( -12.210 2.009 4.122) 13.043 20.602 ( 4.305 5.018 -11.688) 13.429 21.691 ( 16.058 -2.105 18.249) 24.399 23.081 ( -5.436 -1.673 -2.649) 6.275 23.540 ( -1.536 1.503 -7.506) 7.808 ======================= Grid point 177 (79/361) ======================= q-point: (-0.20 -0.40 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.972 ( -5.696 1.485 -17.084) 18.070 2.731 ( -14.662 -5.854 -6.656) 17.133 2.841 ( 11.596 -2.053 2.975) 12.146 3.305 ( 6.467 4.621 5.250) 9.526 3.590 ( 20.472 2.987 0.334) 20.691 4.205 ( 3.448 3.261 5.607) 7.345 4.359 ( 1.495 -0.697 -0.660) 1.777 4.678 ( -9.776 -2.756 14.352) 17.582 4.759 ( -4.538 0.746 8.186) 9.390 4.970 ( 0.208 -5.566 8.419) 10.094 5.360 ( -7.308 -4.070 -11.358) 14.106 5.715 ( -3.805 -0.974 4.104) 5.681 5.911 ( 8.014 1.851 14.128) 16.348 6.222 ( -1.281 1.400 -1.976) 2.740 6.580 ( 14.577 -0.921 -8.170) 16.736 6.862 ( -5.315 10.414 2.998) 12.070 7.472 ( -9.922 -17.993 2.042) 20.648 8.481 ( 2.371 3.139 -0.729) 4.001 8.645 ( 3.459 -2.248 -0.069) 4.126 9.576 ( 0.895 3.452 8.178) 8.922 9.841 ( -11.614 -3.710 -6.970) 14.044 10.579 ( 4.437 19.754 -11.069) 23.075 11.166 ( -10.983 1.654 6.985) 13.121 11.643 ( 7.395 -6.816 -4.663) 11.085 11.843 ( -2.954 -1.750 0.905) 3.551 12.092 ( -3.942 -2.839 4.167) 6.400 12.829 ( -3.391 -0.573 -12.097) 12.576 13.230 ( 9.022 -1.815 9.566) 13.274 17.622 ( 3.789 -1.246 -2.440) 4.675 17.972 ( -1.378 -2.370 -6.789) 7.322 18.257 ( 4.858 -1.194 8.800) 10.122 18.872 ( -16.346 6.207 5.458) 18.317 20.466 ( 4.011 2.528 -14.576) 15.328 22.076 ( 9.498 2.477 16.493) 19.193 23.018 ( -3.643 -4.777 -1.187) 6.124 23.435 ( 0.912 1.816 -7.178) 7.461 ======================= Grid point 178 (80/361) ======================= q-point: (-0.10 -0.40 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.727 ( -7.468 -8.047 -12.884) 16.927 2.438 ( -19.506 -13.383 -12.084) 26.563 3.058 ( 8.961 2.625 4.628) 10.422 3.379 ( 2.022 4.843 4.726) 7.062 3.778 ( 11.391 10.086 2.103) 15.359 4.100 ( -4.121 -2.955 -16.889) 17.634 4.328 ( -9.950 -1.135 1.815) 10.178 4.751 ( -11.217 -3.184 5.968) 13.098 4.772 ( 0.251 9.722 16.290) 18.972 5.062 ( 0.478 4.808 1.282) 4.999 5.187 ( -6.370 -11.307 -7.034) 14.761 5.721 ( -5.408 -0.591 3.791) 6.631 6.024 ( 0.002 -9.829 1.236) 9.906 6.291 ( -2.115 10.224 14.350) 17.746 6.645 ( 4.342 9.890 5.565) 12.151 6.891 ( 9.433 -6.015 1.301) 11.263 7.548 ( -5.412 -15.884 3.888) 17.225 8.447 ( -0.350 4.418 -2.811) 5.248 8.732 ( 5.754 -1.338 1.583) 6.116 9.508 ( -8.780 2.819 -2.605) 9.582 9.810 ( 2.372 -6.971 1.740) 7.566 10.370 ( 6.283 17.475 -8.350) 20.361 11.078 ( -14.939 -2.216 9.127) 17.646 11.728 ( 4.210 -2.928 -4.040) 6.528 11.871 ( 1.807 -5.513 2.478) 6.309 12.147 ( -0.063 -0.580 6.229) 6.256 12.586 ( -5.095 -1.343 -17.874) 18.634 13.546 ( 13.096 1.794 14.809) 19.850 17.647 ( 1.483 1.242 -4.258) 4.677 17.875 ( 4.210 -5.169 -12.345) 14.030 18.464 ( 7.465 0.805 8.465) 11.315 18.624 ( -17.356 10.435 5.635) 21.021 20.350 ( 1.798 -5.104 -13.659) 14.692 22.260 ( 0.061 10.745 12.884) 16.777 23.062 ( 1.003 -7.280 3.206) 8.018 23.370 ( 2.160 0.224 -5.841) 6.231 ======================= Grid point 186 (81/361) ======================= q-point: (-0.30 -0.30 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.987 ( -6.275 -0.000 -22.060) 22.935 2.669 ( -19.664 -0.000 -9.581) 21.874 2.831 ( 15.785 0.000 6.563) 17.095 3.369 ( 6.505 0.000 6.660) 9.309 3.598 ( 24.274 0.000 -0.693) 24.284 4.250 ( 9.849 0.000 -8.236) 12.839 4.374 ( -4.924 -0.000 19.248) 19.868 4.563 ( -9.324 -0.000 6.503) 11.367 4.819 ( -8.448 -0.000 14.462) 16.749 4.904 ( 1.365 0.000 7.423) 7.547 5.336 ( -6.556 -0.000 -10.598) 12.461 5.704 ( -3.620 -0.000 2.424) 4.356 5.925 ( 6.014 0.000 11.140) 12.660 6.243 ( 2.500 0.000 1.347) 2.840 6.551 ( 17.384 0.000 -11.929) 21.084 7.096 ( -3.956 -0.000 5.840) 7.054 7.182 ( -14.593 -0.000 0.410) 14.599 8.517 ( 1.840 0.000 -1.566) 2.416 8.618 ( 4.573 0.000 0.491) 4.599 9.609 ( 1.972 0.000 9.980) 10.173 9.809 ( -14.486 -0.000 -7.745) 16.426 10.788 ( 6.588 0.000 -16.487) 17.754 11.183 ( -12.678 -0.000 7.173) 14.566 11.547 ( 3.551 0.000 -1.253) 3.765 11.833 ( -3.223 -0.000 1.799) 3.691 12.060 ( -2.577 -0.000 3.788) 4.582 12.822 ( -3.594 -0.000 -14.252) 14.698 13.215 ( 10.266 0.000 12.260) 15.991 17.610 ( 4.572 0.000 -2.408) 5.167 17.951 ( -2.569 -0.000 -6.160) 6.674 18.248 ( 6.152 0.000 9.304) 11.154 18.924 ( -15.285 -0.000 5.481) 16.238 20.497 ( 2.605 0.000 -17.090) 17.287 22.098 ( 10.460 0.000 20.617) 23.119 22.970 ( -5.273 -0.000 -1.974) 5.630 23.452 ( 1.237 0.000 -8.160) 8.254 ======================= Grid point 187 (82/361) ======================= q-point: (-0.20 -0.30 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.637 ( -8.338 -2.406 -20.620) 22.372 2.254 ( -23.755 -6.169 -12.230) 27.422 3.115 ( 13.716 2.661 5.990) 15.201 3.460 ( 0.480 3.047 2.908) 4.240 3.877 ( 15.153 1.018 -0.398) 15.192 4.118 ( 1.438 4.002 -19.874) 20.324 4.330 ( -19.929 3.057 6.260) 21.111 4.582 ( -11.392 -12.750 5.870) 18.078 4.921 ( 0.107 7.025 13.148) 14.907 5.022 ( -0.070 -5.075 9.973) 11.190 5.173 ( -2.995 3.087 -0.129) 4.303 5.712 ( -3.823 -0.391 5.963) 7.093 5.895 ( -4.274 -4.194 -6.261) 8.663 6.471 ( 5.932 9.095 15.493) 18.919 6.695 ( 17.175 -5.957 -4.257) 18.670 6.926 ( -7.344 12.420 5.172) 15.328 7.241 ( -4.715 -17.412 4.258) 18.534 8.511 ( 0.702 2.197 -1.224) 2.611 8.703 ( 6.356 -1.276 0.446) 6.498 9.534 ( -11.669 0.525 -6.352) 13.297 9.752 ( 3.228 -0.791 6.602) 7.391 10.635 ( 7.325 9.544 -17.133) 20.935 11.074 ( -17.217 1.777 11.731) 20.909 11.622 ( 2.496 -7.285 1.107) 7.780 11.798 ( -4.617 -1.791 1.013) 5.055 12.135 ( 3.336 -0.374 5.642) 6.565 12.570 ( -3.412 -0.435 -18.165) 18.487 13.564 ( 13.879 0.461 16.347) 21.449 17.675 ( 5.472 1.583 -0.737) 5.744 17.798 ( 0.402 -3.068 -14.409) 14.737 18.479 ( 7.753 0.666 10.857) 13.358 18.751 ( -17.131 3.698 5.795) 18.459 20.304 ( 0.698 -0.830 -19.103) 19.134 22.421 ( 2.842 6.405 21.179) 22.308 22.919 ( -3.278 -6.548 0.842) 7.371 23.387 ( 3.517 0.852 -8.029) 8.807 ======================= Grid point 188 (83/361) ======================= q-point: (-0.10 -0.30 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.359 ( -10.555 -10.712 -13.392) 20.137 1.871 ( -24.080 -14.905 -11.245) 30.471 3.229 ( 0.179 6.590 -2.903) 7.203 3.435 ( -0.805 -1.052 -2.236) 2.599 3.726 ( -20.978 4.925 -9.929) 23.726 3.918 ( -2.881 4.226 -3.070) 5.965 4.175 ( -9.130 -3.449 3.008) 10.213 4.583 ( -7.866 -5.623 4.941) 10.859 5.002 ( 9.593 3.596 -0.926) 10.287 5.084 ( 3.042 2.377 -2.025) 4.359 5.249 ( -4.632 7.475 22.097) 23.782 5.652 ( -4.718 1.281 -2.741) 5.605 5.951 ( -2.354 -12.976 7.971) 15.409 6.435 ( -8.684 16.056 5.938) 19.195 6.881 ( 2.905 8.906 6.485) 11.394 7.037 ( 11.821 -9.160 10.564) 18.309 7.392 ( -1.051 -17.901 2.334) 18.083 8.448 ( -1.985 6.466 -2.533) 7.223 8.832 ( 8.976 -2.137 0.615) 9.248 9.347 ( -7.246 -1.651 -3.098) 8.051 9.860 ( 3.619 -0.351 2.238) 4.269 10.463 ( 7.781 9.784 -14.655) 19.262 10.966 ( -19.910 2.089 16.805) 26.137 11.684 ( 0.058 -2.244 -4.411) 4.949 11.855 ( -2.595 -13.662 9.110) 16.625 12.255 ( 4.407 1.189 5.473) 7.127 12.333 ( -0.425 0.041 -16.884) 16.890 13.938 ( 15.747 2.502 13.882) 21.140 17.527 ( 0.781 2.998 -21.644) 21.865 17.856 ( 9.258 -4.672 -0.986) 10.417 18.531 ( -15.167 7.231 4.650) 17.434 18.682 ( 6.993 1.780 7.928) 10.720 20.115 ( -1.712 -6.431 -16.762) 18.035 22.491 ( -7.487 17.084 14.109) 23.388 23.072 ( 1.496 -13.692 11.581) 17.995 23.345 ( 4.171 1.352 -6.714) 8.019 ======================= Grid point 197 (84/361) ======================= q-point: (-0.20 -0.20 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.263 ( -11.141 -0.000 -17.162) 20.461 1.728 ( -27.341 -0.000 -11.604) 29.702 3.336 ( -13.283 -0.000 -15.914) 20.729 3.372 ( 11.315 0.000 5.153) 12.433 3.808 ( -23.042 -0.000 -8.120) 24.431 3.949 ( -3.762 -0.000 -1.947) 4.236 4.131 ( -9.862 -0.000 3.818) 10.575 4.516 ( -1.442 -0.000 6.134) 6.301 5.033 ( 9.734 0.000 -3.897) 10.485 5.102 ( 4.026 0.000 0.507) 4.058 5.332 ( -6.655 -0.000 25.871) 26.713 5.720 ( -4.950 -0.000 -4.960) 7.007 5.772 ( -2.466 -0.000 10.301) 10.592 6.723 ( -14.088 -0.000 18.082) 22.922 6.783 ( 16.821 0.000 -8.305) 18.760 7.024 ( 2.662 0.000 10.354) 10.691 7.192 ( 1.590 0.000 3.544) 3.885 8.509 ( -1.181 -0.000 -0.864) 1.463 8.806 ( 9.278 0.000 0.031) 9.278 9.330 ( -7.282 -0.000 -5.021) 8.845 9.866 ( 3.193 0.000 4.622) 5.618 10.544 ( 6.586 0.000 -19.896) 20.958 11.041 ( -16.543 -0.000 19.779) 25.785 11.627 ( 0.123 0.000 2.441) 2.444 11.718 ( -7.459 -0.000 2.844) 7.983 12.266 ( 5.634 0.000 5.026) 7.550 12.333 ( -1.153 -0.000 -16.930) 16.969 13.959 ( 15.967 0.000 14.647) 21.667 17.560 ( 2.458 0.000 -24.611) 24.733 17.808 ( 7.599 0.000 2.768) 8.088 18.600 ( -16.003 -0.000 4.671) 16.671 18.700 ( 6.792 0.000 8.498) 10.878 20.059 ( -1.607 -0.000 -19.472) 19.539 22.755 ( -2.530 -0.000 27.824) 27.939 22.833 ( -3.719 -0.000 0.669) 3.779 23.361 ( 4.855 0.000 -7.058) 8.567 ======================= Grid point 198 (85/361) ======================= q-point: (-0.10 -0.20 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.967 ( -16.282 -8.604 -6.371) 19.486 1.278 ( -27.260 -12.813 -7.893) 31.138 2.675 ( -38.752 -3.411 -29.301) 48.702 3.526 ( -1.984 6.130 8.149) 10.388 3.590 ( -4.301 0.820 7.392) 8.591 3.785 ( -11.899 0.717 -3.078) 12.312 4.107 ( -6.279 -0.526 8.090) 10.255 4.572 ( -0.200 -1.667 2.780) 3.248 5.134 ( 8.832 2.756 -2.347) 9.545 5.158 ( 6.459 0.663 0.081) 6.494 5.469 ( -5.492 2.993 13.738) 15.095 5.613 ( -5.279 7.236 5.521) 10.522 5.933 ( -1.477 -10.036 11.364) 15.233 6.534 ( -11.546 22.480 6.950) 26.210 6.987 ( 6.064 -4.950 -1.980) 8.074 7.233 ( 3.948 -8.965 14.368) 17.390 7.288 ( 1.821 -9.066 1.851) 9.430 8.439 ( -4.237 5.305 -1.223) 6.898 8.951 ( 10.652 -0.990 -1.752) 10.840 9.242 ( -0.961 -3.040 -1.050) 3.357 9.933 ( 2.530 2.636 1.286) 3.874 10.398 ( 6.192 0.430 -19.376) 20.345 11.025 ( -19.604 14.544 28.890) 37.822 11.601 ( -2.015 -0.973 -4.380) 4.919 11.786 ( -4.939 -13.813 9.924) 17.711 12.169 ( 3.174 -5.785 -11.797) 13.517 12.389 ( 4.745 0.929 4.002) 6.277 14.319 ( 15.719 1.745 9.918) 18.668 17.252 ( 3.918 2.117 -35.083) 35.364 17.958 ( 7.082 -2.855 3.266) 8.304 18.427 ( -11.805 2.585 1.801) 12.218 18.860 ( 5.253 0.514 5.590) 7.688 19.842 ( -2.607 -4.085 -15.016) 15.779 22.677 ( -8.988 20.918 8.559) 24.323 23.141 ( -0.785 -15.820 22.047) 27.147 23.363 ( 3.156 0.558 0.740) 3.290 ======================= Grid point 208 (86/361) ======================= q-point: (-0.10 -0.10 0.08) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.671 ( -25.584 -0.000 15.312) 29.816 0.761 ( -28.907 -0.000 -0.493) 28.911 1.691 ( -52.922 -0.000 -23.963) 58.094 3.561 ( -5.745 -0.000 6.493) 8.670 3.577 ( -12.520 -0.000 -1.954) 12.672 3.721 ( 4.683 0.000 6.043) 7.646 4.233 ( -4.060 -0.000 28.512) 28.800 4.557 ( -0.900 -0.000 -1.847) 2.055 5.218 ( 2.384 0.000 2.799) 3.676 5.276 ( 9.914 0.000 -1.971) 10.108 5.476 ( -3.648 -0.000 -0.574) 3.692 5.720 ( -7.624 -0.000 19.173) 20.634 6.007 ( 1.915 0.000 7.236) 7.485 6.595 ( -11.493 -0.000 6.743) 13.325 7.013 ( 8.922 0.000 -4.200) 9.861 7.318 ( -4.000 -0.000 14.155) 14.709 7.332 ( 5.348 0.000 0.691) 5.393 8.381 ( -6.256 -0.000 0.041) 6.257 9.027 ( 8.564 0.000 -8.626) 12.155 9.259 ( 4.938 0.000 1.174) 5.076 9.998 ( 1.411 0.000 2.084) 2.516 10.207 ( 2.316 0.000 -25.665) 25.769 11.368 ( -10.259 -0.000 46.297) 47.420 11.522 ( -1.852 -0.000 -3.312) 3.794 11.741 ( -3.199 -0.000 4.013) 5.132 12.020 ( 1.186 0.000 -7.554) 7.646 12.486 ( 2.961 0.000 2.717) 4.019 14.603 ( 12.373 0.000 3.207) 12.782 16.855 ( -0.319 -0.000 -34.996) 34.997 18.059 ( 2.573 0.000 4.416) 5.111 18.299 ( -6.381 -0.000 -2.191) 6.746 18.962 ( 2.493 0.000 3.034) 3.926 19.657 ( -0.908 -0.000 -9.360) 9.404 22.765 ( -3.640 -0.000 1.894) 4.104 23.265 ( 3.102 0.000 3.643) 4.784 23.571 ( -2.894 -0.000 43.692) 43.788 ======================= Grid point 209 (87/361) ======================= q-point: ( 0.00 0.00 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.124 ( 20.618 0.000 25.553) 32.834 1.189 ( -3.288 -0.000 31.082) 31.255 2.321 ( -3.979 -0.000 51.162) 51.317 3.270 ( -0.716 -0.000 -5.341) 5.389 3.739 ( -4.264 -0.000 8.805) 9.783 3.971 ( -6.030 -0.000 4.486) 7.516 4.404 ( 3.355 0.000 -5.578) 6.509 4.780 ( -9.289 -0.000 8.096) 12.322 5.115 ( -4.484 -0.000 -3.134) 5.470 5.255 ( 2.528 0.000 -7.783) 8.183 5.542 ( -29.840 -0.000 -2.929) 29.983 5.916 ( -11.355 -0.000 15.439) 19.165 6.011 ( -4.543 -0.000 2.605) 5.237 6.397 ( -5.426 -0.000 6.075) 8.146 6.707 ( 7.677 0.000 3.242) 8.333 7.057 ( 0.005 0.000 -14.590) 14.590 7.440 ( 2.965 0.000 12.832) 13.171 8.487 ( -2.231 -0.000 5.941) 6.346 9.017 ( -4.439 -0.000 -7.161) 8.425 9.150 ( -1.375 -0.000 -4.102) 4.327 9.415 ( 13.722 0.000 3.271) 14.107 10.089 ( -3.224 -0.000 1.687) 3.639 11.256 ( -1.963 -0.000 -12.419) 12.573 11.432 ( 6.669 0.000 -6.058) 9.010 11.466 ( -8.443 -0.000 12.966) 15.473 12.292 ( 5.462 0.000 6.632) 8.592 12.476 ( -1.320 -0.000 -2.251) 2.609 14.313 ( -0.286 -0.000 -20.903) 20.905 17.856 ( 5.307 0.000 -9.311) 10.717 18.446 ( -9.934 -0.000 7.555) 12.481 18.721 ( 2.449 0.000 -7.430) 7.823 18.973 ( 16.790 0.000 0.416) 16.795 19.658 ( 14.376 0.000 3.866) 14.887 22.562 ( -48.549 -0.000 -9.944) 49.557 22.799 ( -3.378 -0.000 3.333) 4.745 23.318 ( 4.848 0.000 -1.590) 5.102 ======================= Grid point 210 (88/361) ======================= q-point: ( 0.10 0.00 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.531 ( 3.763 4.538 29.361) 29.947 1.715 ( 20.648 -6.719 20.379) 29.779 2.937 ( 7.692 -6.998 38.496) 39.876 3.212 ( 4.252 2.042 -7.458) 8.824 3.743 ( -9.509 2.191 12.816) 16.108 3.897 ( -5.004 2.939 -1.574) 6.013 4.360 ( 1.357 1.941 -6.657) 7.066 4.714 ( -29.083 3.211 12.666) 31.884 5.039 ( 4.259 -0.782 2.136) 4.828 5.113 ( -7.549 2.557 -7.385) 10.866 5.211 ( 0.691 -0.021 -3.534) 3.601 5.968 ( -8.742 1.747 6.553) 11.064 6.085 ( -3.646 0.899 20.417) 20.759 6.400 ( -4.319 5.311 11.102) 13.043 6.807 ( 3.865 3.795 -1.530) 5.628 6.878 ( -0.594 0.272 -12.158) 12.175 7.648 ( -1.715 -9.863 11.625) 15.342 8.493 ( -1.047 3.491 2.109) 4.211 8.924 ( 0.824 -2.303 -5.945) 6.429 9.069 ( -3.779 -2.559 -3.441) 5.716 9.684 ( 20.505 4.313 -0.492) 20.960 10.074 ( -5.605 -9.453 0.359) 10.996 11.090 ( 1.049 0.926 -13.077) 13.151 11.434 ( 4.885 6.171 1.972) 8.114 11.614 ( -1.301 -11.392 8.331) 14.173 12.401 ( -2.673 1.856 -1.513) 3.589 12.465 ( 5.205 -2.886 4.275) 7.328 14.009 ( -5.117 3.581 -20.748) 21.667 17.847 ( 9.687 2.190 -7.824) 12.644 18.262 ( -12.980 12.994 0.891) 18.388 18.598 ( -10.959 -14.576 -7.183) 19.600 19.055 ( -7.825 0.484 1.733) 8.029 19.964 ( 18.235 2.595 10.943) 21.424 21.955 ( -12.058 16.499 -5.600) 21.189 22.873 ( -4.580 -15.613 -0.902) 16.295 23.374 ( 5.514 -0.123 -1.597) 5.742 ======================= Grid point 211 (89/361) ======================= q-point: ( 0.20 0.00 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.874 ( 6.650 6.794 24.408) 26.194 2.275 ( 19.224 -8.769 16.464) 26.787 3.155 ( 5.712 5.140 -8.175) 11.220 3.397 ( -0.921 -2.719 16.776) 17.019 3.694 ( -4.501 6.737 -1.540) 8.248 3.870 ( 1.005 0.362 11.050) 11.102 4.245 ( -2.257 2.561 -8.534) 9.191 4.439 ( -11.754 -1.179 0.352) 11.818 4.955 ( -11.449 -7.537 -0.005) 13.707 5.179 ( -1.271 2.834 3.670) 4.808 5.323 ( 11.321 -1.544 13.082) 17.369 5.909 ( -9.392 1.788 8.102) 12.532 6.236 ( -6.121 -5.151 14.373) 16.449 6.402 ( -3.025 14.767 10.178) 18.188 6.642 ( -2.150 6.121 -11.036) 12.802 6.854 ( 1.098 5.142 3.937) 6.569 7.805 ( -8.951 -13.402 9.872) 18.900 8.470 ( 1.632 4.784 0.460) 5.075 8.861 ( -3.367 2.489 -3.600) 5.522 9.100 ( 6.791 -7.579 -0.788) 10.207 9.813 ( 6.303 3.316 -3.053) 7.749 10.136 ( 2.162 -8.147 -0.613) 8.451 10.988 ( 4.591 -0.972 -9.495) 10.592 11.496 ( 7.312 3.473 0.945) 8.150 11.795 ( -0.807 -11.634 7.164) 13.686 12.291 ( -6.885 1.845 -2.159) 7.448 12.619 ( 7.010 -1.993 2.614) 7.742 13.659 ( -7.361 5.613 -16.098) 18.570 17.873 ( 9.001 4.373 -10.379) 14.418 18.009 ( -6.396 8.324 1.884) 10.665 18.487 ( -11.596 -13.618 -7.730) 19.486 18.877 ( -20.717 0.229 5.927) 21.549 20.322 ( 16.643 5.921 12.879) 21.861 21.728 ( 4.821 6.218 -10.242) 12.915 22.919 ( -2.485 -10.776 -1.972) 11.233 23.424 ( 4.992 1.005 -1.842) 5.415 ======================= Grid point 212 (90/361) ======================= q-point: ( 0.30 0.00 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.116 ( 3.152 9.849 15.648) 18.756 2.765 ( 15.497 -7.455 13.253) 21.711 3.071 ( 0.065 5.253 -5.903) 7.902 3.371 ( -2.247 9.358 -0.181) 9.626 3.550 ( -3.977 6.318 -6.008) 9.583 4.069 ( 6.905 -3.505 1.806) 7.951 4.123 ( -1.164 -2.243 0.215) 2.536 4.426 ( 0.541 -7.720 -0.633) 7.765 4.890 ( -11.695 -9.596 2.391) 15.316 5.142 ( -8.730 2.596 5.973) 10.892 5.651 ( 8.439 -4.237 8.397) 12.636 5.867 ( -7.631 -0.941 4.198) 8.760 6.269 ( -11.893 13.319 14.453) 22.973 6.372 ( -3.063 -2.914 10.539) 11.355 6.473 ( 0.754 9.301 -3.266) 9.887 6.879 ( 3.451 9.429 5.761) 11.576 7.872 ( -12.627 -11.946 8.683) 19.430 8.468 ( 2.514 4.935 0.567) 5.567 8.746 ( -3.277 3.601 -1.708) 5.160 9.308 ( 9.871 -6.592 2.340) 12.098 9.798 ( -4.067 -9.569 -3.619) 11.009 10.180 ( 7.793 9.976 -3.585) 13.157 11.046 ( 7.525 -5.721 0.095) 9.454 11.583 ( 8.597 1.750 -1.467) 8.895 11.940 ( -1.033 -7.938 3.629) 8.789 12.144 ( -8.719 1.251 -0.540) 8.824 12.720 ( 4.003 -2.593 -4.733) 6.719 13.392 ( -3.644 4.954 -4.944) 7.891 17.740 ( -0.990 6.707 -5.520) 8.743 18.003 ( 5.838 1.049 -7.305) 9.410 18.338 ( -7.959 -6.207 -5.898) 11.690 18.694 ( -21.169 -6.586 8.815) 23.858 20.552 ( 10.710 13.480 6.644) 18.454 21.727 ( 9.793 -6.711 -7.229) 13.899 22.961 ( 0.495 -6.854 -1.443) 7.022 23.446 ( 3.818 2.954 -1.909) 5.191 ======================= Grid point 213 (91/361) ======================= q-point: (-0.60 0.00 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.117 ( -4.987 14.738 5.545) 16.518 2.896 ( -11.893 5.499 -3.017) 13.445 3.067 ( 5.281 4.331 5.902) 9.027 3.371 ( 6.370 1.133 0.999) 6.547 3.399 ( 2.104 -1.138 -1.655) 2.908 4.026 ( 8.694 1.859 -17.010) 19.193 4.294 ( 0.253 -4.335 6.448) 7.773 4.525 ( 3.947 -10.948 -0.958) 11.678 4.850 ( -15.118 -11.268 7.074) 20.139 5.051 ( -11.847 -0.432 6.413) 13.478 5.615 ( -10.310 5.113 -7.339) 13.649 5.808 ( -5.146 -1.812 -1.788) 5.741 6.299 ( -0.380 10.223 13.591) 17.011 6.432 ( 2.398 -3.255 4.115) 5.769 6.501 ( -8.607 3.244 22.655) 24.451 6.933 ( 8.263 8.006 4.444) 12.333 7.881 ( -11.265 -6.001 7.870) 14.995 8.431 ( -1.050 6.173 -0.885) 6.324 8.709 ( 1.639 1.095 1.096) 2.255 9.433 ( -1.568 -5.418 -2.078) 6.011 9.870 ( 1.954 -14.642 1.950) 14.900 10.115 ( 9.555 20.070 -4.120) 22.607 11.251 ( 4.079 -4.974 9.709) 11.647 11.655 ( 7.679 1.246 -3.778) 8.649 11.926 ( -2.297 2.817 -2.151) 4.224 12.108 ( -2.275 -6.301 2.463) 7.138 12.613 ( -5.882 0.546 -10.980) 12.468 13.417 ( 7.702 -1.590 5.068) 9.356 17.619 ( -2.741 1.699 -8.284) 8.890 17.881 ( 0.214 3.045 -10.498) 10.933 18.342 ( 3.836 -4.766 0.917) 6.186 18.607 ( -16.726 -9.810 7.962) 20.961 20.530 ( 5.480 17.917 -4.475) 19.263 21.923 ( 7.089 -15.359 2.001) 17.034 23.024 ( 3.710 -3.786 -0.544) 5.329 23.436 ( 2.946 5.278 -1.273) 6.177 ======================= Grid point 214 (92/361) ======================= q-point: (-0.50 0.00 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.894 ( -11.208 17.760 1.954) 21.092 2.556 ( -19.676 13.541 -2.051) 23.973 3.113 ( 3.586 1.343 3.040) 4.890 3.401 ( -1.316 -1.602 1.856) 2.783 3.602 ( 7.233 -11.760 -1.188) 13.858 3.859 ( -0.795 8.468 -13.947) 16.336 4.304 ( -5.664 -2.289 -0.071) 6.110 4.678 ( 8.073 -8.340 -3.705) 12.184 4.812 ( -13.217 -8.104 3.928) 15.993 5.028 ( -7.981 -6.123 7.633) 12.627 5.378 ( -10.936 2.506 6.031) 12.738 5.696 ( -5.698 -0.703 -5.384) 7.871 6.281 ( -1.043 6.728 2.053) 7.111 6.544 ( -10.052 4.084 15.248) 18.714 6.645 ( 0.748 -6.123 10.912) 12.535 7.106 ( 9.345 1.909 10.558) 14.228 7.849 ( -7.949 2.213 6.357) 10.416 8.341 ( -3.225 3.293 -0.630) 4.652 8.764 ( 5.063 0.484 0.150) 5.088 9.380 ( -6.621 -6.709 -2.739) 9.816 10.010 ( 7.442 20.028 -3.009) 21.576 10.083 ( 6.363 -9.316 2.834) 11.632 11.365 ( -12.122 2.161 14.737) 19.204 11.673 ( 4.656 2.081 -5.411) 7.436 11.954 ( 12.679 0.078 -0.500) 12.689 12.156 ( 0.922 -4.139 -3.650) 5.595 12.383 ( -9.690 2.176 -2.924) 10.353 13.671 ( 13.953 -6.908 4.120) 16.105 17.374 ( -7.099 -0.850 -19.181) 20.470 17.854 ( 5.947 3.032 1.437) 6.829 18.460 ( -0.447 -7.819 1.865) 8.051 18.595 ( -5.154 -6.374 6.044) 10.184 20.322 ( 1.968 17.770 -12.036) 21.553 22.179 ( -1.293 -18.688 7.418) 20.148 23.121 ( 6.990 -2.170 -0.012) 7.319 23.421 ( 3.340 7.277 1.947) 8.240 ======================= Grid point 215 (93/361) ======================= q-point: (-0.40 0.00 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.586 ( -15.741 17.334 4.426) 23.830 2.115 ( -22.126 19.229 1.732) 29.365 3.073 ( -14.234 8.592 -9.024) 18.917 3.407 ( 2.796 -5.037 3.420) 6.700 3.620 ( -7.031 -1.905 -2.915) 7.846 3.717 ( -4.089 -8.672 0.298) 9.593 4.235 ( -8.037 -2.495 1.542) 8.555 4.724 ( -4.560 0.272 3.678) 5.865 4.844 ( 11.796 -5.294 -5.292) 13.971 5.078 ( -2.691 -3.970 7.018) 8.500 5.435 ( -8.083 -11.379 12.660) 18.843 5.570 ( -4.822 -1.808 -3.767) 6.380 6.227 ( -2.471 1.792 -0.609) 3.113 6.498 ( -15.708 5.052 16.413) 23.273 6.820 ( 3.250 -7.820 3.101) 9.019 7.310 ( 3.241 -2.526 4.892) 6.389 7.774 ( -2.658 11.039 4.221) 12.113 8.315 ( -3.403 -2.655 6.116) 7.486 8.819 ( 6.539 1.105 -3.920) 7.704 9.350 ( -2.374 -3.244 1.326) 4.233 9.890 ( 4.417 13.861 -5.811) 15.666 10.242 ( 3.275 -3.466 2.302) 5.295 11.291 ( -18.840 1.231 15.771) 24.601 11.622 ( 1.926 3.481 -6.430) 7.561 12.005 ( -3.655 -0.727 -13.760) 14.255 12.213 ( 13.714 3.694 7.569) 16.093 12.363 ( 1.722 -0.261 6.996) 7.210 13.983 ( 16.658 -9.633 -0.187) 19.244 17.045 ( -6.748 -0.530 -20.484) 21.574 17.969 ( 6.853 2.231 5.578) 9.114 18.467 ( -8.416 -5.714 2.044) 10.376 18.737 ( 7.996 -4.282 3.629) 9.769 20.019 ( -0.867 15.779 -14.892) 21.714 22.357 ( -10.377 -20.193 7.507) 23.912 23.214 ( 6.648 0.048 -3.957) 7.737 23.507 ( 6.916 5.016 12.407) 15.064 ======================= Grid point 216 (94/361) ======================= q-point: (-0.30 0.00 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.274 ( -20.472 14.373 9.061) 26.605 1.673 ( -24.080 19.939 6.067) 31.847 2.462 ( -33.722 19.135 -5.707) 39.190 3.522 ( -4.784 -4.596 0.042) 6.634 3.652 ( 1.489 -8.212 9.168) 12.398 3.705 ( -6.904 -5.029 0.390) 8.550 4.214 ( -4.688 -7.622 5.725) 10.623 4.733 ( 1.569 5.436 4.520) 7.242 5.005 ( 10.000 -6.133 -2.468) 11.987 5.187 ( 0.059 -4.458 7.690) 8.889 5.460 ( -3.001 -3.481 -3.999) 6.092 5.624 ( -6.000 -13.847 10.276) 18.258 6.174 ( -3.209 -2.991 -2.261) 4.935 6.439 ( -17.529 -0.705 16.898) 24.358 6.925 ( -1.341 -6.608 0.493) 6.761 7.309 ( -1.703 -1.811 -7.675) 8.067 7.714 ( 4.725 12.489 0.633) 13.368 8.425 ( -2.602 -2.317 13.129) 13.583 8.832 ( 6.839 1.667 -6.804) 9.790 9.384 ( 3.995 6.255 2.495) 7.830 9.767 ( -2.504 -1.027 -6.982) 7.488 10.277 ( -1.074 3.358 1.016) 3.669 11.246 ( -18.605 -7.936 16.339) 26.002 11.536 ( 1.038 3.478 -5.477) 6.571 11.806 ( -5.716 -0.514 -7.996) 9.842 12.396 ( 7.286 1.394 2.245) 7.751 12.520 ( 12.871 10.187 5.419) 17.286 14.269 ( 16.258 -10.387 -5.731) 20.126 16.777 ( -4.207 0.291 -7.918) 8.971 18.111 ( 5.440 1.871 6.788) 8.898 18.396 ( -4.282 1.718 -2.176) 5.101 18.924 ( 8.410 -1.735 3.075) 9.121 19.710 ( -2.123 10.611 -12.893) 16.833 22.440 ( -16.066 -23.375 6.560) 29.112 23.227 ( 5.578 2.244 -4.805) 7.697 23.779 ( 8.114 -0.303 16.643) 18.518 ======================= Grid point 217 (95/361) ======================= q-point: (-0.20 0.00 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.014 ( -21.189 10.215 16.253) 28.591 1.167 ( -33.497 13.553 -1.942) 36.187 1.932 ( -29.848 23.424 30.937) 48.956 3.458 ( -8.170 -5.261 -2.125) 9.947 3.637 ( -4.803 0.364 1.574) 5.067 3.844 ( -0.166 -5.866 9.310) 11.005 4.348 ( 0.641 -11.417 1.744) 11.568 4.805 ( 5.291 3.529 9.398) 11.348 5.143 ( 4.672 -6.548 -2.594) 8.452 5.319 ( 1.158 -1.194 6.618) 6.824 5.370 ( -2.949 -1.656 -6.293) 7.145 5.806 ( -2.700 -16.020 8.568) 18.366 6.153 ( -1.111 -4.217 -0.589) 4.400 6.432 ( -18.325 -12.570 13.652) 26.080 6.875 ( -15.441 -6.702 1.203) 16.876 7.226 ( 5.130 -2.293 -11.569) 12.861 7.649 ( 8.183 17.723 -8.021) 21.105 8.491 ( -3.658 2.585 3.490) 5.678 8.869 ( 8.060 4.024 1.914) 9.210 9.351 ( 5.496 13.951 -4.261) 15.588 9.678 ( -15.430 -16.876 -4.279) 23.263 10.194 ( -3.344 9.198 1.378) 9.883 11.280 ( -13.856 -16.290 8.407) 22.979 11.472 ( -2.283 -0.112 -2.593) 3.456 11.698 ( -1.377 -0.284 -2.289) 2.687 12.472 ( 6.470 6.616 -0.867) 9.295 12.507 ( 6.345 17.315 -12.194) 22.108 14.456 ( 12.176 -8.811 -11.132) 18.703 16.942 ( 14.064 -8.558 27.958) 32.445 18.206 ( 5.285 9.005 -0.780) 10.470 18.310 ( 0.988 3.012 2.087) 3.795 19.038 ( 4.512 4.323 1.720) 6.481 19.512 ( 0.315 2.061 -8.340) 8.596 22.506 ( -18.492 -29.917 6.604) 35.785 23.235 ( 5.453 1.765 -3.698) 6.821 24.017 ( 1.671 -2.920 2.096) 3.964 ======================= Grid point 218 (96/361) ======================= q-point: (-0.10 0.00 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.725 ( -10.351 10.081 19.303) 24.112 0.968 ( -13.462 3.577 26.738) 30.148 1.938 ( -19.744 12.646 51.304) 56.408 3.357 ( -5.961 -2.350 -3.303) 7.209 3.652 ( 0.205 -0.393 6.698) 6.712 3.956 ( -3.673 -3.305 7.315) 8.828 4.407 ( 2.268 -4.222 -4.752) 6.749 4.908 ( -4.164 -2.618 -5.753) 7.569 5.144 ( -1.845 -0.011 2.148) 2.831 5.286 ( 4.948 0.124 -6.345) 8.047 5.501 ( 2.606 -0.712 15.009) 15.250 5.967 ( -5.582 -18.164 -0.214) 19.003 6.223 ( -7.538 -8.816 4.940) 12.608 6.399 ( -16.035 -12.770 -1.395) 20.546 6.693 ( -16.934 -4.404 1.693) 17.579 7.187 ( 3.714 -1.870 -11.162) 11.911 7.412 ( 4.260 28.598 -2.629) 29.033 8.448 ( -4.388 -0.097 5.424) 6.977 9.014 ( 11.664 5.721 4.651) 13.799 9.233 ( 2.514 7.390 -8.392) 11.461 9.455 ( -24.337 -8.849 -1.169) 25.923 10.117 ( -1.035 6.636 2.895) 7.314 11.340 ( -6.419 -16.030 1.995) 17.382 11.392 ( -2.554 -0.612 -5.740) 6.312 11.621 ( -3.238 9.315 -5.176) 11.138 12.230 ( 2.931 16.357 -1.259) 16.665 12.499 ( 1.023 -0.198 -1.469) 1.801 14.479 ( 5.970 -4.700 -16.984) 18.606 17.769 ( 15.138 -25.706 8.957) 31.147 18.255 ( 38.539 20.678 9.509) 44.758 18.402 ( -2.731 -4.015 8.996) 10.222 18.996 ( -1.521 7.454 -2.653) 8.057 19.497 ( 6.953 -1.964 -3.216) 7.909 22.618 ( -17.764 -36.873 4.928) 41.225 23.258 ( 4.721 1.046 -3.301) 5.855 23.651 ( -32.406 16.130 -23.210) 43.001 ======================= Grid point 220 (97/361) ======================= q-point: ( 0.10 0.10 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.986 ( 7.581 0.000 28.716) 29.700 2.148 ( 16.649 0.000 16.298) 23.299 3.204 ( 6.480 0.000 -8.990) 11.082 3.356 ( 4.229 0.000 20.182) 20.620 3.783 ( -4.543 -0.000 -7.673) 8.917 3.855 ( -1.620 -0.000 16.763) 16.841 4.290 ( 0.087 0.000 -8.238) 8.238 4.420 ( -16.066 -0.000 -4.397) 16.656 4.874 ( -14.901 -0.000 1.398) 14.966 5.209 ( -1.581 -0.000 2.631) 3.069 5.307 ( 12.351 0.000 10.778) 16.392 5.925 ( -9.607 -0.000 5.900) 11.274 6.181 ( -8.375 -0.000 16.880) 18.844 6.543 ( -1.826 -0.000 4.803) 5.139 6.714 ( 0.999 0.000 -12.348) 12.389 6.910 ( -1.710 -0.000 14.961) 15.059 7.655 ( -9.759 -0.000 9.440) 13.578 8.516 ( 1.019 0.000 0.206) 1.040 8.877 ( -1.151 -0.000 -3.963) 4.127 9.032 ( 6.032 0.000 0.245) 6.037 9.882 ( -9.773 -0.000 -4.753) 10.867 10.027 ( 22.715 0.000 0.990) 22.737 10.989 ( 8.117 0.000 -14.912) 16.978 11.570 ( 9.659 0.000 -2.806) 10.058 11.637 ( -7.485 -0.000 15.933) 17.604 12.309 ( -6.482 -0.000 -2.405) 6.913 12.600 ( 7.437 0.000 2.441) 7.827 13.709 ( -8.479 -0.000 -15.949) 18.063 17.907 ( 12.221 0.000 -9.707) 15.607 18.192 ( -14.344 -0.000 5.782) 15.465 18.250 ( -9.063 -0.000 -11.381) 14.549 18.887 ( -19.507 -0.000 3.405) 19.802 20.382 ( 17.861 0.000 14.966) 23.302 21.800 ( -0.638 -0.000 -15.519) 15.533 22.805 ( 0.089 0.000 1.709) 1.711 23.434 ( 5.899 0.000 -1.934) 6.208 ======================= Grid point 221 (98/361) ======================= q-point: ( 0.20 0.10 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.327 ( 7.089 13.176 20.204) 25.141 2.583 ( 11.037 -12.304 15.697) 22.794 3.147 ( 0.342 2.675 -8.009) 8.451 3.496 ( -1.959 3.642 3.575) 5.467 3.626 ( 0.790 2.445 -10.516) 10.825 4.021 ( -1.620 -2.265 13.455) 13.740 4.147 ( 0.277 6.067 -9.520) 11.292 4.294 ( 0.853 -8.038 -6.662) 10.475 4.752 ( -12.152 -4.832 5.498) 14.187 5.179 ( -8.962 1.353 4.466) 10.104 5.589 ( 8.342 -2.168 8.426) 12.054 5.848 ( -8.499 -0.776 1.816) 8.725 6.300 ( -6.923 -1.459 19.990) 21.205 6.446 ( -8.776 4.076 0.482) 9.688 6.616 ( 4.397 4.579 -6.816) 9.315 7.077 ( -1.254 11.237 19.668) 22.687 7.627 ( -14.399 -12.661 7.616) 20.631 8.537 ( 2.459 2.339 0.923) 3.516 8.794 ( -4.425 1.551 -0.924) 4.780 9.227 ( 14.234 -2.377 4.176) 15.023 9.673 ( -10.275 -3.937 -7.981) 13.593 10.337 ( 20.277 5.679 2.491) 21.204 10.984 ( 12.653 -1.379 -10.245) 16.339 11.632 ( 4.992 4.322 1.544) 6.782 11.764 ( -3.656 -9.763 8.853) 13.677 12.176 ( -8.351 1.253 -1.743) 8.622 12.687 ( 5.259 -0.983 -5.096) 7.388 13.452 ( -6.928 1.742 -6.016) 9.339 17.874 ( -0.751 7.922 -7.872) 11.194 18.007 ( 2.106 -1.424 -12.165) 12.427 18.177 ( -5.929 -8.356 1.987) 10.437 18.648 ( -20.696 -0.412 5.193) 21.341 20.758 ( 13.254 7.719 15.439) 21.763 21.630 ( 4.117 -3.607 -17.902) 18.721 22.859 ( 2.116 -3.610 1.577) 4.472 23.484 ( 5.130 1.148 -1.940) 5.603 ======================= Grid point 222 (99/361) ======================= q-point: ( 0.30 0.10 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.402 ( -0.884 17.325 8.396) 19.273 2.930 ( -5.081 -4.510 0.576) 6.818 3.042 ( 3.846 -3.398 7.632) 9.197 3.434 ( 0.786 4.782 -1.456) 5.060 3.458 ( -2.741 6.228 -10.624) 12.616 4.054 ( 8.129 2.511 -10.270) 13.336 4.200 ( -1.319 -6.088 12.043) 13.559 4.343 ( 5.252 -10.209 -5.770) 12.849 4.700 ( -12.112 -5.025 5.005) 14.036 5.048 ( -14.860 0.065 4.014) 15.393 5.656 ( -4.670 0.554 -6.073) 7.681 5.757 ( -5.180 -3.131 -2.593) 6.585 6.375 ( -0.253 -1.071 4.073) 4.219 6.452 ( -11.375 4.359 24.076) 26.983 6.593 ( 2.591 5.668 4.367) 7.610 7.113 ( -0.586 12.972 10.198) 16.511 7.678 ( -11.770 -15.322 9.056) 21.338 8.550 ( 0.942 5.453 1.866) 5.840 8.733 ( -1.980 1.739 1.706) 3.139 9.374 ( -2.673 -0.744 -5.607) 6.256 9.642 ( 7.665 -11.175 3.743) 14.059 10.490 ( 16.140 20.819 0.037) 26.342 11.150 ( 12.563 -6.408 2.212) 14.275 11.679 ( 4.886 1.801 -0.819) 5.271 11.882 ( -3.350 -8.712 4.112) 10.199 12.041 ( -6.584 0.263 0.177) 6.592 12.609 ( -3.046 -0.534 -11.536) 11.944 13.397 ( 2.628 -0.741 2.441) 3.663 17.661 ( -5.188 2.928 -13.303) 14.576 17.902 ( -0.154 -1.028 -7.800) 7.869 18.252 ( 4.381 -4.094 1.075) 6.092 18.493 ( -13.599 -3.595 6.749) 15.601 20.875 ( 5.375 20.592 2.062) 21.381 21.637 ( 4.696 -17.197 -5.688) 18.712 22.955 ( 4.278 -3.403 1.885) 5.782 23.510 ( 4.253 2.969 -1.333) 5.356 ======================= Grid point 223 (100/361) ======================= q-point: (-0.60 0.10 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.228 ( -7.216 19.808 1.187) 21.115 2.719 ( -15.481 5.063 -1.368) 16.345 3.203 ( 0.277 7.276 1.032) 7.354 3.370 ( 2.230 -11.499 1.334) 11.789 3.402 ( -0.839 -0.843 -2.684) 2.936 4.004 ( 4.348 7.522 -10.939) 13.969 4.263 ( -8.625 -2.731 3.980) 9.884 4.518 ( 10.259 -10.890 -1.141) 15.005 4.628 ( -12.257 -7.999 4.352) 15.270 4.932 ( -10.627 -5.375 5.256) 13.017 5.446 ( -10.287 4.032 -2.975) 11.442 5.661 ( -5.436 -3.080 -6.061) 8.704 6.394 ( -4.417 5.689 1.211) 7.303 6.525 ( 1.970 -2.342 9.474) 9.956 6.668 ( -12.532 3.994 20.645) 24.479 7.150 ( 3.830 4.043 6.534) 8.585 7.742 ( -8.963 -11.089 6.094) 15.506 8.497 ( -1.520 10.898 2.853) 11.368 8.759 ( 2.137 -0.816 2.096) 3.102 9.245 ( -6.801 -7.105 -6.310) 11.685 9.940 ( 10.901 -6.777 6.818) 14.534 10.449 ( 11.389 27.882 -1.432) 30.152 11.382 ( -2.174 -1.047 12.099) 12.337 11.703 ( 3.581 1.354 -3.232) 5.010 11.924 ( 7.098 -4.401 -2.759) 8.795 12.060 ( 0.223 -5.624 2.852) 6.309 12.399 ( -9.181 0.017 -7.351) 11.762 13.551 ( 10.760 -6.154 1.111) 12.445 17.363 ( -7.670 -0.372 -19.364) 20.831 17.894 ( 4.259 1.214 1.324) 4.622 18.348 ( 0.831 -4.020 1.789) 4.477 18.502 ( 0.298 -4.593 4.493) 6.432 20.662 ( 0.235 20.671 -10.769) 23.309 21.843 ( -1.811 -19.665 5.637) 20.537 23.078 ( 6.147 -2.441 2.356) 7.021 23.526 ( 4.275 4.653 0.372) 6.330 ======================= Grid point 224 (101/361) ======================= q-point: (-0.50 0.10 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.927 ( -11.002 20.872 0.511) 23.600 2.396 ( -19.030 12.533 0.322) 22.788 3.219 ( 2.594 3.504 4.117) 5.996 3.316 ( -7.039 -2.425 -3.366) 8.171 3.493 ( -0.255 -10.569 -4.121) 11.347 3.730 ( -14.890 9.128 -3.464) 17.805 4.180 ( -9.959 -3.335 0.890) 10.540 4.657 ( -2.868 -7.388 6.539) 10.274 4.723 ( 10.625 -8.354 -3.716) 14.018 4.974 ( -4.412 -8.332 6.938) 11.706 5.305 ( -9.998 -2.415 4.920) 11.402 5.542 ( -3.514 -1.623 -5.834) 7.001 6.267 ( -8.464 4.247 0.636) 9.491 6.622 ( -17.132 5.947 15.997) 24.182 6.691 ( 2.900 -5.958 5.423) 8.563 7.254 ( 2.474 -3.138 0.637) 4.047 7.778 ( -6.308 -7.651 4.836) 11.033 8.423 ( -0.322 12.189 6.145) 13.654 8.823 ( 3.696 -0.665 -0.195) 3.761 9.196 ( -4.567 -10.743 -1.849) 11.819 10.178 ( 7.477 -2.253 4.108) 8.824 10.306 ( 7.225 28.604 -1.382) 29.535 11.349 ( -16.620 4.295 12.120) 21.014 11.672 ( 0.397 1.979 -4.169) 4.632 11.984 ( 0.572 -2.177 -13.829) 14.011 12.224 ( 10.061 -1.478 5.982) 11.798 12.320 ( 2.403 -4.839 7.630) 9.349 13.794 ( 14.867 -11.170 -3.761) 18.972 17.037 ( -6.997 -0.364 -18.659) 19.931 18.002 ( 6.777 1.277 4.652) 8.319 18.398 ( -0.472 -1.842 2.894) 3.463 18.662 ( 9.701 -4.336 2.981) 11.036 20.314 ( -3.589 17.528 -15.201) 23.477 22.006 ( -11.324 -19.542 7.337) 23.748 23.206 ( 6.176 -0.842 1.131) 6.335 23.584 ( 6.076 3.723 5.332) 8.900 ======================= Grid point 225 (102/361) ======================= q-point: (-0.40 0.10 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.593 ( -13.874 20.783 3.466) 25.228 1.987 ( -22.823 16.276 -0.277) 28.034 2.882 ( -20.332 26.399 -1.474) 33.354 3.416 ( -10.364 -8.838 -1.612) 13.716 3.472 ( 3.819 -9.806 8.092) 13.275 3.612 ( -5.281 -5.267 3.243) 8.133 4.101 ( -7.547 -5.548 2.120) 9.603 4.766 ( 1.781 -2.421 2.362) 3.822 4.880 ( 7.284 -7.748 -1.085) 10.689 5.074 ( -4.488 -8.170 8.293) 12.476 5.305 ( -9.236 -12.033 4.074) 15.707 5.498 ( 1.594 -1.110 -0.005) 1.942 6.108 ( -14.228 -1.394 1.354) 14.360 6.511 ( -15.206 3.909 11.878) 19.687 6.812 ( -0.262 -5.280 2.308) 5.768 7.240 ( -0.199 -4.738 -10.564) 11.580 7.814 ( -2.421 -1.552 4.328) 5.196 8.452 ( 1.555 5.799 9.653) 11.368 8.864 ( 4.561 1.853 -0.409) 4.940 9.250 ( -3.885 -14.136 0.950) 14.691 10.073 ( 4.580 28.054 -6.180) 29.089 10.319 ( 1.829 2.377 5.184) 5.989 11.219 ( -17.558 2.810 12.957) 22.001 11.592 ( -1.918 2.259 -4.046) 5.016 11.807 ( -3.213 0.873 -9.501) 10.067 12.349 ( 1.947 -5.086 2.033) 5.814 12.634 ( 17.682 1.781 6.871) 19.053 14.046 ( 15.650 -14.361 -9.170) 23.136 16.782 ( -4.222 0.232 -9.166) 10.095 18.137 ( 6.132 0.976 4.137) 7.461 18.441 ( 3.973 3.345 1.412) 5.382 18.891 ( 13.204 -1.914 3.814) 13.876 19.926 ( -6.504 13.481 -15.036) 21.217 22.043 ( -20.002 -21.063 6.246) 29.711 23.267 ( 4.581 2.176 -1.784) 5.376 23.764 ( 7.026 -1.179 10.187) 12.431 ======================= Grid point 226 (103/361) ======================= q-point: (-0.30 0.10 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.285 ( -15.041 19.428 9.643) 26.395 1.458 ( -27.467 19.334 -2.486) 33.681 2.436 ( -19.738 31.840 21.462) 43.174 3.336 ( -9.747 -8.618 -0.789) 13.034 3.620 ( -3.396 -2.430 2.128) 4.687 3.696 ( -0.084 -10.705 8.033) 13.384 4.157 ( 0.083 -9.602 3.737) 10.304 4.801 ( 0.742 -4.429 -1.817) 4.844 5.033 ( 3.738 -6.455 2.350) 7.820 5.196 ( -7.290 -10.844 11.977) 17.725 5.308 ( -4.754 -8.357 -2.517) 9.938 5.578 ( -2.742 -5.504 5.753) 8.420 5.967 ( -14.040 -9.241 3.278) 17.125 6.427 ( -8.913 2.418 7.356) 11.807 6.792 ( -10.735 -2.238 1.304) 11.044 7.158 ( 3.960 -5.077 -12.789) 14.318 7.841 ( 3.028 4.926 1.736) 6.037 8.495 ( -1.066 -0.921 -2.615) 2.970 8.955 ( 6.606 4.667 8.728) 11.900 9.312 ( -9.304 -16.581 -0.328) 19.016 9.790 ( 2.187 27.743 -7.262) 28.761 10.331 ( -2.099 6.649 4.564) 8.333 11.141 ( -14.834 -0.763 13.866) 20.320 11.495 ( -3.070 1.196 -3.921) 5.121 11.707 ( 1.361 1.636 -3.016) 3.691 12.422 ( 1.046 -4.839 -1.095) 5.071 12.804 ( 13.396 9.686 -9.576) 19.104 14.243 ( 12.657 -14.900 -13.288) 23.639 16.812 ( 5.186 -5.743 14.331) 16.287 18.240 ( 3.288 -1.267 2.139) 4.122 18.478 ( 11.732 11.287 -2.180) 16.425 19.123 ( 13.526 4.617 4.863) 15.097 19.581 ( -7.253 6.225 -11.437) 14.905 21.992 ( -27.377 -25.969 6.966) 38.373 23.276 ( 4.068 2.866 -2.326) 5.493 23.957 ( 1.788 -3.860 4.182) 5.965 ======================= Grid point 227 (104/361) ======================= q-point: (-0.20 0.10 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.018 ( -9.449 21.269 13.324) 26.817 1.113 ( -11.887 13.683 19.432) 26.573 2.309 ( -13.631 27.006 39.572) 49.811 3.276 ( -6.341 -6.799 -2.068) 9.524 3.638 ( -1.501 -1.308 5.486) 5.836 3.844 ( -2.703 -9.170 5.682) 11.121 4.284 ( 2.759 -8.771 -0.989) 9.248 4.826 ( -2.488 -6.405 -3.628) 7.770 5.123 ( -1.197 -4.456 0.791) 4.682 5.273 ( -0.156 -3.123 -4.270) 5.293 5.345 ( -15.670 -22.085 16.586) 31.755 5.583 ( -13.393 -6.793 8.092) 17.059 5.997 ( -5.455 -10.454 4.753) 12.714 6.409 ( 1.434 2.871 2.959) 4.365 6.649 ( -13.139 -0.594 4.676) 13.959 7.125 ( 3.223 -4.871 -10.858) 12.329 7.810 ( 5.102 15.091 -4.244) 16.485 8.412 ( -4.477 -4.094 -3.579) 7.044 9.133 ( 8.673 4.393 8.071) 12.635 9.238 ( -16.730 -12.522 -2.151) 21.007 9.512 ( 3.398 24.039 -6.908) 25.242 10.277 ( -3.018 10.004 5.534) 11.824 11.151 ( -9.973 -4.312 13.047) 16.979 11.399 ( -1.573 0.499 -5.834) 6.063 11.716 ( 3.877 3.850 -0.502) 5.487 12.418 ( -0.314 -1.722 -6.857) 7.077 12.631 ( 4.328 16.464 -12.790) 21.293 14.323 ( 6.780 -12.529 -17.235) 22.360 17.337 ( 13.587 -21.306 21.381) 33.101 18.299 ( -2.501 -6.069 1.249) 6.682 18.577 ( 27.443 14.941 -2.672) 31.361 19.198 ( -0.679 13.957 1.515) 14.056 19.444 ( 5.577 -3.280 -3.076) 7.164 21.936 ( -31.898 -33.609 10.150) 47.434 23.284 ( 3.987 1.987 -2.148) 4.946 23.854 ( -12.884 5.776 -11.278) 18.071 ======================= Grid point 228 (105/361) ======================= q-point: (-0.10 0.10 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.179 ( 1.312 5.004 25.373) 25.895 1.240 ( 13.424 8.179 25.528) 29.980 2.498 ( -2.914 18.247 45.891) 49.472 3.234 ( -1.017 -4.202 -4.761) 6.431 3.712 ( -5.249 -2.890 9.118) 10.911 3.912 ( -4.355 -6.490 2.625) 8.244 4.360 ( 3.546 -4.734 -3.853) 7.059 4.770 ( -11.162 -1.421 10.066) 15.097 5.086 ( -5.383 -6.439 -6.815) 10.812 5.244 ( 0.306 -0.390 -5.172) 5.196 5.355 ( -27.536 -19.045 1.875) 33.533 5.756 ( 3.685 -7.348 22.137) 23.614 6.003 ( -8.491 -3.514 3.930) 9.995 6.407 ( -6.691 2.295 4.441) 8.352 6.672 ( 6.664 -3.772 2.601) 8.087 7.040 ( -1.066 -2.803 -12.794) 13.141 7.667 ( 1.960 19.233 3.643) 19.673 8.428 ( -1.877 -6.363 3.837) 7.664 9.058 ( -8.389 1.142 -4.065) 9.392 9.207 ( -2.787 3.174 -5.057) 6.589 9.424 ( 16.093 7.595 0.889) 17.817 10.200 ( -3.828 10.612 4.218) 12.044 11.198 ( -7.275 -4.565 2.949) 9.081 11.331 ( 3.675 -1.772 -4.592) 6.143 11.674 ( 1.862 11.696 -0.868) 11.875 12.347 ( 3.117 3.233 -0.131) 4.492 12.497 ( -0.729 4.346 -2.067) 4.867 14.239 ( 0.376 -8.141 -20.807) 22.346 17.747 ( 7.299 -11.443 -1.103) 13.617 18.303 ( -9.005 -10.941 0.530) 14.180 18.842 ( 12.011 8.095 -3.243) 14.842 19.049 ( 2.844 7.213 -1.493) 7.896 19.617 ( 12.662 -2.337 5.987) 14.200 21.955 ( -25.892 -35.505 8.229) 44.707 23.253 ( -7.403 13.938 -7.866) 17.634 23.367 ( -5.717 11.984 -5.055) 14.208 ======================= Grid point 231 (106/361) ======================= q-point: ( 0.20 0.20 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.668 ( -1.659 -0.000 7.776) 7.951 2.750 ( 5.917 0.000 10.458) 12.016 3.037 ( -6.048 -0.000 -0.782) 6.098 3.466 ( -4.197 -0.000 -4.368) 6.058 3.544 ( 3.575 0.000 -11.280) 11.833 4.100 ( -7.788 -0.000 11.089) 13.551 4.168 ( 5.329 0.000 -3.973) 6.647 4.185 ( 10.740 0.000 -8.039) 13.415 4.663 ( -9.621 -0.000 5.764) 11.215 5.050 ( -16.116 -0.000 2.532) 16.314 5.656 ( -1.460 -0.000 -4.008) 4.265 5.727 ( -6.384 -0.000 -3.509) 7.285 6.367 ( -0.305 -0.000 1.491) 1.522 6.487 ( -14.682 -0.000 31.523) 34.775 6.647 ( 6.553 0.000 -5.422) 8.505 7.358 ( -2.157 -0.000 17.733) 17.864 7.411 ( -15.185 -0.000 5.887) 16.286 8.596 ( 1.960 0.000 2.162) 2.918 8.754 ( -3.804 -0.000 2.521) 4.563 9.391 ( -9.652 -0.000 -11.133) 14.735 9.517 ( 16.768 0.000 8.174) 18.654 10.723 ( 19.948 0.000 8.221) 21.576 11.062 ( 17.387 0.000 -10.390) 20.255 11.732 ( -10.333 -0.000 13.500) 17.001 11.743 ( 6.750 0.000 -3.338) 7.530 12.051 ( -7.592 -0.000 -0.876) 7.642 12.603 ( -1.865 -0.000 -11.943) 12.088 13.391 ( 0.417 0.000 1.697) 1.747 17.697 ( -7.164 -0.000 -19.071) 20.372 17.877 ( -1.027 -0.000 -0.842) 1.328 18.220 ( 7.979 0.000 -0.347) 7.987 18.463 ( -13.617 -0.000 5.759) 14.785 21.152 ( 7.287 0.000 18.587) 19.965 21.395 ( 1.469 0.000 -22.939) 22.986 22.923 ( 4.691 0.000 3.062) 5.602 23.537 ( 4.693 0.000 -1.453) 4.913 ======================= Grid point 232 (107/361) ======================= q-point: (-0.70 0.20 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.557 ( -6.269 16.346 1.008) 17.536 2.746 ( -11.374 -2.576 -1.908) 11.817 3.128 ( 2.791 -10.078 2.711) 10.803 3.309 ( -7.454 1.710 -6.627) 10.119 3.455 ( -0.981 3.998 -0.664) 4.170 4.110 ( 5.874 3.646 -4.265) 8.123 4.209 ( -5.585 -0.702 6.755) 8.793 4.319 ( 6.221 -9.952 -0.630) 11.753 4.597 ( -4.635 2.106 2.343) 5.604 4.838 ( -16.746 -4.428 1.052) 17.353 5.500 ( -9.034 1.843 -5.294) 10.632 5.611 ( -4.025 -1.940 -5.681) 7.227 6.430 ( 2.334 -0.432 4.135) 4.768 6.572 ( -12.182 6.016 15.504) 20.615 6.676 ( -4.612 -3.085 7.589) 9.401 7.265 ( -6.900 7.967 8.173) 13.337 7.538 ( -6.271 -10.470 9.084) 15.214 8.638 ( 0.903 4.123 4.062) 5.858 8.748 ( -2.091 -0.082 3.866) 4.396 9.161 ( -6.042 -2.352 -10.348) 12.211 9.853 ( 14.241 -2.761 8.801) 16.968 10.924 ( 14.123 24.376 2.585) 28.291 11.287 ( 12.509 -11.100 1.884) 16.829 11.720 ( -4.921 0.448 4.423) 6.632 11.802 ( -1.030 -6.150 0.158) 6.238 12.007 ( 2.319 -0.997 2.641) 3.653 12.396 ( -7.803 -0.130 -10.460) 13.050 13.474 ( 7.921 -2.381 -0.290) 8.276 17.360 ( -8.009 -0.073 -19.952) 21.500 17.898 ( 1.642 -0.221 3.920) 4.256 18.324 ( 8.632 0.416 -2.413) 8.973 18.434 ( -1.310 -2.716 5.528) 6.297 21.016 ( -1.703 17.782 -16.685) 24.444 21.507 ( -1.519 -17.086 10.704) 20.220 23.045 ( 6.034 -1.076 4.039) 7.340 23.581 ( 4.650 1.604 -0.489) 4.943 ======================= Grid point 233 (108/361) ======================= q-point: (-0.60 0.20 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.289 ( -8.552 19.561 -1.473) 21.400 2.557 ( -14.324 5.787 1.483) 15.520 3.159 ( -6.237 -5.026 -2.187) 8.303 3.195 ( -3.555 -13.091 -5.963) 14.818 3.458 ( 0.357 3.914 6.041) 7.207 3.940 ( -7.427 11.652 -11.974) 18.284 4.150 ( -14.499 1.601 6.430) 15.941 4.491 ( 1.152 -9.337 7.257) 11.882 4.605 ( 4.382 -4.965 -0.567) 6.646 4.798 ( -4.804 -10.915 4.133) 12.622 5.306 ( -11.081 0.992 -1.332) 11.204 5.521 ( -0.695 -0.576 -5.158) 5.236 6.382 ( -9.405 8.418 1.376) 12.697 6.587 ( -8.519 -3.835 12.365) 15.497 6.676 ( -8.425 -2.680 4.886) 10.101 7.240 ( -2.607 2.095 3.924) 5.156 7.621 ( -5.995 -8.738 6.939) 12.666 8.630 ( -0.642 10.019 5.475) 11.435 8.795 ( 1.107 -2.305 3.057) 3.986 9.040 ( -2.755 -6.430 -6.529) 9.568 10.137 ( 9.794 -1.800 7.568) 12.507 10.840 ( 8.840 30.274 -0.907) 31.551 11.406 ( -10.720 1.108 8.071) 13.464 11.688 ( -2.338 -0.340 -1.942) 3.059 11.887 ( 4.175 -9.740 -5.854) 12.107 12.183 ( -1.565 -2.135 -0.019) 2.647 12.236 ( 9.013 -3.430 6.742) 11.767 13.625 ( 12.659 -7.311 -5.855) 15.747 17.033 ( -7.046 -0.174 -17.693) 19.045 18.011 ( 5.173 0.001 6.125) 8.017 18.402 ( 7.899 1.811 -0.834) 8.147 18.588 ( 9.873 -3.945 4.346) 11.486 20.607 ( -5.934 14.796 -19.259) 25.001 21.693 ( -10.734 -15.321 10.470) 21.437 23.190 ( 5.754 -0.839 4.609) 7.420 23.635 ( 5.506 2.082 1.309) 6.030 ======================= Grid point 234 (109/361) ======================= q-point: (-0.50 0.20 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.967 ( -10.087 21.204 -0.318) 23.483 2.258 ( -17.829 14.773 0.213) 23.155 3.095 ( -10.710 -9.352 -2.696) 14.472 3.273 ( 0.464 -12.371 5.514) 13.552 3.457 ( -3.459 16.042 -0.058) 16.411 3.564 ( -12.629 2.935 0.167) 12.966 4.021 ( -9.790 -2.590 2.777) 10.500 4.658 ( 0.516 -7.922 1.457) 8.071 4.735 ( 3.423 -9.820 3.035) 10.834 4.902 ( -4.532 -10.767 6.016) 13.140 5.165 ( -10.942 -3.641 2.710) 11.846 5.504 ( 4.803 1.184 -1.628) 5.208 6.138 ( -20.566 4.291 2.818) 21.197 6.517 ( -14.853 -2.341 5.163) 15.899 6.735 ( 2.432 -4.965 1.119) 5.641 7.196 ( -2.490 0.762 -3.883) 4.675 7.713 ( -4.873 -8.011 9.208) 13.142 8.592 ( -0.092 8.841 2.981) 9.330 8.879 ( 1.914 -1.085 5.103) 5.557 9.031 ( -1.259 -9.221 -2.839) 9.730 10.322 ( 5.191 1.431 5.781) 7.900 10.641 ( 4.595 31.584 -2.109) 31.986 11.289 ( -14.587 4.294 9.284) 17.816 11.608 ( -4.828 -0.071 -3.121) 5.749 11.831 ( -0.235 1.144 -9.016) 9.091 12.216 ( -1.312 -10.432 2.201) 10.742 12.615 ( 17.944 -2.654 8.913) 20.210 13.802 ( 14.621 -12.457 -11.453) 22.364 16.784 ( -4.044 0.101 -10.123) 10.902 18.146 ( 5.580 0.167 2.888) 6.285 18.505 ( 10.985 3.576 0.504) 11.563 18.858 ( 16.137 -1.825 6.223) 17.391 20.159 ( -9.304 12.430 -18.411) 24.084 21.720 ( -19.506 -15.464 7.372) 25.961 23.299 ( 3.549 1.371 2.660) 4.642 23.744 ( 6.255 -0.943 4.318) 7.659 ======================= Grid point 235 (110/361) ======================= q-point: (-0.40 0.20 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.650 ( -10.863 21.465 3.440) 24.302 1.830 ( -18.533 22.682 0.001) 29.291 2.942 ( -11.546 17.461 9.429) 22.959 3.196 ( -13.172 -0.589 2.198) 13.367 3.465 ( -2.780 -14.297 6.553) 15.971 3.578 ( 1.616 -2.727 2.831) 4.250 4.021 ( -1.768 -5.893 4.263) 7.485 4.679 ( -2.071 -8.205 -4.887) 9.772 4.855 ( -6.227 -12.736 0.327) 14.180 5.023 ( -6.675 -10.680 13.706) 18.614 5.155 ( -5.082 -5.668 5.760) 9.546 5.570 ( 3.583 1.878 1.668) 4.376 5.862 ( -19.310 -3.529 2.739) 19.820 6.417 ( -6.538 -2.827 -0.059) 7.124 6.779 ( -3.259 -1.618 0.726) 3.710 7.096 ( -0.393 -0.084 -7.088) 7.100 7.831 ( -2.175 -5.325 9.105) 10.770 8.519 ( -1.614 4.236 -4.949) 6.711 8.971 ( -3.923 -6.448 5.020) 9.064 9.095 ( 2.713 -3.969 3.129) 5.736 10.319 ( 4.557 27.281 -5.382) 28.178 10.445 ( -2.008 9.959 6.697) 12.168 11.185 ( -11.889 4.343 11.209) 16.908 11.500 ( -5.189 -0.417 -3.266) 6.145 11.755 ( 2.987 3.402 -2.603) 5.222 12.304 ( -0.034 -8.955 -1.104) 9.022 12.884 ( 11.656 0.756 -2.169) 11.880 13.965 ( 13.170 -15.836 -15.288) 25.651 16.741 ( 2.410 -2.651 5.456) 6.527 18.213 ( 2.951 -1.606 -2.529) 4.205 18.643 ( 15.258 7.453 -0.221) 16.982 19.184 ( 19.143 2.387 7.163) 20.578 19.725 ( -11.158 9.554 -14.331) 20.522 21.620 ( -25.995 -16.894 6.216) 31.620 23.330 ( 2.045 3.112 0.287) 3.735 23.887 ( 2.819 -3.984 2.900) 5.677 ======================= Grid point 236 (111/361) ======================= q-point: (-0.30 0.20 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.393 ( -8.553 21.074 10.382) 25.001 1.466 ( -6.456 25.466 7.687) 27.373 2.798 ( -9.186 26.481 26.675) 38.693 3.126 ( -7.541 -9.993 -0.457) 12.527 3.583 ( -5.093 -7.519 7.370) 11.696 3.675 ( 1.949 -6.879 1.815) 7.377 4.134 ( 2.573 -7.660 1.835) 8.286 4.694 ( 0.369 -8.599 -1.828) 8.798 4.831 ( -22.515 -20.753 4.561) 30.958 5.134 ( -11.003 -5.638 12.019) 17.243 5.218 ( -0.143 -4.388 2.426) 5.016 5.552 ( -5.712 -0.274 6.840) 8.915 5.845 ( -0.236 -6.881 3.485) 7.717 6.398 ( 2.027 -3.782 -2.325) 4.880 6.690 ( -9.336 3.877 2.845) 10.501 7.042 ( 1.575 -3.260 -7.457) 8.290 7.951 ( 2.201 0.531 6.692) 7.064 8.360 ( -4.993 0.638 -8.676) 10.031 8.981 ( -8.737 -12.404 -0.949) 15.202 9.227 ( 4.140 2.687 7.525) 8.999 10.010 ( 2.614 31.224 -7.532) 32.226 10.436 ( -3.555 7.773 8.503) 12.056 11.152 ( -8.225 3.050 12.384) 15.176 11.403 ( -2.688 0.001 -4.611) 5.337 11.789 ( 6.340 4.632 2.203) 8.155 12.337 ( -0.539 -6.767 -4.307) 8.040 12.848 ( 3.073 7.747 -12.984) 15.429 14.064 ( 8.288 -16.271 -18.034) 25.664 17.048 ( 9.950 -12.053 18.760) 24.418 18.202 ( -1.781 -4.902 -5.419) 7.522 18.787 ( 21.102 9.378 -4.585) 23.543 19.349 ( -10.735 -1.043 -10.110) 14.783 19.503 ( 16.226 13.990 9.359) 23.380 21.486 ( -26.863 -19.030 8.638) 34.035 23.325 ( 1.683 2.586 -0.815) 3.191 23.889 ( -5.610 -0.626 -5.111) 7.615 ======================= Grid point 237 (112/361) ======================= q-point: (-0.20 0.20 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.344 ( -1.733 14.927 16.492) 22.312 1.459 ( 13.179 15.662 18.306) 27.461 2.870 ( -2.088 21.668 34.601) 40.879 3.125 ( -1.674 -7.955 -2.669) 8.556 3.648 ( -8.207 -4.382 10.303) 13.882 3.768 ( -0.010 -8.713 -0.700) 8.741 4.253 ( 5.262 -7.088 -1.983) 9.047 4.693 ( -28.909 -11.215 17.432) 35.573 4.822 ( 3.984 -14.066 -5.672) 15.681 5.143 ( -9.881 -6.729 6.353) 13.538 5.254 ( 0.438 0.456 -0.269) 0.687 5.667 ( -0.143 -4.484 15.473) 16.110 5.915 ( -5.072 -5.445 4.231) 8.560 6.447 ( 1.042 -0.782 -2.932) 3.208 6.610 ( -0.941 -0.783 4.089) 4.269 6.977 ( -1.956 -3.355 -9.610) 10.365 7.968 ( 2.064 14.087 1.373) 14.304 8.284 ( -3.032 -9.276 1.542) 9.880 8.953 ( -6.308 -10.331 -2.778) 12.419 9.286 ( 1.199 5.223 0.502) 5.382 9.728 ( 5.592 24.136 -5.576) 25.395 10.394 ( -5.344 10.349 7.796) 14.016 11.171 ( -8.030 1.563 10.697) 13.467 11.321 ( 3.541 -0.029 -8.638) 9.335 11.849 ( 6.085 8.618 0.904) 10.588 12.331 ( 0.406 -3.941 -2.428) 4.646 12.638 ( -1.442 8.997 -7.646) 11.894 14.042 ( 2.181 -13.831 -20.823) 25.093 17.512 ( 9.896 -13.839 11.308) 20.428 18.131 ( -7.003 -8.450 -5.655) 12.346 18.949 ( 16.698 4.250 -7.077) 18.627 19.115 ( -10.566 -1.031 -2.667) 10.946 19.694 ( 11.880 12.470 9.465) 19.652 21.472 ( -14.878 -20.364 10.022) 27.138 23.317 ( 1.421 1.193 -1.924) 2.673 23.620 ( -11.640 10.243 -10.103) 18.506 ======================= Grid point 238 (113/361) ======================= q-point: (-0.10 0.20 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.503 ( 2.893 3.241 23.142) 23.546 1.849 ( 22.646 7.916 17.903) 29.933 3.098 ( 4.245 1.156 8.843) 9.877 3.180 ( 2.589 6.379 16.819) 18.173 3.672 ( -11.945 -5.165 12.039) 17.729 3.808 ( -0.315 -6.412 -2.756) 6.987 4.313 ( 2.034 -3.435 -5.827) 7.063 4.596 ( -25.424 -9.291 12.618) 29.865 4.989 ( 12.519 -3.948 2.187) 13.307 5.126 ( -10.244 -0.996 6.715) 12.289 5.208 ( 0.774 2.341 -4.113) 4.795 5.916 ( -8.945 -4.295 7.489) 12.431 5.978 ( 1.875 -10.665 21.044) 23.667 6.370 ( -7.315 2.980 3.361) 8.585 6.717 ( 3.706 -6.204 -2.760) 7.735 6.836 ( -2.026 -3.522 -11.117) 11.836 7.889 ( -1.886 14.776 7.829) 16.828 8.385 ( 0.311 -8.424 2.374) 8.758 8.917 ( -3.473 -4.977 -3.573) 7.043 9.179 ( -0.053 9.678 -5.048) 10.916 9.678 ( 12.502 6.269 -2.527) 14.213 10.280 ( -6.877 11.888 3.954) 14.292 11.089 ( -4.185 1.857 -4.729) 6.582 11.363 ( 7.419 -2.349 -0.872) 7.831 11.828 ( 2.758 11.917 2.433) 12.471 12.360 ( -1.936 -2.651 -0.107) 3.285 12.534 ( 2.304 4.482 1.198) 5.180 13.889 ( -3.440 -9.856 -20.892) 23.355 17.777 ( 10.246 -5.530 -2.494) 11.907 18.045 ( -10.227 -10.874 -2.240) 15.095 18.823 ( -8.692 7.092 -8.196) 13.893 19.045 ( -10.104 0.609 3.836) 10.824 19.928 ( 15.539 1.273 11.005) 19.084 21.628 ( 0.390 -16.874 1.763) 16.970 23.169 ( -8.284 13.413 -7.282) 17.365 23.389 ( 2.562 2.537 -2.018) 4.132 ======================= Grid point 242 (114/361) ======================= q-point: ( 0.30 -0.70 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.540 ( -9.432 -0.000 -2.766) 9.830 2.569 ( -9.302 -0.000 3.157) 9.823 3.038 ( -3.287 -0.000 -3.959) 5.145 3.108 ( -11.205 -0.000 -5.917) 12.672 3.498 ( -1.399 -0.000 5.412) 5.590 4.027 ( -5.587 -0.000 -15.126) 16.125 4.230 ( -4.674 -0.000 14.427) 15.165 4.395 ( 1.912 0.000 5.573) 5.892 4.551 ( -13.976 -0.000 -3.075) 14.310 4.673 ( 4.014 0.000 4.037) 5.692 5.315 ( -11.804 -0.000 -2.705) 12.110 5.519 ( 0.991 0.000 -4.866) 4.966 6.509 ( -3.178 -0.000 4.801) 5.758 6.563 ( -25.001 -0.000 20.460) 32.306 6.582 ( 1.381 0.000 -9.812) 9.909 7.282 ( -7.787 -0.000 8.014) 11.174 7.526 ( -3.537 -0.000 6.839) 7.700 8.741 ( 1.834 0.000 6.471) 6.726 8.756 ( -3.473 -0.000 4.260) 5.496 8.981 ( -0.997 -0.000 -9.634) 9.685 10.121 ( 10.771 0.000 8.541) 13.746 11.267 ( -3.140 -0.000 8.935) 9.471 11.317 ( 14.878 0.000 -9.665) 17.742 11.658 ( -11.105 -0.000 8.228) 13.821 11.764 ( 1.068 0.000 -3.089) 3.268 12.170 ( -9.361 -0.000 -6.884) 11.619 12.205 ( 16.279 0.000 8.735) 18.474 13.559 ( 11.637 0.000 -6.436) 13.298 17.031 ( -7.039 -0.000 -17.427) 18.795 18.010 ( 4.496 0.000 7.158) 8.453 18.429 ( 12.757 0.000 -5.965) 14.083 18.544 ( 8.165 0.000 8.047) 11.465 20.760 ( -7.105 -0.000 -24.643) 25.646 21.536 ( -10.086 -0.000 15.442) 18.444 23.182 ( 5.622 0.000 5.787) 8.068 23.654 ( 5.299 0.000 0.069) 5.299 ======================= Grid point 244 (115/361) ======================= q-point: (-0.60 0.30 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.300 ( -8.816 15.018 -2.564) 17.602 2.470 ( -10.114 6.572 3.155) 12.467 2.905 ( -12.328 -6.890 -2.982) 14.434 3.041 ( -3.937 -11.824 3.989) 13.085 3.514 ( -2.695 -0.197 2.340) 3.575 3.763 ( -6.603 4.878 -10.812) 13.576 4.125 ( -12.225 16.856 6.232) 21.735 4.482 ( -4.083 -18.428 5.338) 19.615 4.553 ( 0.377 -3.488 5.260) 6.323 4.773 ( 0.021 -3.328 2.473) 4.146 5.136 ( -11.581 -0.498 1.688) 11.714 5.524 ( 6.136 0.774 -2.070) 6.522 6.225 ( -31.711 4.138 6.459) 32.626 6.478 ( -4.264 -1.225 -6.005) 7.466 6.631 ( 1.777 -5.185 2.203) 5.908 7.247 ( -6.271 3.241 4.713) 8.488 7.587 ( -4.077 -4.975 8.952) 11.024 8.721 ( -3.208 4.848 1.710) 6.060 8.824 ( -2.047 -3.117 2.127) 4.293 8.946 ( 5.221 -1.876 -0.446) 5.566 10.335 ( 6.175 0.305 8.099) 10.189 11.135 ( -1.209 20.584 -0.536) 20.627 11.349 ( -3.887 2.333 -0.056) 4.533 11.610 ( -6.519 1.056 1.188) 6.710 11.796 ( 2.564 -6.857 -4.000) 8.342 12.029 ( -6.441 -7.007 -0.005) 9.517 12.575 ( 17.735 -1.352 9.802) 20.308 13.645 ( 13.758 -4.805 -12.463) 19.175 16.785 ( -3.861 0.021 -10.623) 11.303 18.147 ( 5.272 -0.028 2.513) 5.840 18.554 ( 14.751 1.662 -2.606) 15.071 18.832 ( 17.211 -0.919 9.438) 19.650 20.328 ( -10.712 5.642 -22.400) 25.463 21.522 ( -18.312 -6.348 10.270) 21.934 23.314 ( 2.939 0.417 6.061) 6.749 23.733 ( 5.839 -0.307 0.440) 5.864 ======================= Grid point 245 (116/361) ======================= q-point: (-0.50 0.30 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.012 ( -8.467 19.115 0.393) 20.910 2.225 ( -10.357 21.259 2.173) 23.747 2.846 ( -9.726 -13.435 2.535) 16.779 3.171 ( -6.419 -16.479 3.958) 18.123 3.451 ( -7.312 7.860 0.838) 10.768 3.577 ( 0.671 5.049 1.849) 5.418 3.992 ( -3.966 5.263 7.787) 10.201 4.547 ( -2.996 -6.581 -1.775) 7.446 4.668 ( -7.864 -7.955 -2.249) 11.410 4.788 ( -7.289 -14.094 10.919) 19.262 5.112 ( -4.856 -0.769 10.508) 11.602 5.606 ( 6.471 1.845 0.736) 6.769 5.825 ( -27.076 -1.088 1.928) 27.166 6.369 ( -1.256 -1.964 -7.694) 8.039 6.707 ( 0.410 -5.173 -0.318) 5.199 7.163 ( -5.177 5.903 1.784) 8.052 7.704 ( -4.121 -7.623 10.928) 13.947 8.618 ( -2.963 6.021 -3.967) 7.795 8.819 ( -4.703 -7.658 -1.824) 9.170 9.091 ( 5.747 0.378 8.350) 10.143 10.471 ( 1.696 2.498 8.138) 8.680 10.888 ( -1.080 25.631 -4.335) 26.017 11.264 ( -6.143 4.539 4.353) 8.791 11.502 ( -6.811 1.757 -0.153) 7.036 11.805 ( 3.507 1.488 -1.700) 4.172 12.100 ( -1.554 -13.963 0.385) 14.054 12.870 ( 10.246 -1.429 3.129) 10.808 13.728 ( 13.570 -10.145 -16.945) 23.963 16.711 ( 1.845 -0.966 1.041) 2.328 18.189 ( 3.303 -1.055 -6.007) 6.936 18.740 ( 16.141 3.629 0.423) 16.549 19.212 ( 20.069 0.889 8.448) 21.793 19.882 ( -10.499 7.382 -16.486) 20.893 21.394 ( -23.641 -8.986 6.931) 26.224 23.379 ( -0.140 2.197 3.584) 4.206 23.826 ( 4.209 -2.753 0.100) 5.030 ======================= Grid point 246 (117/361) ======================= q-point: (-0.40 0.30 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.769 ( -4.938 21.286 5.744) 22.594 1.934 ( -4.522 27.209 4.141) 27.891 2.896 ( -6.254 -12.900 3.690) 14.803 3.142 ( -10.031 1.505 5.794) 11.681 3.425 ( -1.629 -1.951 9.374) 9.712 3.631 ( 1.437 -0.445 3.802) 4.089 4.053 ( 1.324 0.004 6.159) 6.299 4.491 ( -11.854 -13.139 -5.169) 18.436 4.592 ( -9.320 -6.752 7.831) 13.920 4.979 ( -4.931 -12.108 9.062) 15.907 5.164 ( -7.588 -1.824 10.611) 13.172 5.544 ( -8.488 -0.790 3.789) 9.329 5.764 ( 3.910 -2.538 1.959) 5.057 6.315 ( 3.084 -4.804 -8.241) 10.025 6.711 ( -3.471 -1.957 -0.933) 4.093 7.063 ( -3.215 5.688 0.331) 6.542 7.856 ( -2.188 -8.929 10.197) 13.729 8.445 ( -3.895 7.196 -7.199) 10.898 8.793 ( -5.448 -8.867 -2.562) 10.717 9.257 ( 3.160 0.870 9.300) 9.861 10.530 ( 1.951 11.424 3.520) 12.112 10.567 ( -4.701 22.408 -2.380) 23.020 11.218 ( -4.508 3.623 6.461) 8.671 11.407 ( -4.681 1.052 -0.599) 4.835 11.869 ( 7.066 3.913 3.878) 8.960 12.182 ( -0.949 -10.922 -2.200) 11.181 12.923 ( 0.802 1.716 -6.586) 6.853 13.789 ( 10.176 -14.057 -19.526) 26.123 16.898 ( 8.558 -5.525 13.523) 16.930 18.129 ( -0.421 -3.383 -10.484) 11.024 18.913 ( 16.495 5.204 -3.225) 17.595 19.317 ( -8.716 -1.512 -11.819) 14.763 19.758 ( 17.069 13.309 9.533) 23.651 21.231 ( -22.626 -10.889 7.216) 26.127 23.370 ( -1.457 2.363 0.970) 2.941 23.859 ( -1.091 -2.284 -3.631) 4.426 ======================= Grid point 247 (118/361) ======================= q-point: (-0.30 0.30 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.678 ( 5.140 21.119 7.506) 22.995 1.772 ( 3.087 20.510 11.262) 23.602 2.946 ( -2.845 -10.832 -2.103) 11.395 3.162 ( -2.677 5.806 17.963) 19.066 3.548 ( -2.703 -5.521 8.617) 10.585 3.682 ( -3.127 0.204 6.905) 7.583 4.133 ( 6.344 -5.827 -4.774) 9.848 4.422 ( -20.584 -13.450 12.955) 27.792 4.694 ( 1.291 -5.339 9.390) 10.878 5.035 ( -6.385 -5.957 4.061) 9.630 5.233 ( -2.100 -3.477 6.628) 7.774 5.588 ( -2.094 -4.051 9.687) 10.707 5.843 ( -0.433 -2.460 2.916) 3.839 6.347 ( 6.914 -8.142 -8.853) 13.874 6.645 ( -4.843 1.457 1.135) 5.183 6.969 ( -3.702 3.729 -2.775) 5.942 8.035 ( 0.804 -9.632 7.806) 12.424 8.246 ( -4.075 8.610 -4.099) 10.370 8.775 ( -3.427 -9.133 -3.191) 10.263 9.356 ( -0.182 2.700 6.195) 6.760 10.199 ( 1.360 28.113 -10.319) 29.977 10.542 ( -6.353 6.569 9.690) 13.320 11.224 ( -4.269 3.252 9.058) 10.528 11.327 ( 0.357 1.121 -6.236) 6.346 11.977 ( 7.064 5.466 2.032) 9.160 12.239 ( 0.902 -5.935 1.385) 6.161 12.759 ( -4.898 4.545 -8.600) 10.891 13.782 ( 4.697 -14.979 -21.466) 26.593 17.300 ( 11.233 -9.873 16.281) 22.108 18.006 ( -4.640 -5.956 -10.696) 13.092 18.983 ( 2.885 -0.614 -14.124) 14.428 19.085 ( -2.675 -0.384 -0.984) 2.876 19.986 ( 13.027 18.645 11.382) 25.434 21.194 ( -8.774 -12.687 8.330) 17.531 23.333 ( -1.688 0.743 -0.907) 2.056 23.731 ( -6.473 3.306 -8.126) 10.903 ======================= Grid point 248 (119/361) ======================= q-point: (-0.20 0.30 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.670 ( 3.858 15.566 12.391) 20.267 1.987 ( 19.516 7.885 14.195) 25.388 2.984 ( 2.696 -8.813 -5.566) 10.766 3.302 ( -4.235 -1.011 13.826) 14.495 3.616 ( -3.237 -3.044 3.691) 5.777 3.731 ( -4.823 2.425 15.314) 16.238 4.208 ( 5.072 -9.106 -9.080) 13.823 4.468 ( -11.021 -3.608 16.895) 20.492 4.920 ( 5.416 -4.810 12.677) 14.600 5.057 ( -3.853 -4.463 4.948) 7.697 5.272 ( -0.606 2.698 2.464) 3.704 5.753 ( -2.966 -10.855 12.360) 16.715 5.876 ( -4.605 -2.472 7.500) 9.142 6.390 ( 2.363 -3.913 -5.449) 7.112 6.620 ( -0.642 -3.818 -1.480) 4.145 6.817 ( -5.283 3.347 -5.651) 8.429 8.108 ( -5.079 7.406 2.946) 9.451 8.218 ( 3.419 -8.117 4.708) 9.987 8.783 ( -1.565 -8.663 -3.519) 9.481 9.343 ( -1.001 7.694 1.233) 7.856 9.913 ( 5.089 19.232 -8.516) 21.640 10.459 ( -10.182 8.421 6.306) 14.641 11.164 ( -6.752 6.266 1.576) 9.345 11.335 ( 9.456 -1.138 -4.011) 10.334 11.993 ( 3.591 5.687 -1.617) 6.917 12.328 ( -0.744 0.087 4.130) 4.197 12.601 ( -1.354 2.709 -0.887) 3.156 13.681 ( -0.761 -13.377 -21.388) 25.239 17.667 ( 11.040 -6.502 5.225) 13.837 17.884 ( -7.305 -7.777 -4.574) 11.609 18.793 ( -11.484 -7.058 -7.943) 15.646 19.099 ( -0.755 3.395 0.041) 3.478 20.070 ( 6.924 14.455 9.387) 18.574 21.393 ( 8.514 -10.688 4.876) 14.509 23.275 ( -3.718 0.759 -3.922) 5.457 23.492 ( -4.226 7.494 -6.865) 11.007 ======================= Grid point 249 (120/361) ======================= q-point: (-0.10 0.30 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.827 ( 4.712 2.219 16.951) 17.733 2.398 ( 21.995 4.984 13.462) 26.265 3.041 ( 5.369 -7.254 -6.809) 11.305 3.351 ( -8.970 -7.955 5.303) 13.110 3.605 ( -3.088 -5.197 -3.665) 7.070 3.894 ( 1.034 5.763 20.968) 21.770 4.201 ( 2.016 -3.810 -10.287) 11.154 4.488 ( -4.342 5.204 5.465) 8.707 5.069 ( -8.412 3.916 6.452) 11.301 5.119 ( -2.043 -4.069 3.752) 5.900 5.368 ( 10.856 3.955 15.496) 19.329 5.860 ( -7.796 -4.350 9.554) 13.076 6.068 ( -2.138 -17.686 13.777) 22.520 6.365 ( -4.312 4.833 5.126) 8.261 6.538 ( -5.767 -5.471 -10.249) 12.971 6.759 ( 3.057 -4.037 -1.889) 5.405 8.013 ( -9.023 8.066 7.530) 14.254 8.368 ( 3.702 -6.007 1.693) 7.256 8.781 ( -2.636 -6.166 -3.533) 7.579 9.272 ( 4.181 10.875 -0.080) 11.651 9.830 ( 9.053 5.698 -4.950) 11.787 10.268 ( -11.269 7.120 -0.161) 13.331 11.053 ( 0.620 6.440 -1.821) 6.722 11.455 ( 9.977 -1.594 -1.571) 10.225 11.970 ( 1.414 6.606 1.239) 6.868 12.264 ( -8.213 -0.181 -0.550) 8.233 12.663 ( 6.361 2.927 3.966) 8.048 13.518 ( -4.614 -10.177 -16.431) 19.871 17.761 ( 1.431 -7.003 -9.116) 11.584 17.924 ( 3.311 -2.755 4.532) 6.252 18.591 ( -11.261 -2.932 -8.699) 14.529 18.950 ( -17.357 8.813 6.656) 20.573 20.237 ( 11.658 -1.692 7.368) 13.895 21.637 ( 12.845 -3.716 -2.029) 13.525 23.099 ( -4.498 8.040 -5.461) 10.710 23.410 ( 2.378 -0.144 -2.438) 3.409 ======================= Grid point 254 (121/361) ======================= q-point: ( 0.40 -0.60 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.232 ( -7.017 -0.000 -1.594) 7.196 2.455 ( -4.017 -0.000 4.228) 5.832 2.695 ( -12.126 -0.000 2.765) 12.437 2.960 ( -8.249 -0.000 4.032) 9.182 3.481 ( -2.202 -0.000 1.048) 2.439 3.634 ( -2.429 -0.000 -4.025) 4.701 4.133 ( -7.503 -0.000 5.301) 9.186 4.454 ( 1.327 0.000 6.648) 6.779 4.581 ( -3.621 -0.000 7.018) 7.897 4.650 ( -14.551 -0.000 -2.119) 14.704 5.107 ( -4.803 -0.000 11.327) 12.303 5.624 ( 8.135 0.000 0.507) 8.150 5.816 ( -31.668 -0.000 1.790) 31.719 6.354 ( 1.924 0.000 -12.387) 12.535 6.653 ( 0.306 0.000 2.000) 2.023 7.230 ( -6.271 -0.000 4.424) 7.675 7.623 ( -4.621 -0.000 10.997) 11.928 8.697 ( -4.636 -0.000 -0.001) 4.636 8.729 ( -2.295 -0.000 -6.556) 6.946 9.093 ( 5.400 0.000 9.016) 10.510 10.492 ( 1.610 0.000 9.082) 9.223 11.126 ( -9.541 -0.000 1.999) 9.748 11.322 ( 3.554 0.000 -9.336) 9.990 11.580 ( -6.807 -0.000 2.885) 7.393 11.776 ( 4.368 0.000 0.061) 4.368 11.933 ( -3.227 -0.000 2.490) 4.076 12.855 ( 9.775 0.000 4.882) 10.926 13.636 ( 13.669 0.000 -17.619) 22.299 16.703 ( 1.801 0.000 -0.256) 1.819 18.179 ( 3.494 0.000 -7.302) 8.095 18.771 ( 16.322 0.000 0.464) 16.329 19.219 ( 19.994 0.000 8.966) 21.912 19.952 ( -9.698 -0.000 -17.582) 20.079 21.313 ( -22.862 -0.000 7.734) 24.134 23.399 ( -1.240 -0.000 5.380) 5.521 23.800 ( 4.993 0.000 -1.565) 5.233 ======================= Grid point 256 (122/361) ======================= q-point: (-0.50 0.40 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.097 ( -3.636 13.902 3.081) 14.696 2.384 ( -0.828 21.913 4.359) 22.357 2.667 ( -6.966 -10.784 5.131) 13.825 2.918 ( -8.792 -17.637 -0.932) 19.729 3.487 ( 0.362 2.678 2.574) 3.731 3.620 ( -0.415 -1.081 4.317) 4.470 4.147 ( -1.597 7.274 12.766) 14.779 4.326 ( -14.317 -5.256 -8.633) 17.525 4.555 ( -4.031 3.817 9.350) 10.874 4.736 ( -2.043 -14.395 10.859) 18.147 5.145 ( -12.682 -0.466 12.342) 17.702 5.531 ( -9.582 -0.447 2.209) 9.843 5.741 ( 5.774 -0.439 1.812) 6.067 6.252 ( 4.230 -1.973 -12.964) 13.779 6.666 ( -1.242 -1.850 -0.553) 2.296 7.178 ( -4.673 5.108 3.535) 7.773 7.711 ( -5.069 -5.815 10.984) 13.422 8.566 ( -3.371 6.182 -5.457) 8.908 8.668 ( -3.631 -5.884 -3.582) 7.787 9.263 ( 2.378 0.053 10.336) 10.606 10.587 ( -3.536 1.330 10.479) 11.139 10.962 ( -2.473 13.457 -6.565) 15.176 11.261 ( 2.332 1.192 -5.489) 6.082 11.466 ( -8.256 5.629 3.596) 10.620 11.889 ( 5.476 -3.933 1.892) 7.003 11.997 ( 0.596 -5.825 5.633) 8.125 12.933 ( -0.950 0.005 -2.013) 2.225 13.610 ( 11.686 -5.561 -21.132) 24.780 16.839 ( 8.200 -1.539 10.473) 13.390 18.087 ( 0.504 -1.259 -13.371) 13.440 18.973 ( 14.063 1.691 -1.625) 14.257 19.301 ( -8.766 -0.442 -13.215) 15.864 19.931 ( 20.563 5.558 9.180) 23.195 21.098 ( -22.137 -4.045 7.124) 23.604 23.401 ( -4.178 1.025 2.556) 5.004 23.825 ( 1.956 -1.171 -4.024) 4.625 ======================= Grid point 257 (123/361) ======================= q-point: (-0.40 0.40 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.005 ( 3.373 15.677 6.091) 17.154 2.192 ( -0.440 26.115 2.890) 26.278 2.746 ( -1.607 -11.231 0.843) 11.376 3.033 ( -1.377 -16.937 3.778) 17.408 3.505 ( -0.857 -0.757 2.215) 2.493 3.712 ( -2.339 0.411 13.952) 14.153 4.055 ( -5.538 -3.995 -7.816) 10.379 4.324 ( -3.783 2.911 18.550) 19.154 4.622 ( -2.032 -1.657 11.988) 12.271 4.918 ( -1.435 -8.254 5.256) 9.890 5.143 ( -7.750 -5.252 12.238) 15.408 5.544 ( -0.525 -0.981 5.590) 5.699 5.821 ( 1.540 -0.462 2.295) 2.802 6.217 ( 7.520 -5.838 -12.617) 15.806 6.633 ( -3.479 -1.753 -1.988) 4.374 7.094 ( -4.185 8.703 2.472) 9.969 7.834 ( -4.227 -11.069 7.992) 14.292 8.404 ( -2.294 8.199 -3.658) 9.267 8.641 ( -2.249 -6.455 -3.093) 7.503 9.386 ( -0.864 0.965 9.507) 9.595 10.585 ( -10.083 6.993 3.992) 12.904 10.697 ( 3.349 18.388 -7.563) 20.163 11.253 ( 4.141 0.028 -2.580) 4.879 11.370 ( -7.273 3.317 4.059) 8.965 11.983 ( 1.677 -5.600 -2.071) 6.201 12.178 ( 6.600 0.254 11.953) 13.657 12.804 ( -8.572 1.119 -5.959) 10.500 13.555 ( 7.374 -9.945 -22.891) 26.024 17.173 ( 11.786 -4.687 16.396) 20.729 17.924 ( -2.714 -3.354 -14.370) 15.003 18.958 ( -11.469 -1.349 -14.981) 18.916 19.096 ( 7.729 0.901 -3.171) 8.402 20.295 ( 18.893 15.538 12.796) 27.606 20.998 ( -10.008 -9.927 7.474) 15.955 23.343 ( -4.877 0.343 -0.164) 4.892 23.761 ( -2.356 0.702 -7.132) 7.544 ======================= Grid point 258 (124/361) ======================= q-point: (-0.30 0.40 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.015 ( 3.351 22.506 3.104) 22.965 2.118 ( 12.204 6.741 10.039) 17.180 2.831 ( 4.021 -8.082 -3.383) 9.640 3.179 ( -2.767 -10.671 3.100) 11.452 3.505 ( -4.221 -6.962 -2.197) 8.432 3.867 ( -5.904 7.217 27.129) 28.687 4.031 ( 7.642 -9.711 -10.485) 16.206 4.476 ( 0.243 4.433 17.576) 18.128 4.811 ( -1.772 -6.908 17.227) 18.645 4.997 ( -0.177 -2.858 4.135) 5.030 5.273 ( -0.193 -2.527 10.614) 10.912 5.615 ( -2.689 -4.384 6.277) 8.115 5.850 ( -2.843 -0.787 3.993) 4.965 6.260 ( 8.909 -8.371 -10.663) 16.221 6.564 ( -4.463 -2.926 -3.862) 6.588 6.959 ( -5.693 11.215 1.158) 12.630 7.955 ( -5.168 -14.164 3.623) 15.507 8.305 ( 0.821 8.132 1.884) 8.388 8.648 ( -0.387 -6.576 -2.519) 7.053 9.442 ( -2.206 3.881 7.374) 8.620 10.271 ( -0.950 18.636 -14.424) 23.585 10.594 ( -8.435 8.411 6.164) 13.412 11.281 ( -6.748 6.137 4.369) 10.114 11.315 ( 9.465 -1.340 -4.336) 10.497 12.001 ( 0.508 -3.797 -3.557) 5.228 12.384 ( 2.666 5.440 9.776) 11.501 12.620 ( -5.894 -0.540 -0.701) 5.960 13.450 ( 2.206 -11.984 -22.574) 25.653 17.564 ( 11.688 -4.899 12.209) 17.598 17.769 ( -4.256 -5.380 -8.346) 10.803 18.671 ( -12.329 -5.734 -10.363) 17.096 19.136 ( 3.891 1.039 -3.180) 5.132 20.376 ( 0.609 18.889 7.927) 20.494 21.224 ( 13.678 -9.417 7.692) 18.301 23.266 ( -4.759 -1.124 -2.286) 5.398 23.597 ( -3.912 4.192 -8.446) 10.209 ======================= Grid point 259 (125/361) ======================= q-point: (-0.20 0.40 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.951 ( 1.392 11.188 6.520) 13.024 2.448 ( 19.522 0.869 11.123) 22.485 2.925 ( 7.262 -5.426 -4.269) 10.019 3.209 ( -5.395 -6.618 0.544) 8.556 3.468 ( -5.663 -9.628 -4.622) 12.088 4.049 ( -2.466 9.442 25.902) 27.679 4.105 ( 10.565 -6.278 -13.225) 18.054 4.606 ( 1.450 7.331 7.966) 10.922 5.006 ( -5.606 -7.820 11.573) 15.050 5.101 ( -3.895 -0.864 11.490) 12.163 5.451 ( 9.645 4.644 15.003) 18.430 5.701 ( -5.454 -11.626 6.501) 14.393 5.882 ( -5.449 -4.183 8.706) 11.090 6.348 ( 7.808 -6.303 -5.440) 11.415 6.454 ( -6.876 -4.258 -7.732) 11.189 6.803 ( -4.264 9.329 1.838) 10.420 8.000 ( -9.129 -9.990 3.044) 13.871 8.332 ( 3.841 2.708 3.774) 6.027 8.674 ( -0.262 -5.605 -2.166) 6.015 9.442 ( 0.324 7.951 4.678) 9.231 9.990 ( 4.145 10.823 -13.299) 17.640 10.410 ( -13.798 9.964 2.319) 17.177 11.191 ( -1.721 8.409 2.564) 8.958 11.430 ( 10.713 -1.527 -2.638) 11.138 11.993 ( -0.363 -2.917 -3.098) 4.271 12.301 ( -9.392 3.131 0.507) 9.913 12.718 ( 6.449 3.278 7.599) 10.492 13.319 ( -1.378 -11.853 -16.924) 20.708 17.654 ( 0.585 -5.036 -7.847) 9.342 17.885 ( 5.989 -1.961 8.807) 10.829 18.473 ( -11.137 -8.220 -6.900) 15.466 19.086 ( -7.018 5.077 1.379) 8.771 20.303 ( 1.712 8.878 1.840) 9.226 21.590 ( 18.563 -2.045 5.228) 19.393 23.170 ( -4.320 0.380 -4.294) 6.102 23.436 ( -0.991 2.910 -5.904) 6.656 ======================= Grid point 260 (126/361) ======================= q-point: (-0.10 0.40 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.002 ( -1.664 -3.113 7.727) 8.495 2.821 ( 14.026 -1.345 10.038) 17.301 2.986 ( -0.593 -3.980 -3.188) 5.134 3.234 ( 4.323 -4.825 -0.238) 6.483 3.421 ( -4.255 -7.510 -4.025) 9.524 4.098 ( 9.286 -1.576 -16.958) 19.398 4.210 ( 1.020 7.691 15.335) 17.186 4.584 ( -0.192 10.192 2.822) 10.578 5.050 ( -9.652 7.989 4.289) 13.243 5.088 ( -9.278 -3.691 9.991) 14.125 5.700 ( 3.071 -1.560 1.417) 3.724 5.853 ( -4.346 -3.683 12.210) 13.474 5.989 ( -3.933 -11.821 16.534) 20.702 6.334 ( -4.726 -5.913 0.459) 7.583 6.441 ( 1.151 1.149 4.761) 5.031 6.766 ( 3.420 -1.680 0.169) 3.814 7.967 ( -11.557 -2.750 6.551) 13.566 8.401 ( 2.352 -1.327 0.410) 2.731 8.684 ( -0.516 -3.237 -1.198) 3.490 9.443 ( 4.495 8.337 2.512) 9.799 9.917 ( 9.448 -0.595 -8.121) 12.473 10.125 ( -13.702 8.952 -1.500) 16.436 11.169 ( 2.523 7.787 5.434) 9.825 11.558 ( 10.269 -1.403 -3.056) 10.805 11.966 ( -2.764 -3.651 -2.771) 5.353 12.178 ( -6.103 3.587 2.122) 7.390 12.768 ( 1.110 2.367 -5.853) 6.410 13.289 ( 2.063 -6.202 -0.981) 6.610 17.643 ( 1.020 -4.466 -3.714) 5.897 17.983 ( 2.136 -1.077 -5.410) 5.915 18.352 ( -4.810 -3.071 -2.262) 6.139 18.876 ( -17.603 11.813 6.100) 22.060 20.358 ( 6.846 -7.236 -1.833) 10.128 21.848 ( 14.576 6.775 2.371) 16.248 23.061 ( -0.735 3.740 -3.581) 5.230 23.392 ( 1.550 -2.734 -3.019) 4.358 ======================= Grid point 266 (127/361) ======================= q-point: (-0.50 0.50 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.172 ( -1.672 -0.000 3.810) 4.161 2.560 ( -3.949 0.000 1.739) 4.315 2.667 ( -1.662 0.000 -3.649) 4.010 2.693 ( 7.248 -0.000 8.397) 11.093 3.499 ( -2.401 -0.000 -0.813) 2.535 3.704 ( 0.817 -0.000 11.544) 11.573 4.012 ( -11.292 -0.000 -5.087) 12.385 4.382 ( 0.765 -0.000 19.843) 19.858 4.657 ( -3.335 -0.000 7.418) 8.133 4.783 ( 1.887 -0.000 11.112) 11.271 5.095 ( -10.205 -0.000 12.540) 16.168 5.539 ( 0.374 -0.000 4.724) 4.738 5.818 ( 1.827 -0.000 2.247) 2.896 6.163 ( 7.842 -0.000 -14.262) 16.276 6.614 ( -3.192 -0.000 -2.172) 3.861 7.192 ( -2.979 -0.000 3.230) 4.394 7.717 ( -6.892 -0.000 8.684) 11.087 8.512 ( -0.423 -0.000 -6.022) 6.037 8.550 ( -3.478 0.000 -0.954) 3.606 9.394 ( -1.074 -0.000 10.692) 10.746 10.623 ( -10.194 -0.000 9.394) 13.862 10.909 ( 3.088 -0.000 -13.655) 14.000 11.245 ( 6.874 -0.000 -8.013) 10.558 11.410 ( -9.712 -0.000 5.503) 11.163 11.898 ( -0.167 -0.000 1.757) 1.765 12.192 ( 8.488 -0.000 13.707) 16.122 12.812 ( -10.347 -0.000 -4.389) 11.239 13.464 ( 8.728 -0.000 -23.837) 25.385 17.132 ( 11.940 -0.000 15.958) 19.931 17.894 ( -1.974 -0.000 -15.759) 15.883 18.946 ( -14.275 -0.000 -14.819) 20.577 19.105 ( 9.135 -0.000 -4.211) 10.059 20.459 ( 27.779 -0.000 14.037) 31.124 20.888 ( -17.311 -0.000 6.597) 18.526 23.346 ( -6.236 -0.000 0.137) 6.238 23.766 ( -0.746 -0.000 -6.924) 6.964 ======================= Grid point 268 (128/361) ======================= q-point: (-0.40 0.50 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.208 ( 3.823 2.998 6.450) 8.075 2.391 ( -1.676 17.134 -3.095) 17.492 2.724 ( 9.063 -3.461 -1.671) 9.845 2.964 ( 5.936 -11.905 4.623) 14.084 3.417 ( -7.875 -2.646 -2.527) 8.684 3.890 ( 15.306 -3.637 -9.586) 18.423 3.943 ( -11.281 0.485 27.275) 29.520 4.591 ( 3.011 6.202 12.683) 14.436 4.715 ( -4.458 -3.114 15.028) 15.982 4.938 ( -0.389 -3.449 8.422) 9.109 5.219 ( 1.496 -2.218 16.315) 16.533 5.583 ( -1.829 -0.333 3.423) 3.895 5.842 ( -2.017 -0.187 2.225) 3.009 6.149 ( 10.716 -3.545 -12.578) 16.900 6.526 ( -5.148 -1.246 -4.076) 6.684 7.149 ( -3.239 8.292 2.340) 9.204 7.730 ( -8.770 -9.340 5.157) 13.811 8.430 ( 0.653 5.967 -1.436) 6.172 8.547 ( -0.461 -5.116 -0.884) 5.212 9.485 ( -2.653 1.203 10.314) 10.718 10.468 ( -11.060 4.207 -7.962) 14.263 10.777 ( 1.685 9.423 -5.686) 11.134 11.279 ( 10.185 -2.046 -7.974) 13.096 11.363 ( -8.184 2.557 9.299) 12.649 11.921 ( -0.926 -3.639 -0.208) 3.760 12.475 ( 6.332 3.968 13.988) 15.859 12.591 ( -12.134 -2.175 -1.777) 12.455 13.296 ( 4.548 -4.818 -24.019) 24.916 17.505 ( 12.089 -1.740 16.397) 20.446 17.702 ( -2.230 -2.074 -12.122) 12.499 18.605 ( -12.770 -1.810 -12.216) 17.764 19.145 ( 4.701 0.175 -4.510) 6.517 20.676 ( -6.721 13.297 4.891) 15.682 21.054 ( 21.424 -9.010 12.013) 26.163 23.249 ( -6.232 -0.578 -1.872) 6.533 23.643 ( -2.732 1.233 -8.792) 9.289 ======================= Grid point 269 (129/361) ======================= q-point: (-0.30 0.50 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.167 ( -4.750 11.667 -2.472) 12.837 2.435 ( 12.913 -2.055 8.939) 15.839 2.875 ( 13.096 0.220 -1.898) 13.234 3.133 ( 3.424 -2.619 0.560) 4.347 3.300 ( -8.432 -8.696 -3.133) 12.511 3.986 ( 13.363 -5.850 -11.849) 18.793 4.196 ( -0.730 6.164 25.528) 26.271 4.698 ( 4.757 0.976 4.737) 6.784 4.880 ( -7.121 -3.574 15.568) 17.489 5.058 ( -5.572 -3.539 16.535) 17.804 5.507 ( 10.256 1.473 16.877) 19.804 5.573 ( -5.658 -2.739 2.435) 6.741 5.836 ( -4.740 -1.661 4.567) 6.789 6.223 ( 12.159 -6.236 -9.331) 16.547 6.397 ( -6.565 -2.143 -6.715) 9.632 7.017 ( -5.379 13.353 2.571) 14.623 7.758 ( -10.162 -15.158 3.471) 18.576 8.405 ( 2.142 4.611 1.515) 5.305 8.587 ( 0.881 -4.401 -0.370) 4.504 9.544 ( -1.628 3.818 8.837) 9.763 10.142 ( -5.630 5.697 -17.150) 18.928 10.623 ( -5.837 13.099 -0.373) 14.345 11.315 ( 0.161 4.735 1.725) 5.042 11.395 ( 6.184 -2.201 0.483) 6.582 11.924 ( -1.185 -3.730 -2.412) 4.597 12.333 ( -12.989 0.408 -0.707) 13.015 12.772 ( 6.836 2.588 11.493) 13.621 13.134 ( 1.559 -8.314 -17.868) 19.769 17.588 ( 0.515 -2.547 -7.019) 7.485 17.853 ( 8.253 -1.592 12.922) 15.415 18.352 ( -9.712 -4.950 -9.102) 14.201 19.131 ( -0.943 0.862 -1.860) 2.257 20.490 ( -6.170 10.260 -2.176) 12.169 21.555 ( 22.673 -1.985 11.597) 25.544 23.150 ( -5.278 -1.644 -2.879) 6.233 23.485 ( -2.116 2.187 -8.763) 9.276 ======================= Grid point 270 (130/361) ======================= q-point: (-0.20 0.50 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.994 ( -8.308 1.371 -1.235) 8.511 2.751 ( 10.941 -4.835 8.041) 14.413 2.934 ( -7.423 -2.403 -1.909) 8.033 3.191 ( 10.373 -0.915 1.205) 10.483 3.334 ( 8.047 -1.661 -1.811) 8.414 4.038 ( 10.819 -4.493 -17.000) 20.645 4.350 ( 1.056 7.788 10.966) 13.492 4.756 ( 1.823 7.712 2.443) 8.293 4.988 ( -7.775 -6.927 14.061) 17.497 5.160 ( -10.429 3.300 15.400) 18.890 5.523 ( -10.371 -11.272 -0.882) 15.343 5.834 ( 0.075 0.272 12.392) 12.396 5.908 ( 4.631 -1.270 15.456) 16.185 6.261 ( -4.290 -2.410 -1.054) 5.032 6.371 ( 11.976 -7.162 -4.575) 14.685 6.866 ( -4.963 11.342 3.944) 12.993 7.792 ( -11.104 -15.056 4.759) 19.303 8.424 ( 1.880 2.790 1.160) 3.559 8.631 ( 1.381 -2.878 -0.119) 3.194 9.579 ( 0.894 6.617 4.968) 8.323 9.876 ( -1.424 -1.620 -14.600) 14.758 10.383 ( -7.819 16.803 -0.939) 18.557 11.299 ( -2.249 6.537 7.438) 10.154 11.520 ( 9.811 -3.430 -3.329) 10.914 11.892 ( -2.656 -3.478 -3.540) 5.629 12.207 ( -6.425 -0.555 1.885) 6.718 12.780 ( -2.579 -1.340 -11.918) 12.267 13.204 ( 8.085 -2.933 7.483) 11.400 17.582 ( 2.355 -2.589 -1.964) 4.013 17.967 ( -2.306 -0.776 -5.609) 6.115 18.283 ( 0.991 -3.881 3.343) 5.217 19.036 ( -10.363 5.706 2.581) 12.108 20.318 ( -0.116 2.134 -8.476) 8.742 21.955 ( 18.090 5.192 10.120) 21.368 23.076 ( -2.434 -1.766 -2.705) 4.045 23.367 ( -0.120 -0.137 -6.645) 6.647 ======================= Grid point 271 (131/361) ======================= q-point: (-0.10 -0.50 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.899 ( -10.834 -10.006 1.405) 14.814 2.747 ( -17.153 -10.726 -4.668) 20.762 2.993 ( 5.605 -2.314 5.557) 8.225 3.348 ( 4.125 0.856 4.664) 6.286 3.497 ( 17.837 6.603 0.513) 19.027 3.968 ( 5.914 -4.601 -20.052) 21.407 4.367 ( -0.053 4.401 1.107) 4.539 4.716 ( 3.108 10.095 -0.611) 10.580 4.998 ( -15.573 0.509 7.737) 17.396 5.114 ( -8.671 10.633 12.646) 18.659 5.449 ( -13.632 -13.309 -1.399) 19.103 5.818 ( -6.197 0.045 -0.988) 6.275 6.136 ( 1.496 -8.060 8.077) 11.509 6.427 ( -2.212 -2.286 21.400) 21.636 6.537 ( 7.195 3.780 5.017) 9.552 6.844 ( 5.138 -0.527 5.829) 7.788 7.828 ( -10.535 -11.452 7.064) 17.089 8.404 ( -1.144 2.851 -1.702) 3.512 8.686 ( 3.567 -1.783 0.529) 4.022 9.531 ( -2.450 4.723 -2.897) 6.058 9.839 ( 4.088 -10.436 -4.924) 12.242 10.146 ( -1.693 16.623 -0.307) 16.711 11.322 ( -5.071 3.102 12.134) 13.512 11.627 ( 8.314 -2.280 -4.713) 9.825 11.864 ( 1.028 -3.262 -2.553) 4.268 12.182 ( -0.604 1.735 1.461) 2.347 12.578 ( -7.662 -3.428 -12.054) 14.689 13.452 ( 11.645 2.245 9.158) 14.984 17.603 ( -0.518 -0.154 -4.619) 4.651 17.815 ( -1.755 -4.119 -10.440) 11.360 18.403 ( 6.002 2.543 4.489) 7.915 18.807 ( -17.167 11.338 5.389) 21.268 20.275 ( 4.185 -10.660 -10.870) 15.790 22.175 ( 9.366 13.402 8.543) 18.448 23.064 ( 3.230 0.059 -1.355) 3.503 23.340 ( 1.208 -5.076 -2.964) 6.001 ======================= Grid point 278 (132/361) ======================= q-point: (-0.40 0.60 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.291 ( -10.383 -0.000 -7.658) 12.902 2.400 ( 10.209 0.000 9.443) 13.907 2.901 ( 20.153 0.000 -3.881) 20.523 3.102 ( 9.766 0.000 5.966) 11.445 3.212 ( -13.567 -0.000 -3.818) 14.094 3.929 ( 15.283 0.000 -12.536) 19.767 4.253 ( -0.075 -0.000 29.002) 29.002 4.670 ( 0.349 0.000 -0.933) 0.996 4.885 ( -3.291 -0.000 20.062) 20.330 5.012 ( -6.817 -0.000 15.145) 16.608 5.514 ( 8.225 0.000 14.763) 16.900 5.561 ( -3.024 -0.000 5.964) 6.687 5.821 ( -4.279 -0.000 2.400) 4.906 6.165 ( 13.033 0.000 -10.353) 16.645 6.379 ( -6.447 -0.000 -6.193) 8.940 7.178 ( -2.188 -0.000 1.239) 2.514 7.579 ( -14.080 -0.000 5.257) 15.029 8.464 ( 2.103 0.000 -1.347) 2.497 8.531 ( 0.883 0.000 1.883) 2.079 9.577 ( -2.105 -0.000 10.171) 10.387 10.190 ( -9.697 -0.000 -16.443) 19.089 10.766 ( -1.125 -0.000 -4.655) 4.789 11.329 ( 11.221 0.000 -6.808) 13.125 11.391 ( -7.098 -0.000 10.531) 12.700 11.889 ( -0.613 -0.000 -1.171) 1.322 12.332 ( -15.342 -0.000 -0.855) 15.366 12.797 ( 6.892 0.000 12.905) 14.630 13.058 ( 2.936 0.000 -18.576) 18.806 17.566 ( 0.394 0.000 -6.701) 6.712 17.838 ( 9.581 0.000 14.394) 17.291 18.308 ( -9.321 -0.000 -10.375) 13.947 19.136 ( 0.515 0.000 -2.922) 2.967 20.591 ( -8.979 -0.000 -4.270) 9.942 21.534 ( 24.675 0.000 14.815) 28.781 23.133 ( -5.992 -0.000 -2.621) 6.540 23.505 ( -2.183 -0.000 -9.598) 9.843 ======================= Grid point 280 (133/361) ======================= q-point: (-0.30 -0.40 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.020 ( -14.260 0.996 -6.539) 15.719 2.691 ( 13.078 -1.732 8.460) 15.672 2.892 ( -17.303 -1.870 -4.489) 17.974 3.215 ( 21.097 2.966 -0.126) 21.305 3.321 ( 12.241 -1.131 3.790) 12.864 3.971 ( 12.796 -2.361 -17.413) 21.738 4.485 ( 0.776 7.567 10.720) 13.144 4.713 ( 1.741 -9.757 0.717) 9.937 4.984 ( -7.589 5.068 14.457) 17.097 5.146 ( -10.468 -3.484 23.828) 26.258 5.437 ( -11.380 -0.257 0.762) 11.408 5.809 ( -4.842 -1.797 6.878) 8.601 5.915 ( 9.458 0.951 14.951) 17.716 6.241 ( -1.845 -0.271 -0.794) 2.027 6.263 ( 14.348 -3.883 -7.858) 16.813 7.095 ( -4.230 12.573 2.553) 13.509 7.514 ( -14.477 -14.178 6.767) 21.363 8.473 ( 1.826 2.220 0.257) 2.886 8.584 ( 2.141 -2.134 0.931) 3.163 9.661 ( -0.145 2.481 8.084) 8.457 9.864 ( -6.862 -0.134 -17.956) 19.223 10.633 ( -3.972 9.368 -4.427) 11.097 11.385 ( -5.066 3.092 7.773) 9.780 11.441 ( 7.289 -4.379 -2.178) 8.778 11.862 ( -0.224 -0.313 -3.164) 3.187 12.178 ( -8.745 -1.655 2.987) 9.388 12.742 ( -2.908 -1.823 -17.224) 17.562 13.183 ( 10.050 -0.144 13.440) 16.783 17.552 ( 2.897 -0.852 -0.750) 3.111 17.956 ( -5.103 -0.365 -7.004) 8.674 18.234 ( 5.791 -1.435 7.065) 9.247 19.087 ( -5.336 0.961 0.336) 5.432 20.378 ( -5.227 2.801 -12.105) 13.480 22.020 ( 20.501 2.000 15.478) 25.766 23.035 ( -4.828 -1.772 -2.048) 5.536 23.372 ( -0.329 0.349 -9.324) 9.336 ======================= Grid point 281 (134/361) ======================= q-point: (-0.20 -0.40 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.769 ( -16.477 -4.920 -1.766) 17.286 2.571 ( -22.446 -8.200 -6.377) 24.734 2.978 ( 10.635 0.149 7.549) 13.043 3.412 ( 7.134 5.730 5.099) 10.475 3.585 ( 21.925 2.410 0.322) 22.059 3.893 ( 6.000 -2.908 -21.479) 22.490 4.455 ( -2.979 6.127 0.428) 6.826 4.811 ( 3.073 -4.581 -3.310) 6.433 4.951 ( -12.399 -0.178 6.887) 14.184 5.232 ( -14.163 -7.929 1.039) 16.264 5.329 ( -8.771 10.644 23.876) 27.574 5.825 ( -6.641 0.708 1.199) 6.785 6.000 ( -2.891 -7.557 6.030) 10.091 6.383 ( 8.898 -2.733 0.849) 9.347 6.558 ( 15.474 -0.346 18.537) 24.149 6.956 ( -5.529 12.023 6.217) 14.621 7.558 ( -11.764 -17.546 7.019) 22.261 8.471 ( 0.344 3.590 0.165) 3.610 8.647 ( 3.853 -2.349 -0.145) 4.515 9.568 ( -4.541 -0.193 -13.483) 14.229 9.760 ( 2.101 0.095 3.124) 3.766 10.422 ( -3.436 13.488 -3.932) 14.463 11.362 ( -11.731 1.755 12.880) 17.510 11.566 ( 9.023 -4.412 -3.972) 10.801 11.830 ( 1.884 -0.659 -2.882) 3.506 12.177 ( -0.915 -1.621 3.899) 4.321 12.510 ( -6.157 -3.533 -15.029) 16.621 13.488 ( 12.592 1.670 12.509) 17.827 17.611 ( 2.076 0.903 -0.282) 2.281 17.748 ( -4.246 -3.252 -12.445) 13.545 18.440 ( 7.550 1.680 8.543) 11.524 18.958 ( -13.332 5.385 3.410) 14.777 20.161 ( 0.312 -2.842 -17.145) 17.382 22.385 ( 12.533 10.163 14.949) 21.996 23.011 ( -0.224 -5.326 0.478) 5.352 23.283 ( 1.389 -1.372 -7.618) 7.865 ======================= Grid point 282 (135/361) ======================= q-point: (-0.10 -0.40 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.627 ( -16.591 -12.201 3.460) 20.883 2.288 ( -24.086 -15.399 -3.453) 28.796 3.145 ( 5.346 4.090 3.833) 7.746 3.442 ( -1.803 1.986 -0.643) 2.758 3.742 ( 0.660 -3.313 -14.313) 14.706 3.780 ( 9.913 8.107 -0.418) 12.813 4.339 ( -7.484 1.728 -0.082) 7.681 4.811 ( 5.104 6.420 -4.293) 9.258 4.829 ( -12.047 -5.564 0.116) 13.270 5.100 ( -8.190 0.767 3.510) 8.944 5.428 ( -6.240 8.176 19.788) 22.301 5.700 ( -6.407 0.854 -2.982) 7.118 6.149 ( -1.135 -8.690 7.568) 11.579 6.491 ( -3.067 -1.180 6.224) 7.038 6.801 ( 3.259 10.890 5.930) 12.821 7.070 ( 7.389 -2.097 19.185) 20.665 7.650 ( -8.478 -17.259 6.551) 20.314 8.403 ( -2.782 7.169 -0.762) 7.728 8.736 ( 6.796 -2.723 -1.446) 7.463 9.406 ( -3.693 -4.157 -7.122) 9.035 9.821 ( 3.643 -1.338 -0.906) 3.985 10.261 ( 0.916 10.151 -1.387) 10.286 11.336 ( -16.110 -0.164 16.373) 22.970 11.631 ( 4.738 -2.658 -6.663) 8.597 11.923 ( 10.777 -3.699 1.825) 11.540 12.204 ( 1.032 1.709 -6.784) 7.071 12.321 ( -7.319 -4.394 -0.860) 8.580 13.775 ( 15.392 4.742 7.678) 17.842 17.392 ( -6.408 1.089 -20.034) 21.062 17.800 ( 5.727 -2.838 4.090) 7.588 18.585 ( 5.525 5.928 4.278) 9.164 18.727 ( -14.333 7.950 4.446) 16.983 20.056 ( 2.567 -12.192 -16.496) 20.672 22.494 ( -0.290 17.240 10.504) 20.190 23.139 ( 8.904 -1.095 1.311) 9.066 23.282 ( 1.504 -7.685 0.787) 7.870 ======================= Grid point 290 (136/361) ======================= q-point: (-0.30 -0.30 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.726 ( -18.869 -0.000 -2.701) 19.061 2.494 ( -24.540 -0.000 -7.180) 25.569 2.983 ( 13.515 0.000 7.901) 15.655 3.491 ( 3.515 0.000 5.189) 6.268 3.581 ( 25.305 0.000 -0.412) 25.308 3.876 ( 9.275 0.000 -21.834) 23.722 4.582 ( -6.437 -0.000 1.251) 6.558 4.643 ( -1.513 -0.000 1.104) 1.873 4.984 ( -7.488 -0.000 1.403) 7.619 5.163 ( -11.813 -0.000 4.537) 12.655 5.442 ( -9.413 -0.000 25.353) 27.045 5.836 ( -4.497 -0.000 10.818) 11.716 5.913 ( -6.835 -0.000 -3.632) 7.740 6.353 ( 15.581 0.000 -8.069) 17.546 6.554 ( 13.376 0.000 25.045) 28.393 7.162 ( 0.260 0.000 0.606) 0.659 7.305 ( -19.714 -0.000 12.375) 23.276 8.506 ( 0.932 0.000 0.760) 1.203 8.622 ( 3.867 0.000 -0.285) 3.877 9.562 ( -5.348 -0.000 -17.738) 18.527 9.771 ( 1.726 0.000 6.305) 6.537 10.554 ( -4.252 -0.000 -6.382) 7.669 11.382 ( -12.430 -0.000 13.013) 17.995 11.513 ( 8.635 0.000 -2.503) 8.991 11.827 ( 0.451 0.000 -3.336) 3.366 12.157 ( -1.116 -0.000 5.717) 5.825 12.476 ( -4.476 -0.000 -16.697) 17.287 13.504 ( 12.488 0.000 13.704) 18.540 17.623 ( 4.590 0.000 4.105) 6.158 17.715 ( -6.635 -0.000 -16.073) 17.389 18.456 ( 8.216 0.000 10.266) 13.149 19.001 ( -10.867 -0.000 2.646) 11.185 20.144 ( -2.059 -0.000 -19.813) 19.919 22.489 ( 15.904 0.000 19.293) 25.003 22.945 ( -4.408 -0.000 -0.421) 4.428 23.274 ( 2.118 0.000 -9.496) 9.729 ======================= Grid point 291 (137/361) ======================= q-point: (-0.20 -0.30 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.482 ( -20.938 -4.206 5.713) 22.107 2.078 ( -27.842 -6.986 -5.671) 29.260 3.226 ( 10.163 4.072 5.004) 12.038 3.423 ( -9.203 -3.075 -9.741) 13.750 3.775 ( 6.452 5.211 -8.468) 11.853 3.861 ( 13.135 0.563 -1.723) 13.260 4.382 ( -15.240 3.346 1.512) 15.676 4.675 ( -7.438 -8.701 2.950) 11.821 4.893 ( 1.424 2.580 -4.079) 5.032 5.099 ( -3.580 -0.139 3.875) 5.278 5.546 ( -4.633 3.027 10.377) 11.760 5.780 ( -7.833 8.624 8.274) 14.289 5.979 ( -4.531 -10.242 11.928) 16.361 6.487 ( 13.622 0.124 -4.979) 14.504 6.999 ( 8.330 6.583 15.677) 18.934 7.066 ( -7.778 7.052 16.787) 19.800 7.330 ( -9.658 -18.013 6.347) 21.402 8.508 ( -0.992 3.652 1.512) 4.075 8.688 ( 6.962 -1.906 -2.138) 7.528 9.327 ( -2.145 -2.887 -14.403) 14.845 9.851 ( 2.605 1.979 3.226) 4.594 10.398 ( -3.474 4.477 -5.817) 8.121 11.375 ( -13.473 3.608 18.498) 23.167 11.583 ( 5.096 -2.570 -5.666) 8.043 11.836 ( 2.098 -4.563 2.091) 5.440 12.226 ( -0.891 1.003 -9.127) 9.225 12.257 ( -0.905 -2.401 0.413) 2.599 13.831 ( 15.493 1.599 10.011) 18.515 17.407 ( -5.900 0.545 -21.352) 22.158 17.763 ( 5.208 -1.153 6.652) 8.527 18.661 ( 6.969 2.459 7.880) 10.803 18.833 ( -15.767 3.398 2.475) 16.318 19.909 ( 1.825 -4.337 -21.459) 21.968 22.779 ( 1.060 15.185 11.767) 19.240 23.020 ( 5.542 -11.668 12.647) 18.078 23.215 ( 4.490 -0.668 -8.895) 9.987 ======================= Grid point 292 (138/361) ======================= q-point: (-0.10 -0.30 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.352 ( -21.582 -8.508 11.192) 25.757 1.771 ( -26.691 -17.936 1.221) 32.180 2.963 ( -25.006 -3.972 -17.826) 30.966 3.461 ( 7.808 1.536 4.874) 9.332 3.698 ( -4.795 6.238 2.189) 8.167 3.859 ( -3.803 5.928 -2.390) 7.438 4.262 ( -7.315 0.823 5.915) 9.443 4.663 ( -5.284 -5.220 2.762) 7.924 4.920 ( 11.636 3.243 -3.960) 12.712 5.130 ( 0.071 2.109 5.975) 6.336 5.539 ( -2.500 0.285 -0.275) 2.531 5.708 ( -8.154 13.063 13.266) 20.325 6.133 ( -1.791 -8.821 6.356) 11.018 6.533 ( -4.463 8.299 6.003) 11.173 6.948 ( 1.293 6.536 1.601) 6.853 7.330 ( 1.062 -0.623 9.213) 9.295 7.472 ( -3.742 -19.162 10.200) 22.028 8.441 ( -4.079 8.327 3.397) 9.875 8.785 ( 9.429 -2.407 -5.668) 11.262 9.258 ( 1.988 -9.120 -5.110) 10.641 9.863 ( 1.543 5.569 -1.314) 5.926 10.287 ( -1.276 1.084 -2.583) 3.079 11.351 ( -16.198 8.798 20.554) 27.609 11.564 ( 2.521 -2.732 -8.368) 9.156 12.008 ( -8.703 -1.986 -6.655) 11.135 12.066 ( 12.499 -11.129 3.268) 17.052 12.361 ( 3.349 0.001 5.254) 6.231 14.113 ( 17.227 5.018 3.464) 18.274 17.054 ( -6.313 0.448 -22.553) 23.424 17.933 ( 5.373 -1.557 7.731) 9.543 18.574 ( -13.795 5.537 -1.032) 14.901 18.807 ( 6.110 3.386 5.053) 8.622 19.783 ( 1.846 -10.442 -16.727) 19.805 22.690 ( -7.068 16.779 6.966) 19.494 23.202 ( 5.862 -1.449 -7.297) 9.472 23.411 ( 8.262 -5.575 20.631) 22.913 ======================= Grid point 301 (139/361) ======================= q-point: (-0.20 -0.20 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.288 ( -24.149 -0.000 17.981) 30.108 1.588 ( -30.088 -0.000 -2.601) 30.200 2.929 ( -28.179 -0.000 -20.487) 34.840 3.474 ( 10.478 0.000 5.098) 11.653 3.770 ( -6.200 -0.000 0.736) 6.244 3.906 ( -3.366 -0.000 -1.905) 3.868 4.272 ( -7.522 -0.000 10.087) 12.583 4.603 ( -4.331 -0.000 2.441) 4.971 4.950 ( 11.386 0.000 -3.737) 11.983 5.150 ( 1.000 0.000 5.554) 5.643 5.537 ( -2.011 -0.000 -0.198) 2.020 5.890 ( -8.285 -0.000 13.368) 15.727 5.988 ( -3.149 -0.000 10.047) 10.529 6.653 ( 16.374 0.000 -3.918) 16.837 7.030 ( -20.282 -0.000 10.477) 22.828 7.213 ( 3.923 0.000 -1.959) 4.385 7.345 ( -2.078 -0.000 21.784) 21.883 8.526 ( -3.790 -0.000 3.272) 5.007 8.759 ( 10.486 0.000 -5.678) 11.924 9.165 ( 2.711 0.000 -9.835) 10.202 9.930 ( 2.847 0.000 1.795) 3.366 10.288 ( -4.669 -0.000 -5.288) 7.054 11.506 ( -9.544 -0.000 25.696) 27.411 11.537 ( 2.892 0.000 -8.627) 9.099 11.856 ( -2.708 -0.000 7.509) 7.983 12.026 ( -1.460 -0.000 -13.554) 13.632 12.362 ( 4.432 0.000 4.765) 6.507 14.157 ( 17.189 0.000 5.032) 17.910 17.059 ( -6.071 -0.000 -23.494) 24.265 17.919 ( 4.561 0.000 8.742) 9.860 18.628 ( -15.718 -0.000 -2.632) 15.937 18.840 ( 5.079 0.000 6.109) 7.945 19.685 ( 3.292 0.000 -18.198) 18.493 22.867 ( -4.057 -0.000 2.879) 4.975 23.175 ( 3.236 0.000 -3.169) 4.530 23.351 ( 10.128 0.000 22.920) 25.058 ======================= Grid point 302 (140/361) ======================= q-point: (-0.10 -0.20 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.146 ( -26.950 1.171 13.701) 30.256 1.325 ( -26.142 -17.370 15.543) 35.024 2.245 ( -42.366 -5.883 -11.308) 44.242 3.597 ( 0.354 3.538 -0.698) 3.624 3.694 ( -4.837 -0.998 2.250) 5.427 3.801 ( -6.973 3.686 5.876) 9.836 4.367 ( 0.207 8.846 13.568) 16.198 4.603 ( -0.643 -8.135 2.184) 8.447 5.082 ( 12.822 2.410 -2.573) 13.298 5.232 ( 0.817 1.026 7.020) 7.141 5.496 ( -2.360 1.036 -3.097) 4.030 5.858 ( -5.481 11.141 9.907) 15.884 6.100 ( -0.840 -8.147 4.132) 9.173 6.669 ( -7.677 21.339 8.361) 24.170 6.968 ( -0.958 -6.050 0.957) 6.200 7.270 ( 2.408 -5.348 -4.004) 7.102 7.492 ( -1.404 -7.651 5.769) 9.684 8.482 ( -6.685 2.618 6.146) 9.451 8.808 ( 9.448 -0.897 -10.126) 13.878 9.201 ( 6.681 -7.438 -2.368) 10.274 9.933 ( 0.111 10.146 -0.494) 10.159 10.188 ( -5.413 -6.146 -2.636) 8.604 11.471 ( 0.649 2.106 -6.755) 7.105 11.556 ( -8.786 19.994 17.916) 28.248 11.815 ( -6.689 0.295 -6.564) 9.377 12.117 ( 8.580 -24.826 5.168) 26.771 12.463 ( 3.342 0.240 2.820) 4.379 14.393 ( 16.156 3.604 -2.540) 16.747 16.773 ( -4.063 -0.140 -6.914) 8.021 18.082 ( 2.837 -1.076 8.988) 9.486 18.379 ( -9.543 -0.367 -6.896) 11.780 18.948 ( 3.655 0.824 3.388) 5.051 19.576 ( 2.411 -4.195 -11.760) 12.716 22.787 ( -6.897 12.958 4.741) 15.426 23.194 ( 5.901 -1.395 -5.203) 7.990 23.773 ( 8.988 -0.641 23.077) 24.774 ======================= Grid point 312 (141/361) ======================= q-point: (-0.10 -0.10 0.15) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 0.943 ( -23.534 -0.000 17.021) 29.045 1.022 ( -35.021 -0.000 1.683) 35.061 1.709 ( -37.452 -0.000 35.453) 51.571 3.510 ( -8.119 -0.000 -3.719) 8.930 3.626 ( -4.437 -0.000 2.482) 5.084 3.895 ( -0.460 -0.000 9.749) 9.760 4.482 ( -0.926 -0.000 -5.233) 5.315 4.743 ( 9.069 0.000 19.418) 21.432 5.227 ( 10.470 0.000 -3.423) 11.015 5.290 ( -4.845 -0.000 -1.103) 4.969 5.394 ( -1.899 -0.000 -1.920) 2.700 6.021 ( 2.643 0.000 12.501) 12.778 6.069 ( -0.167 -0.000 -0.482) 0.510 6.707 ( -16.800 -0.000 6.984) 18.194 7.039 ( 8.920 0.000 6.503) 11.039 7.254 ( 5.768 0.000 -7.917) 9.795 7.300 ( -11.224 -0.000 -18.901) 21.982 8.448 ( -7.784 -0.000 6.499) 10.140 8.835 ( 8.633 0.000 -3.576) 9.344 9.223 ( 5.584 0.000 -4.469) 7.152 9.912 ( -20.481 -0.000 -5.977) 21.335 10.042 ( 2.106 0.000 2.097) 2.972 11.420 ( 3.237 0.000 -7.239) 7.930 11.649 ( -4.641 -0.000 -9.482) 10.557 11.752 ( -10.176 -0.000 -0.855) 10.212 12.039 ( 2.257 0.000 5.709) 6.139 12.503 ( 1.533 0.000 -1.441) 2.104 14.535 ( 11.920 0.000 -9.984) 15.549 17.042 ( 24.367 0.000 37.527) 44.743 18.081 ( -5.251 -0.000 -7.067) 8.804 18.303 ( 1.480 0.000 7.510) 7.654 18.996 ( 0.449 0.000 0.145) 0.472 19.496 ( 3.692 0.000 -7.154) 8.050 22.826 ( -5.032 -0.000 4.313) 6.628 23.218 ( 5.970 0.000 -3.864) 7.111 24.048 ( 2.553 0.000 -1.628) 3.027 ======================= Grid point 313 (142/361) ======================= q-point: ( 0.00 0.00 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.570 ( 15.595 0.000 20.145) 25.476 1.793 ( -1.530 -0.000 30.700) 30.738 3.142 ( -1.920 -0.000 -7.737) 7.971 3.175 ( -3.329 -0.000 35.741) 35.896 3.878 ( 2.002 0.000 4.796) 5.197 3.958 ( -4.095 -0.000 -6.939) 8.058 4.309 ( -0.236 -0.000 -4.003) 4.010 4.821 ( 10.359 0.000 -14.693) 17.977 5.084 ( -13.782 -0.000 8.465) 16.174 5.157 ( 3.676 0.000 -0.460) 3.705 5.482 ( -31.193 -0.000 3.136) 31.350 6.085 ( -1.646 -0.000 3.605) 3.963 6.240 ( 8.397 0.000 10.114) 13.145 6.567 ( -7.938 -0.000 12.515) 14.820 6.778 ( -0.967 -0.000 -13.326) 13.361 6.959 ( -9.944 -0.000 24.318) 26.273 7.691 ( 2.176 0.000 12.594) 12.781 8.565 ( -4.390 -0.000 1.942) 4.800 8.846 ( -0.699 -0.000 -9.042) 9.069 9.133 ( -6.394 -0.000 2.295) 6.793 9.499 ( 9.820 0.000 5.515) 11.263 10.083 ( -2.237 -0.000 -3.029) 3.766 11.001 ( -5.320 -0.000 -13.397) 14.415 11.305 ( 10.496 0.000 -7.380) 12.831 11.721 ( -3.796 -0.000 12.699) 13.255 12.379 ( 7.597 0.000 1.986) 7.853 12.440 ( -2.362 -0.000 -1.120) 2.614 13.894 ( 0.799 0.000 -20.846) 20.861 17.665 ( 7.762 0.000 -9.797) 12.499 18.520 ( -4.935 -0.000 -12.893) 13.805 18.598 ( -15.372 -0.000 8.033) 17.345 18.999 ( 14.297 0.000 2.012) 14.438 19.776 ( 21.164 0.000 8.270) 22.722 22.330 ( -34.191 -0.000 -13.824) 36.880 22.859 ( -4.607 -0.000 2.613) 5.296 23.261 ( 6.830 0.000 -4.234) 8.036 ======================= Grid point 314 (143/361) ======================= q-point: ( 0.10 0.00 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.999 ( 14.987 2.142 16.296) 22.243 2.158 ( 5.258 -0.999 27.516) 28.032 3.044 ( 3.571 2.274 -9.065) 10.005 3.524 ( -0.839 -4.277 20.536) 20.993 3.763 ( -4.869 5.098 -10.880) 12.964 3.957 ( 0.177 -0.012 6.728) 6.731 4.227 ( -1.159 1.859 -6.945) 7.282 4.540 ( -9.189 0.552 -19.031) 21.140 5.083 ( -9.634 -1.311 6.209) 11.536 5.244 ( 1.426 -1.249 6.557) 6.826 5.366 ( -4.999 -0.864 19.917) 20.553 6.068 ( -5.817 0.162 2.122) 6.194 6.383 ( 0.823 0.572 5.042) 5.141 6.573 ( -3.480 6.705 3.148) 8.184 6.636 ( -4.965 -0.604 1.103) 5.122 7.100 ( -7.086 11.367 25.769) 29.042 7.870 ( -4.023 -10.822 10.650) 15.708 8.506 ( -1.975 3.059 -0.334) 3.656 8.816 ( 4.296 -3.864 -4.583) 7.375 9.065 ( -6.150 0.000 3.558) 7.105 9.715 ( 14.478 8.982 2.886) 17.280 10.050 ( -4.775 -14.982 -2.845) 15.980 10.807 ( 1.471 -1.779 -15.078) 15.254 11.371 ( 11.925 2.040 -6.494) 13.731 11.839 ( -2.994 -3.929 11.639) 12.644 12.375 ( -5.133 0.787 -0.340) 5.204 12.503 ( 7.903 -1.596 -1.087) 8.136 13.648 ( -2.572 3.400 -15.512) 16.087 17.679 ( 9.862 1.007 -8.396) 12.991 18.201 ( -8.858 10.027 -9.615) 16.476 18.517 ( -14.999 -10.632 1.548) 18.450 19.087 ( -4.249 -0.043 1.798) 4.614 20.203 ( 21.626 1.778 13.581) 25.599 21.774 ( -15.824 7.984 -12.744) 21.830 22.869 ( -3.412 -7.700 0.255) 8.426 23.313 ( 7.576 -0.256 -4.550) 8.841 ======================= Grid point 315 (144/361) ======================= q-point: ( 0.20 0.00 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.292 ( 5.684 8.647 16.825) 19.752 2.583 ( 14.685 -4.238 16.005) 22.131 2.993 ( 6.703 3.577 -7.030) 10.352 3.491 ( -5.244 9.303 -9.366) 14.205 3.638 ( -7.094 -1.924 2.093) 7.642 3.971 ( 0.239 4.256 -7.845) 8.929 4.150 ( 1.454 -2.600 0.758) 3.074 4.346 ( -2.227 -6.553 -5.204) 8.659 5.043 ( -13.333 -5.438 10.658) 17.914 5.319 ( -5.417 -0.198 8.831) 10.362 5.596 ( 4.166 -3.252 10.433) 11.696 5.975 ( -7.902 -1.244 -2.321) 8.329 6.392 ( -0.136 0.030 -2.649) 2.652 6.475 ( 1.970 7.515 -3.319) 8.448 6.686 ( -10.359 2.688 25.389) 27.552 7.133 ( -5.122 20.782 18.285) 28.151 7.992 ( -11.466 -14.891 8.973) 20.826 8.481 ( 2.087 3.985 1.290) 4.679 8.820 ( -2.555 1.923 -0.611) 3.255 9.145 ( 7.578 -4.211 6.089) 10.594 9.749 ( 0.500 -0.363 -4.189) 4.235 10.132 ( 2.515 -2.600 0.299) 3.630 10.783 ( 12.032 -8.747 -9.952) 17.897 11.442 ( 12.377 2.996 -6.492) 14.293 11.959 ( -3.035 -5.558 8.239) 10.392 12.274 ( -8.344 1.371 0.744) 8.488 12.588 ( 5.784 -3.201 -4.818) 8.180 13.432 ( -2.320 5.095 -8.005) 9.768 17.695 ( 7.296 3.846 -7.257) 10.986 17.937 ( -4.496 1.666 -10.230) 11.297 18.404 ( -13.045 -5.629 1.043) 14.246 18.979 ( -16.312 -2.636 4.656) 17.167 20.576 ( 13.933 11.038 12.528) 21.746 21.497 ( 2.761 -3.344 -12.949) 13.656 22.898 ( -0.827 -6.065 -0.351) 6.131 23.361 ( 7.209 0.907 -4.342) 8.465 ======================= Grid point 316 (145/361) ======================= q-point: ( 0.30 0.00 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.365 ( -3.431 12.922 9.404) 16.346 2.936 ( 8.415 -3.154 -2.708) 9.386 3.030 ( 8.352 1.362 9.080) 12.412 3.273 ( 0.929 9.518 -6.091) 11.339 3.515 ( -8.792 0.430 -1.069) 8.867 3.824 ( 4.555 4.837 -11.817) 13.557 4.261 ( 6.210 -6.686 -1.271) 9.213 4.379 ( -0.251 -7.103 0.343) 7.116 5.039 ( -16.144 -9.752 10.683) 21.676 5.287 ( -12.713 -0.130 7.165) 14.594 5.679 ( -3.303 -1.008 -2.458) 4.239 5.840 ( -6.783 -2.668 -4.663) 8.653 6.399 ( 1.470 -2.631 0.876) 3.138 6.423 ( 3.257 7.900 0.807) 8.583 6.873 ( -8.618 3.462 30.659) 32.034 7.058 ( -1.474 19.502 10.410) 22.155 8.032 ( -12.691 -11.249 7.366) 18.489 8.497 ( 1.141 5.593 2.840) 6.376 8.753 ( -2.900 4.201 2.424) 5.651 9.357 ( 5.197 -4.174 1.724) 6.885 9.748 ( -1.051 -13.087 -0.394) 13.135 10.125 ( 7.961 15.424 -2.284) 17.507 11.045 ( 17.126 -12.873 0.832) 21.440 11.502 ( 11.855 2.882 -7.548) 14.346 12.021 ( -4.929 -0.786 5.021) 7.080 12.154 ( -8.487 -0.616 1.138) 8.585 12.586 ( -1.347 -3.533 -6.423) 7.453 13.346 ( 4.113 1.769 -2.690) 5.224 17.608 ( -3.253 2.115 -9.694) 10.442 17.805 ( 2.212 -0.536 -8.531) 8.829 18.325 ( -5.298 -2.572 2.817) 6.528 18.840 ( -18.784 -7.185 6.548) 21.150 20.599 ( 4.454 21.006 -3.318) 21.728 21.646 ( 13.400 -16.180 0.349) 21.012 22.947 ( 2.222 -3.539 -0.131) 4.181 23.392 ( 6.187 2.870 -3.161) 7.517 ======================= Grid point 317 (146/361) ======================= q-point: (-0.60 0.00 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.229 ( -10.979 14.145 6.425) 19.024 2.847 ( -10.419 3.929 -2.701) 11.458 3.126 ( 1.764 8.226 1.183) 8.496 3.340 ( 10.197 -5.648 -1.420) 11.743 3.464 ( -1.754 -3.366 3.394) 5.091 3.757 ( 9.613 6.345 -8.169) 14.121 4.367 ( 1.133 1.910 1.979) 2.975 4.438 ( 4.404 -10.922 -4.871) 12.744 4.980 ( -18.027 -10.442 2.324) 20.963 5.190 ( -12.850 -3.876 6.752) 15.025 5.558 ( -8.919 -0.321 1.663) 9.078 5.722 ( -6.307 -2.645 -5.195) 8.589 6.364 ( -0.223 6.378 -0.364) 6.393 6.542 ( 4.960 -5.712 3.902) 8.512 6.918 ( -4.386 16.473 11.617) 20.629 7.167 ( -1.384 0.393 20.529) 20.580 8.021 ( -11.896 -6.820 6.513) 15.180 8.458 ( -3.022 8.586 4.302) 10.068 8.742 ( 0.671 2.481 2.613) 3.665 9.370 ( -5.056 -8.068 -3.908) 10.292 9.936 ( 8.257 -4.175 3.152) 9.775 10.067 ( 7.622 15.555 0.274) 17.324 11.429 ( 14.503 -9.408 7.642) 18.901 11.537 ( 11.085 2.934 -9.159) 14.676 11.929 ( -9.710 5.495 3.859) 11.806 12.120 ( -1.829 -3.678 -0.275) 4.117 12.484 ( -6.930 -1.355 -2.763) 7.582 13.442 ( 11.064 -5.790 -3.238) 12.900 17.342 ( -9.320 -0.516 -17.244) 19.609 17.824 ( 4.775 1.348 3.032) 5.814 18.371 ( 2.314 -4.993 1.640) 5.742 18.744 ( -16.042 -8.490 6.087) 19.143 20.358 ( 2.931 20.751 -12.943) 24.632 22.020 ( 8.552 -18.774 7.558) 21.971 23.017 ( 5.605 -0.768 -0.466) 5.677 23.419 ( 5.634 4.306 0.163) 7.093 ======================= Grid point 318 (147/361) ======================= q-point: (-0.50 0.00 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.002 ( -16.726 13.226 8.973) 23.134 2.549 ( -18.235 12.058 0.223) 21.863 3.184 ( 3.415 2.262 3.574) 5.436 3.374 ( -1.913 -1.612 -2.271) 3.378 3.514 ( 3.103 -5.551 -5.785) 8.597 3.779 ( 0.851 1.900 2.628) 3.352 4.321 ( -6.520 -1.050 2.318) 6.999 4.585 ( 11.863 -6.748 -5.516) 14.720 4.819 ( -11.598 -3.980 -0.601) 12.276 5.174 ( -6.804 -4.798 6.665) 10.665 5.529 ( -7.808 -6.416 3.995) 10.867 5.607 ( -7.435 -5.355 -0.747) 9.193 6.291 ( -2.591 4.283 -0.482) 5.029 6.701 ( 4.918 -6.718 1.630) 8.484 6.853 ( -4.386 14.099 11.073) 18.457 7.316 ( -4.502 -4.216 6.507) 8.966 7.971 ( -10.749 0.779 6.486) 12.578 8.423 ( -3.117 3.656 8.989) 10.193 8.763 ( 2.122 3.136 1.380) 4.030 9.345 ( -3.527 -7.774 -0.976) 8.592 9.916 ( 8.305 20.520 -5.192) 22.738 10.198 ( 3.764 -4.501 7.051) 9.173 11.509 ( 6.620 3.572 -10.173) 12.653 11.668 ( -9.985 0.613 12.592) 16.082 11.850 ( 5.576 -0.311 -6.695) 8.718 12.165 ( 4.281 -0.774 5.336) 6.884 12.411 ( -3.329 -1.132 2.474) 4.300 13.643 ( 14.672 -11.411 -6.610) 19.727 17.016 ( -8.921 0.159 -15.353) 17.758 17.954 ( 4.934 0.138 7.775) 9.209 18.473 ( 1.297 -7.286 -0.967) 7.464 18.697 ( -6.723 -5.408 4.330) 9.653 20.047 ( 1.663 18.803 -15.189) 24.229 22.325 ( -1.987 -19.493 7.081) 20.834 23.091 ( 8.212 2.330 -3.086) 9.077 23.516 ( 7.571 2.407 7.703) 11.065 ======================= Grid point 319 (148/361) ======================= q-point: (-0.40 0.00 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.757 ( -20.973 11.283 12.010) 26.673 2.175 ( -22.142 13.886 2.312) 26.238 2.975 ( -18.092 16.764 2.681) 24.810 3.510 ( 1.997 -2.827 2.668) 4.370 3.556 ( 6.057 -12.915 -0.194) 14.266 3.764 ( -6.885 -3.053 2.196) 7.846 4.281 ( -8.932 -6.247 3.406) 11.420 4.694 ( 7.754 -1.639 -5.701) 9.763 4.826 ( 6.140 -3.039 2.732) 7.376 5.241 ( -1.767 -3.938 8.072) 9.154 5.453 ( -5.437 -2.560 -3.880) 7.153 5.655 ( -7.031 -14.093 6.220) 16.933 6.215 ( -4.185 1.532 0.105) 4.457 6.801 ( -10.459 4.297 13.172) 17.359 6.830 ( 5.212 -2.027 -0.208) 5.597 7.259 ( -7.403 -6.460 -8.460) 12.966 7.863 ( -7.510 9.594 5.240) 13.263 8.511 ( -1.662 -3.034 7.913) 8.636 8.790 ( 2.473 4.720 5.583) 7.718 9.384 ( 1.734 -1.347 1.370) 2.589 9.774 ( 2.126 12.253 -5.471) 13.586 10.319 ( 0.869 0.473 4.494) 4.601 11.416 ( 2.993 4.292 -10.422) 11.662 11.609 ( -13.414 0.613 11.663) 17.786 11.793 ( -2.527 -2.299 -7.660) 8.387 12.331 ( 7.010 0.872 4.015) 8.125 12.473 ( 6.246 2.476 2.794) 7.277 13.873 ( 16.033 -13.946 -9.834) 23.415 16.791 ( -4.368 -0.094 -4.243) 6.090 18.115 ( 3.301 -1.347 8.437) 9.159 18.438 ( -4.691 -0.774 -5.719) 7.437 18.797 ( 7.310 -4.122 2.633) 8.795 19.745 ( -0.535 14.668 -11.833) 18.854 22.476 ( -10.408 -20.376 4.808) 23.380 23.122 ( 8.099 4.459 -5.165) 10.590 23.756 ( 9.116 -1.646 11.564) 14.817 ======================= Grid point 320 (149/361) ======================= q-point: (-0.30 0.00 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.521 ( -21.606 10.278 15.173) 28.331 1.710 ( -29.777 12.725 -0.775) 32.391 2.693 ( -20.429 18.426 25.867) 37.761 3.493 ( -5.702 -4.995 -2.087) 7.863 3.695 ( -4.822 -2.829 -1.637) 5.825 3.813 ( 5.601 -7.444 5.667) 10.904 4.289 ( -6.190 -11.349 2.137) 13.102 4.760 ( 7.023 -1.998 -1.843) 7.531 4.996 ( 9.325 -2.138 2.006) 9.775 5.334 ( -2.362 -2.101 -7.033) 7.711 5.378 ( -0.596 -1.085 8.796) 8.882 5.773 ( -3.733 -14.356 5.309) 15.755 6.170 ( -4.344 -2.199 3.248) 5.852 6.739 ( -19.269 -3.056 12.036) 22.924 6.922 ( 3.085 -5.081 -0.844) 6.004 7.089 ( -5.217 -4.971 -11.300) 13.402 7.730 ( -1.960 16.735 2.541) 17.040 8.536 ( -4.426 -4.169 -0.519) 6.102 8.902 ( 3.979 6.534 12.229) 14.425 9.376 ( 5.931 15.873 -3.609) 17.325 9.684 ( -7.580 -11.077 -1.597) 13.517 10.316 ( -1.803 6.691 1.919) 7.191 11.300 ( 2.560 2.602 -9.590) 10.261 11.565 ( -10.836 -2.105 5.385) 12.282 11.712 ( -4.324 -3.332 0.228) 5.463 12.421 ( 2.535 -2.662 -1.312) 3.903 12.480 ( 6.615 14.128 -6.214) 16.792 14.076 ( 14.614 -12.858 -13.200) 23.519 16.893 ( 8.287 -6.013 15.938) 18.943 18.203 ( -0.447 2.301 -4.863) 5.398 18.328 ( 2.356 2.745 2.019) 4.143 18.968 ( 9.521 -0.511 1.586) 9.666 19.514 ( -2.548 8.412 -6.657) 11.026 22.543 ( -14.579 -23.820 4.233) 28.246 23.133 ( 7.961 4.124 -5.037) 10.284 23.976 ( 4.178 -2.005 3.287) 5.682 ======================= Grid point 321 (150/361) ======================= q-point: (-0.20 0.00 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.200 ( -24.553 12.643 9.413) 29.177 1.414 ( -16.394 6.932 22.241) 28.486 2.691 ( -19.239 12.318 41.009) 46.943 3.404 ( -7.912 -3.748 -3.458) 9.413 3.660 ( 1.291 -0.627 0.203) 1.450 3.975 ( 2.124 -6.070 2.395) 6.862 4.318 ( -2.815 -8.608 -1.890) 9.252 4.841 ( 1.857 -5.380 -5.454) 7.883 5.144 ( 6.328 0.310 2.288) 6.736 5.200 ( -0.658 2.068 -5.820) 6.212 5.544 ( 5.698 -1.021 11.470) 12.848 5.900 ( -2.709 -13.074 2.137) 13.522 6.250 ( -2.189 -7.750 10.648) 13.350 6.566 ( -23.343 -10.455 -3.312) 25.791 6.896 ( -11.043 -4.847 1.452) 12.147 7.044 ( 2.834 -1.937 -3.515) 4.913 7.576 ( 1.634 23.280 3.841) 23.651 8.516 ( -5.733 -6.777 2.729) 9.287 9.024 ( 5.730 9.809 9.019) 14.505 9.220 ( 3.820 15.584 -8.346) 18.086 9.633 ( -18.831 -17.063 -1.397) 25.450 10.227 ( -0.248 11.913 1.240) 11.980 11.238 ( 5.524 -0.315 -8.658) 10.275 11.450 ( -9.473 -0.815 -2.820) 9.918 11.708 ( -5.719 -1.198 3.697) 6.915 12.288 ( 1.609 10.919 -6.618) 12.869 12.470 ( 2.782 1.941 -0.253) 3.402 14.161 ( 10.498 -8.792 -18.641) 23.130 17.441 ( 17.753 -17.821 16.755) 30.223 18.093 ( 15.085 15.132 -4.823) 21.904 18.442 ( -1.372 -7.672 7.319) 10.691 19.063 ( 5.026 9.552 1.388) 10.882 19.384 ( 1.128 0.736 -4.850) 5.033 22.605 ( -16.407 -28.894 3.642) 33.426 23.154 ( 7.729 2.745 -4.818) 9.513 23.874 ( -11.059 6.675 -12.642) 18.074 ======================= Grid point 322 (151/361) ======================= q-point: (-0.10 0.00 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.175 ( 2.956 5.525 23.991) 24.796 1.508 ( -8.033 1.406 28.344) 29.494 2.862 ( -14.362 6.139 42.019) 44.828 3.273 ( -6.453 -1.573 -5.373) 8.543 3.760 ( 6.973 -1.158 3.210) 7.763 4.030 ( -1.440 -3.894 -1.616) 4.455 4.329 ( -0.314 -3.582 -1.907) 4.070 4.789 ( 2.372 -0.367 -5.793) 6.270 5.146 ( 3.920 0.090 -5.958) 7.132 5.193 ( -5.268 0.526 2.589) 5.893 5.800 ( 0.039 -0.500 10.136) 10.149 5.980 ( -4.452 -14.783 2.291) 15.608 6.177 ( -18.621 -2.993 -7.098) 20.151 6.471 ( 0.536 -1.051 12.675) 12.729 6.843 ( -11.353 -7.172 8.128) 15.697 6.972 ( -4.327 3.421 -4.540) 7.144 7.549 ( 3.661 12.919 12.745) 18.513 8.557 ( -4.689 -6.001 5.131) 9.183 9.015 ( -1.564 5.370 -10.091) 11.538 9.127 ( 8.078 10.694 4.009) 13.989 9.462 ( -17.547 -9.727 1.584) 20.125 10.151 ( 1.084 9.209 -0.079) 9.273 11.227 ( -0.497 0.262 -10.209) 10.224 11.271 ( 0.596 -0.933 -7.723) 7.802 11.671 ( -5.841 3.053 8.668) 10.889 12.265 ( 5.370 2.569 2.344) 6.397 12.471 ( 0.365 0.822 -1.146) 1.457 14.088 ( 5.520 -4.177 -22.003) 23.067 17.687 ( 4.601 -5.113 -10.034) 12.165 18.456 ( 29.022 2.948 6.368) 29.858 18.569 ( -4.263 -14.174 7.849) 16.754 18.940 ( -3.222 15.096 -1.752) 15.535 19.470 ( 13.862 -1.068 0.782) 13.925 22.660 ( -20.340 -34.348 -1.446) 39.944 23.148 ( -0.629 9.522 -8.109) 12.523 23.324 ( -16.528 16.977 -10.114) 25.762 ======================= Grid point 324 (152/361) ======================= q-point: ( 0.10 0.10 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.402 ( 16.628 0.000 10.934) 19.901 2.517 ( 3.810 0.000 23.885) 24.187 3.028 ( 6.788 0.000 -7.638) 10.219 3.584 ( -4.528 -0.000 -10.990) 11.886 3.604 ( -5.964 -0.000 3.414) 6.872 4.020 ( 3.448 0.000 -2.876) 4.490 4.139 ( -0.702 -0.000 -7.016) 7.051 4.267 ( -6.091 -0.000 -4.246) 7.425 4.994 ( -15.197 -0.000 11.944) 19.329 5.318 ( -3.549 -0.000 7.382) 8.191 5.565 ( 3.595 0.000 10.775) 11.359 5.962 ( -8.314 -0.000 -2.803) 8.774 6.387 ( -0.664 -0.000 -2.662) 2.743 6.540 ( 1.711 0.000 -5.207) 5.481 6.717 ( -9.907 -0.000 25.101) 26.985 7.392 ( -6.757 -0.000 27.266) 28.090 7.785 ( -11.334 -0.000 3.566) 11.881 8.520 ( 2.129 0.000 0.691) 2.238 8.826 ( 1.525 0.000 -1.122) 1.893 9.119 ( 4.886 0.000 9.357) 10.556 9.744 ( -11.369 -0.000 -9.641) 14.906 10.116 ( 20.173 0.000 7.969) 21.689 10.701 ( 10.106 0.000 -14.615) 17.768 11.476 ( 13.170 0.000 -7.201) 15.010 11.896 ( -4.929 -0.000 10.425) 11.532 12.290 ( -7.953 -0.000 0.907) 8.004 12.560 ( 6.225 0.000 -5.667) 8.418 13.477 ( -3.306 -0.000 -8.559) 9.175 17.731 ( 9.964 0.000 -7.443) 12.438 17.965 ( -7.573 -0.000 -16.747) 18.380 18.333 ( -13.900 -0.000 8.211) 16.144 18.958 ( -17.364 -0.000 3.836) 17.783 20.687 ( 20.371 0.000 16.388) 26.145 21.466 ( -5.119 -0.000 -19.116) 19.789 22.838 ( 0.407 0.000 1.727) 1.774 23.369 ( 8.093 0.000 -4.414) 9.219 ======================= Grid point 325 (153/361) ======================= q-point: ( 0.20 0.10 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.601 ( 3.007 13.121 7.685) 15.500 2.819 ( 8.185 -9.549 2.952) 12.919 3.064 ( 2.509 1.688 4.930) 5.784 3.422 ( 0.174 5.372 -5.549) 7.725 3.495 ( -5.630 -1.478 -5.860) 8.260 3.930 ( 3.609 6.669 -10.968) 13.334 4.120 ( 4.420 -7.781 -5.937) 10.739 4.286 ( -1.277 -3.654 8.353) 9.206 4.930 ( -16.894 -2.769 10.959) 20.326 5.283 ( -12.577 -0.166 5.288) 13.645 5.655 ( -0.770 -1.111 -0.705) 1.525 5.802 ( -8.029 -1.245 -5.081) 9.583 6.363 ( 1.482 -0.965 -0.656) 1.886 6.522 ( 4.226 2.774 -3.640) 6.229 6.911 ( -10.809 1.244 32.016) 33.814 7.423 ( -7.594 20.759 12.829) 25.558 7.773 ( -12.112 -17.568 8.396) 22.931 8.566 ( 3.043 2.099 2.066) 4.235 8.814 ( -2.845 1.981 2.940) 4.546 9.353 ( 6.528 4.038 4.937) 9.127 9.519 ( -5.008 -11.322 -3.842) 12.962 10.426 ( 18.454 15.833 4.918) 24.807 10.808 ( 18.181 -13.144 -6.011) 23.226 11.555 ( 12.208 2.419 -7.600) 14.582 11.949 ( -5.152 -4.181 7.514) 10.024 12.176 ( -10.448 1.357 2.438) 10.814 12.535 ( 0.992 -1.692 -8.253) 8.483 13.374 ( 0.389 1.011 -4.582) 4.709 17.648 ( -6.796 1.821 -16.209) 17.670 17.787 ( 6.872 -1.062 -5.938) 9.144 18.282 ( -7.907 -1.747 6.817) 10.585 18.755 ( -19.660 -2.367 5.583) 20.574 20.979 ( 7.699 21.416 0.220) 22.759 21.341 ( 8.453 -18.715 -4.844) 21.099 22.896 ( 3.209 -1.779 2.140) 4.247 23.427 ( 7.469 1.008 -3.492) 8.307 ======================= Grid point 326 (154/361) ======================= q-point: (-0.70 0.10 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.493 ( -5.392 15.416 1.435) 16.395 2.864 ( -5.074 -1.775 -4.094) 6.757 3.202 ( 3.766 -8.155 2.759) 9.397 3.294 ( -3.248 7.720 -4.360) 9.443 3.448 ( -0.489 1.415 4.671) 4.905 3.854 ( 10.286 4.993 -9.305) 14.741 4.240 ( 9.085 -10.134 -3.688) 14.101 4.399 ( -1.331 -0.685 7.780) 7.923 4.812 ( -18.064 -5.714 4.823) 19.551 5.130 ( -16.914 -3.227 3.731) 17.618 5.563 ( -7.256 0.705 -2.632) 7.751 5.667 ( -6.264 -3.174 -5.193) 8.734 6.420 ( 2.090 -0.137 0.914) 2.285 6.514 ( 4.639 1.973 -2.129) 5.472 7.094 ( -14.354 1.912 27.997) 31.520 7.285 ( -3.531 14.527 7.346) 16.658 7.842 ( -11.524 -12.271 7.936) 18.611 8.601 ( 1.700 5.721 3.212) 6.778 8.793 ( -2.459 3.458 4.290) 6.034 9.228 ( -7.731 -6.711 -8.128) 13.072 9.795 ( 11.007 -6.802 10.859) 16.892 10.482 ( 16.151 25.385 -1.813) 30.142 11.223 ( 19.231 -14.530 5.876) 24.809 11.593 ( 10.520 3.358 -7.915) 13.586 11.985 ( -8.850 -1.018 6.710) 11.153 12.058 ( -5.606 -1.279 1.258) 5.886 12.438 ( -5.281 -2.933 -5.751) 8.341 13.368 ( 6.923 -2.626 -6.362) 9.762 17.334 ( -9.109 -0.318 -17.279) 19.536 17.844 ( 6.169 0.889 0.556) 6.258 18.301 ( -0.974 -2.827 3.462) 4.575 18.622 ( -14.016 -4.977 6.376) 16.182 20.718 ( 1.972 19.208 -16.427) 25.351 21.699 ( 7.269 -17.116 10.133) 21.177 22.999 ( 5.801 -1.032 2.574) 6.430 23.477 ( 6.580 2.308 -1.596) 7.154 ======================= Grid point 327 (155/361) ======================= q-point: (-0.60 0.10 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.262 ( -11.046 15.752 2.694) 19.426 2.696 ( -12.427 4.965 -1.779) 13.500 3.202 ( 1.929 -0.143 0.225) 1.947 3.301 ( -1.149 -9.124 -3.054) 9.690 3.474 ( -1.655 3.579 4.667) 6.110 3.842 ( 2.821 3.757 -5.961) 7.590 4.329 ( -8.980 1.208 3.100) 9.576 4.476 ( 10.924 -4.416 -1.525) 11.881 4.708 ( -10.049 -7.525 3.044) 12.918 5.043 ( -9.724 -9.497 5.257) 14.573 5.444 ( -9.227 -2.050 1.536) 9.576 5.550 ( -5.915 -2.595 -4.234) 7.723 6.370 ( -2.412 4.625 -2.457) 5.766 6.611 ( 5.742 -4.091 1.075) 7.131 7.076 ( -16.113 9.127 17.061) 25.180 7.265 ( -5.038 0.757 4.661) 6.905 7.876 ( -9.659 -9.001 8.176) 15.529 8.575 ( -0.642 10.766 4.595) 11.724 8.803 ( 0.752 1.392 3.216) 3.584 9.151 ( -5.740 -11.703 -3.133) 13.406 10.091 ( 8.879 -2.510 8.065) 12.255 10.414 ( 12.178 28.316 -2.080) 30.894 11.535 ( 3.067 -2.334 -1.872) 4.284 11.657 ( 9.359 -1.016 -0.698) 9.440 11.870 ( -8.710 2.214 1.819) 9.169 12.133 ( 6.648 -2.609 5.707) 9.142 12.348 ( -5.949 -5.453 -0.045) 8.070 13.456 ( 12.342 -9.129 -10.546) 18.625 17.018 ( -8.965 0.043 -14.545) 17.086 17.958 ( 6.225 0.298 4.537) 7.709 18.372 ( 1.867 -4.223 1.179) 4.766 18.610 ( -3.666 -4.270 5.869) 8.131 20.366 ( -0.589 16.860 -18.064) 24.717 22.000 ( -2.410 -16.958 8.940) 19.321 23.124 ( 7.703 1.328 1.997) 8.068 23.550 ( 6.713 1.518 2.600) 7.357 ======================= Grid point 328 (156/361) ======================= q-point: (-0.50 0.10 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.995 ( -15.187 15.236 6.370) 22.435 2.395 ( -18.550 11.430 -0.826) 21.804 3.246 ( -8.606 5.282 0.769) 10.127 3.342 ( 7.186 -7.969 2.033) 10.921 3.454 ( -3.143 -0.133 3.466) 4.681 3.723 ( -9.334 -1.120 0.523) 9.416 4.192 ( -11.845 -3.081 0.266) 12.242 4.630 ( 8.504 -4.660 -4.514) 10.696 4.769 ( 3.860 -4.055 5.227) 7.659 5.120 ( -3.730 -10.453 6.468) 12.846 5.374 ( -9.502 -6.269 1.753) 11.518 5.488 ( -2.716 -3.590 0.937) 4.598 6.254 ( -6.186 3.213 -0.890) 7.028 6.725 ( 4.861 -5.180 -1.871) 7.346 6.935 ( -23.230 2.956 14.304) 27.441 7.181 ( -3.947 0.665 -5.636) 6.913 7.918 ( -6.826 -3.339 8.058) 11.075 8.541 ( -0.483 6.608 3.859) 7.667 8.861 ( 3.133 3.076 6.308) 7.686 9.187 ( -4.357 -14.510 0.632) 15.163 10.176 ( 7.440 21.960 -3.881) 23.509 10.364 ( 5.673 9.582 6.357) 12.822 11.478 ( -2.840 2.214 -4.387) 5.676 11.655 ( -7.972 3.265 5.733) 10.348 11.765 ( -2.643 -0.480 -7.056) 7.550 12.298 ( 1.449 -4.285 1.145) 4.666 12.476 ( 12.309 -2.192 7.136) 14.396 13.612 ( 15.085 -14.891 -13.420) 25.088 16.788 ( -5.354 -0.266 -6.020) 8.061 18.088 ( 4.667 -1.582 2.867) 5.701 18.430 ( 1.780 -0.168 0.798) 1.958 18.740 ( 8.740 -2.459 4.750) 10.247 20.000 ( -3.773 13.898 -15.693) 21.299 22.132 ( -11.921 -17.979 5.244) 22.200 23.206 ( 7.076 4.883 -1.103) 8.667 23.717 ( 7.343 -2.673 7.689) 10.963 ======================= Grid point 329 (157/361) ======================= q-point: (-0.40 0.10 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.741 ( -17.237 14.302 11.349) 25.109 1.964 ( -24.552 16.173 -0.646) 29.408 3.054 ( -12.940 19.588 16.049) 28.438 3.381 ( -6.993 -6.449 -0.811) 9.547 3.590 ( 3.046 -8.193 0.890) 8.786 3.696 ( -3.778 -6.414 6.975) 10.201 4.107 ( -5.492 -8.567 -1.897) 10.351 4.688 ( 3.654 -5.330 -5.841) 8.711 4.949 ( 6.150 -3.904 5.812) 9.319 5.238 ( -1.301 -8.663 2.293) 9.055 5.345 ( -6.371 -4.270 6.654) 10.154 5.559 ( 0.486 -7.503 4.213) 8.619 6.130 ( -11.168 -1.134 2.389) 11.476 6.687 ( -19.152 -5.963 -0.147) 20.059 6.828 ( -2.562 -5.172 1.170) 5.890 7.061 ( -2.582 3.515 -2.581) 5.067 7.930 ( -2.908 4.968 7.067) 9.115 8.494 ( -3.621 0.757 -2.479) 4.453 8.998 ( 5.536 4.369 11.217) 13.250 9.270 ( -6.224 -16.971 1.037) 18.106 9.949 ( 3.913 29.469 -6.321) 30.393 10.430 ( 2.004 6.752 5.487) 8.929 11.354 ( -4.091 2.896 -3.670) 6.212 11.582 ( -9.875 2.746 5.895) 11.823 11.674 ( 0.323 -0.615 -3.500) 3.568 12.346 ( 0.843 -5.725 -2.960) 6.500 12.661 ( 10.787 6.517 -2.872) 12.926 13.804 ( 14.391 -17.421 -14.036) 26.601 16.796 ( 2.941 -4.792 8.974) 10.590 18.166 ( 3.102 -4.266 -2.991) 6.064 18.443 ( 4.988 7.913 -0.511) 9.368 18.973 ( 15.148 0.915 4.426) 15.808 19.673 ( -6.816 9.289 -9.797) 15.123 22.137 ( -18.626 -21.129 3.621) 28.398 23.223 ( 6.302 5.966 -2.825) 9.126 23.917 ( 3.638 -4.610 4.818) 7.596 ======================= Grid point 330 (158/361) ======================= q-point: (-0.30 0.10 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.498 ( -19.473 20.504 7.809) 29.336 1.570 ( -16.888 10.817 18.129) 27.035 2.979 ( -12.986 18.844 30.273) 37.950 3.308 ( -9.065 -6.863 -2.149) 11.571 3.638 ( 2.443 -2.086 -0.801) 3.311 3.832 ( -2.482 -9.978 5.858) 11.834 4.138 ( 1.915 -10.513 -4.442) 11.572 4.725 ( 2.256 -7.550 -4.338) 8.995 5.113 ( 0.539 -4.903 6.389) 8.071 5.222 ( -0.242 -0.210 -5.100) 5.111 5.479 ( -2.468 -6.965 14.524) 16.296 5.681 ( -2.660 -8.777 4.279) 10.120 6.060 ( -12.658 -10.220 6.554) 17.540 6.480 ( -11.976 -4.591 -3.246) 13.230 6.817 ( -6.319 -3.623 -0.370) 7.293 7.015 ( -1.040 0.048 0.699) 1.254 7.909 ( 0.074 13.735 5.980) 14.980 8.405 ( -5.599 -4.807 -2.039) 7.656 9.150 ( 4.782 4.336 7.801) 10.125 9.296 ( -11.788 -15.561 -1.368) 19.569 9.658 ( 1.703 27.784 -5.926) 28.460 10.429 ( 0.826 10.855 4.814) 11.903 11.251 ( -0.036 1.713 -4.886) 5.178 11.466 ( -9.326 2.301 0.939) 9.651 11.701 ( 1.765 0.785 3.390) 3.902 12.337 ( 0.624 -3.381 -7.383) 8.144 12.616 ( 4.597 11.254 -5.685) 13.421 13.944 ( 10.194 -15.591 -17.205) 25.357 17.156 ( 11.485 -14.144 16.653) 24.683 18.204 ( 5.978 -5.597 -6.199) 10.270 18.434 ( 8.142 10.304 -1.318) 13.199 19.222 ( 17.417 6.865 5.054) 19.392 19.423 ( -8.947 4.657 -4.608) 11.089 22.099 ( -23.010 -26.370 4.157) 35.243 23.222 ( 6.045 4.876 -3.516) 8.525 23.934 ( -5.669 0.125 -5.370) 7.810 ======================= Grid point 331 (159/361) ======================= q-point: (-0.20 0.10 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.358 ( 0.420 14.755 19.386) 24.366 1.559 ( -11.229 4.829 25.325) 28.121 3.052 ( -9.697 13.868 32.634) 36.761 3.218 ( -6.383 -4.450 -2.464) 8.162 3.726 ( 6.465 -2.605 1.072) 7.052 3.914 ( -4.737 -8.290 2.994) 10.007 4.216 ( 4.107 -8.777 -4.349) 10.621 4.756 ( 3.096 -4.063 -5.318) 7.374 5.132 ( -4.128 -2.743 -0.213) 4.961 5.210 ( -1.479 1.321 1.457) 2.460 5.624 ( -24.017 -18.637 8.265) 31.503 5.790 ( 6.742 -3.359 13.807) 15.728 6.067 ( -6.538 -8.134 1.734) 10.579 6.440 ( 0.912 -3.370 4.218) 5.475 6.746 ( -8.660 -3.802 2.126) 9.694 6.979 ( -5.045 -0.902 -2.083) 5.532 7.849 ( 0.401 17.599 9.238) 19.880 8.414 ( -3.312 -9.054 2.841) 10.051 9.155 ( -5.176 5.624 -6.538) 10.058 9.233 ( -8.505 -10.930 1.458) 13.925 9.425 ( 4.832 21.858 -0.540) 22.392 10.376 ( -0.086 14.350 3.784) 14.841 11.214 ( 4.505 -1.235 -8.022) 9.283 11.292 ( -8.124 3.621 -4.536) 9.985 11.746 ( 0.417 4.832 5.770) 7.537 12.302 ( 3.340 -0.084 -2.620) 4.246 12.530 ( 0.664 6.557 -1.612) 6.785 13.946 ( 5.251 -11.682 -20.652) 24.301 17.538 ( 8.147 -10.781 0.532) 13.524 18.297 ( -4.932 -14.867 -0.539) 15.673 18.553 ( 25.834 6.609 0.059) 26.666 19.194 ( -8.963 9.786 -1.631) 13.370 19.474 ( 16.968 4.717 5.521) 18.457 22.067 ( -24.849 -30.752 3.587) 39.699 23.223 ( 5.710 3.342 -4.372) 7.930 23.623 ( -14.828 12.365 -11.384) 22.414 ======================= Grid point 332 (160/361) ======================= q-point: (-0.10 0.10 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.613 ( 11.853 4.647 19.159) 23.004 1.781 ( -0.566 -0.366 29.206) 29.214 3.097 ( -2.081 -3.675 -5.321) 6.793 3.289 ( -2.094 10.230 30.082) 31.843 3.829 ( 2.706 -6.140 -3.514) 7.574 3.917 ( -6.245 -2.955 3.506) 7.747 4.272 ( 1.825 -4.533 -4.907) 6.925 4.770 ( 6.534 -5.388 -15.277) 17.467 5.116 ( -13.808 2.553 12.839) 19.026 5.152 ( 3.041 -0.326 -1.179) 3.278 5.431 ( -25.066 -4.619 7.487) 26.565 6.069 ( -0.871 -2.203 4.279) 4.891 6.165 ( 7.152 -8.001 13.210) 17.020 6.530 ( -7.735 -3.850 9.428) 12.788 6.726 ( -0.326 -5.018 -5.671) 7.579 6.898 ( -9.390 -4.400 10.048) 14.440 7.853 ( 0.270 14.589 13.587) 19.938 8.488 ( -2.868 -7.646 2.384) 8.507 8.932 ( -2.404 7.894 -8.239) 11.660 9.154 ( -9.597 -1.343 0.372) 9.697 9.462 ( 11.927 2.768 2.608) 12.519 10.254 ( -2.566 15.595 0.579) 15.815 11.025 ( -5.292 2.782 -13.246) 14.533 11.276 ( 8.728 -2.414 -5.677) 10.688 11.783 ( -1.145 6.032 9.974) 11.713 12.370 ( 4.693 -1.193 1.161) 4.979 12.472 ( -0.219 3.684 -0.819) 3.780 13.828 ( 0.797 -7.436 -20.288) 21.623 17.638 ( 8.204 -2.912 -8.147) 11.923 18.289 ( -10.200 -14.205 -2.787) 17.709 18.781 ( -0.451 7.263 -2.333) 7.642 19.033 ( 5.790 3.825 -0.029) 6.939 19.778 ( 19.009 1.788 10.214) 21.654 21.999 ( -23.591 -25.772 -2.948) 35.063 23.106 ( -8.575 15.864 -6.343) 19.116 23.290 ( 3.232 4.272 -4.408) 6.938 ======================= Grid point 335 (161/361) ======================= q-point: ( 0.20 0.20 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.711 ( -0.324 -0.000 -9.395) 9.401 2.779 ( -4.203 -0.000 4.169) 5.920 3.118 ( -3.177 -0.000 3.286) 4.571 3.353 ( -4.582 -0.000 -6.262) 7.759 3.484 ( 1.798 0.000 6.246) 6.499 3.914 ( 10.391 0.000 -13.480) 17.019 4.129 ( 9.225 0.000 0.648) 9.248 4.372 ( -1.719 -0.000 9.675) 9.826 4.781 ( -15.923 -0.000 5.797) 16.946 5.095 ( -19.515 -0.000 1.716) 19.590 5.573 ( -5.739 -0.000 -3.432) 6.687 5.633 ( -6.746 -0.000 -4.819) 8.290 6.415 ( 3.894 0.000 2.881) 4.843 6.538 ( 4.191 0.000 -6.447) 7.689 7.101 ( -15.987 -0.000 29.516) 33.567 7.498 ( -9.974 -0.000 2.936) 10.397 7.659 ( -8.606 -0.000 13.403) 15.928 8.646 ( 3.331 0.000 2.684) 4.278 8.834 ( -3.409 -0.000 5.722) 6.661 9.166 ( -8.997 -0.000 -11.836) 14.867 9.732 ( 13.504 0.000 13.334) 18.978 10.856 ( 19.807 0.000 -10.717) 22.521 10.951 ( 19.518 0.000 14.420) 24.267 11.632 ( 10.383 0.000 -8.197) 13.228 11.945 ( -5.073 -0.000 8.098) 9.556 12.064 ( -10.879 -0.000 2.937) 11.269 12.409 ( -4.273 -0.000 -7.543) 8.669 13.346 ( 4.935 0.000 -7.296) 8.808 17.331 ( -9.038 -0.000 -17.420) 19.625 17.852 ( 6.822 0.000 -0.264) 6.827 18.276 ( -2.419 -0.000 4.850) 5.420 18.578 ( -12.884 -0.000 5.872) 14.159 20.930 ( 0.679 0.000 -24.640) 24.649 21.507 ( 7.559 0.000 17.685) 19.233 22.989 ( 5.933 0.000 3.825) 7.059 23.498 ( 6.919 0.000 -2.185) 7.256 ======================= Grid point 336 (162/361) ======================= q-point: (-0.70 0.20 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.516 ( -5.086 11.400 -5.420) 13.609 2.730 ( -8.124 -0.940 0.268) 8.183 3.128 ( -3.648 -7.133 2.324) 8.342 3.200 ( -6.890 -0.411 -4.605) 8.297 3.551 ( -1.421 3.140 6.793) 7.618 3.885 ( 6.071 1.119 -13.225) 14.595 4.327 ( 8.058 -0.520 5.257) 9.635 4.425 ( -4.076 -3.142 5.861) 7.799 4.668 ( -7.932 4.721 4.953) 10.476 4.865 ( -16.393 -9.848 1.655) 19.195 5.436 ( -8.907 0.292 -1.676) 9.068 5.514 ( -4.469 -1.237 -3.391) 5.744 6.453 ( 0.728 4.896 -4.184) 6.481 6.539 ( 4.165 -4.432 -0.919) 6.151 7.121 ( -24.961 -0.540 20.466) 32.283 7.385 ( -5.449 8.218 4.186) 10.712 7.718 ( -8.659 -7.515 10.543) 15.576 8.722 ( 3.757 4.208 3.953) 6.888 8.831 ( -3.618 2.985 4.124) 6.245 8.980 ( -4.970 -7.149 -6.948) 11.139 10.055 ( 10.782 -1.194 11.331) 15.686 10.888 ( 16.550 22.337 -5.874) 28.414 11.392 ( 8.790 -12.151 7.175) 16.625 11.658 ( 8.611 0.447 -7.632) 11.515 11.903 ( -14.975 1.088 7.505) 16.786 12.089 ( 9.107 -1.735 6.234) 11.172 12.263 ( -7.684 -3.063 -4.029) 9.201 13.345 ( 10.090 -3.234 -12.644) 16.496 17.018 ( -8.999 -0.005 -14.133) 16.754 17.962 ( 6.963 0.169 2.378) 7.359 18.324 ( 2.080 -1.352 2.880) 3.801 18.557 ( -1.597 -1.626 6.486) 6.874 20.597 ( -2.188 7.947 -23.312) 24.727 21.770 ( -2.222 -7.858 13.108) 15.444 23.138 ( 7.347 0.360 5.577) 9.231 23.569 ( 6.411 0.567 -0.561) 6.460 ======================= Grid point 337 (163/361) ======================= q-point: (-0.60 0.20 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.264 ( -9.293 14.527 -0.792) 17.264 2.571 ( -11.992 7.893 0.113) 14.357 3.103 ( -7.065 -9.294 -2.116) 11.865 3.219 ( -0.263 -9.469 5.857) 11.138 3.562 ( -2.088 4.483 5.496) 7.393 3.733 ( -5.826 1.460 -8.950) 10.778 4.229 ( -14.113 8.774 1.726) 16.707 4.558 ( 5.408 -3.115 0.711) 6.282 4.672 ( 0.245 -7.378 6.436) 9.794 4.906 ( -3.434 -11.830 6.329) 13.849 5.302 ( -10.279 -1.998 1.282) 10.550 5.463 ( 0.055 -0.375 -0.642) 0.745 6.328 ( -4.150 4.962 -4.537) 7.901 6.625 ( 2.576 -6.273 -2.818) 7.343 6.912 ( -30.650 -2.603 10.068) 32.366 7.290 ( -4.073 8.426 2.617) 9.718 7.808 ( -6.917 -7.298 11.713) 15.437 8.689 ( -0.948 8.684 -0.589) 8.756 8.887 ( 3.480 -0.371 6.919) 7.754 8.964 ( -4.126 -9.834 -0.318) 10.669 10.298 ( 7.654 1.220 8.053) 11.177 10.793 ( 10.149 28.177 -3.537) 30.157 11.479 ( -4.912 -2.290 -1.768) 5.701 11.686 ( 1.285 -0.441 -2.632) 2.962 11.780 ( -8.394 1.645 1.293) 8.651 12.183 ( -4.777 -7.989 -0.567) 9.325 12.424 ( 16.862 -2.729 10.385) 19.991 13.392 ( 13.998 -9.216 -16.817) 23.742 16.783 ( -5.967 -0.241 -7.214) 9.365 18.064 ( 5.775 -1.048 -1.887) 6.165 18.430 ( 5.499 0.114 5.252) 7.605 18.709 ( 10.140 -1.143 6.925) 12.332 20.208 ( -5.780 9.133 -20.398) 23.084 21.873 ( -11.731 -10.957 7.283) 17.627 23.282 ( 6.087 3.525 4.462) 8.329 23.671 ( 6.320 -2.311 2.513) 7.183 ======================= Grid point 338 (164/361) ======================= q-point: (-0.50 0.20 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.006 ( -11.852 15.554 4.766) 20.127 2.263 ( -16.983 17.295 1.365) 24.278 3.094 ( -7.435 -11.261 1.450) 13.572 3.401 ( 1.976 -10.612 4.259) 11.604 3.500 ( -7.777 11.043 4.230) 14.154 3.597 ( -6.541 -3.935 4.866) 9.052 4.033 ( -5.005 2.291 -1.135) 5.620 4.598 ( -0.404 -4.660 -4.046) 6.184 4.838 ( -0.518 -8.583 6.758) 10.937 5.053 ( -2.048 -11.213 7.185) 13.474 5.256 ( -6.533 -4.011 7.372) 10.636 5.512 ( 5.225 -0.027 1.790) 5.523 6.144 ( -14.063 2.677 -0.463) 14.323 6.530 ( -18.393 -10.451 -6.653) 22.177 6.752 ( -4.079 -3.510 2.304) 5.854 7.182 ( -5.003 8.463 2.479) 10.138 7.913 ( -4.952 -5.020 10.810) 12.907 8.573 ( -3.416 6.833 -3.043) 8.223 8.989 ( -6.659 -12.219 1.724) 14.022 9.062 ( 6.595 1.070 8.957) 11.175 10.395 ( 6.250 13.820 -0.585) 15.179 10.631 ( 2.775 22.005 2.679) 22.341 11.374 ( -6.627 -0.811 -2.623) 7.174 11.633 ( -11.537 3.000 7.193) 13.923 11.697 ( 5.083 2.406 -5.455) 7.834 12.214 ( -1.008 -9.553 -2.461) 9.916 12.727 ( 12.558 1.679 2.267) 12.870 13.504 ( 14.740 -15.628 -16.981) 27.384 16.730 ( 0.463 -2.759 4.106) 4.969 18.092 ( 4.187 -3.775 -8.144) 9.905 18.565 ( 7.766 5.596 4.765) 10.692 18.992 ( 18.000 1.115 6.812) 19.278 19.824 ( -8.396 7.573 -14.835) 18.653 21.830 ( -18.779 -13.670 4.069) 23.581 23.334 ( 4.070 6.535 0.775) 7.738 23.823 ( 3.731 -5.794 3.324) 7.651 ======================= Grid point 339 (165/361) ======================= q-point: (-0.40 0.20 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.794 ( -12.868 14.708 11.369) 22.609 1.889 ( -14.859 23.617 6.646) 28.683 3.118 ( -6.877 -9.379 3.200) 12.062 3.315 ( -12.609 10.420 11.370) 19.921 3.564 ( 2.475 -8.842 -0.688) 9.208 3.663 ( -3.744 -5.534 10.314) 12.289 4.016 ( 4.692 -1.113 -3.234) 5.806 4.588 ( -0.546 -7.798 -3.825) 8.703 4.952 ( -8.678 -12.091 8.931) 17.357 5.181 ( -0.432 -5.582 3.573) 6.641 5.352 ( -5.714 -5.298 13.623) 15.694 5.613 ( 3.828 -0.415 2.265) 4.467 5.922 ( -17.777 -5.694 3.868) 19.063 6.354 ( -7.626 -8.981 -6.025) 13.233 6.756 ( -1.757 -3.640 -2.321) 4.661 7.077 ( -5.160 6.591 3.382) 9.028 8.012 ( -2.192 -1.840 9.618) 10.035 8.408 ( -6.051 5.527 -3.691) 8.988 8.998 ( -10.518 -13.935 0.455) 17.465 9.243 ( 6.049 2.910 7.993) 10.438 10.184 ( 3.179 29.972 -8.117) 31.214 10.602 ( 0.086 9.270 8.137) 12.335 11.270 ( -3.329 -0.370 -4.211) 5.381 11.524 ( -9.928 4.371 5.342) 12.092 11.739 ( 7.435 3.123 0.886) 8.113 12.240 ( 0.197 -7.306 -4.782) 8.734 12.778 ( 5.405 7.041 -6.353) 10.916 13.641 ( 10.744 -18.044 -16.804) 26.896 16.955 ( 8.185 -8.872 14.197) 18.635 18.073 ( 2.875 -7.440 -11.190) 13.742 18.635 ( 10.312 10.806 -1.261) 14.990 19.280 ( 12.286 0.705 1.227) 12.368 19.553 ( -1.318 8.859 -1.789) 9.134 21.719 ( -22.771 -16.927 4.295) 28.696 23.320 ( 3.229 6.228 -1.511) 7.176 23.893 ( -2.641 -4.300 -2.216) 5.511 ======================= Grid point 340 (166/361) ======================= q-point: (-0.30 0.20 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.655 ( -6.743 16.542 14.886) 23.253 1.710 ( -6.711 14.906 17.356) 23.842 3.089 ( -8.290 -7.987 -3.416) 12.008 3.299 ( -4.838 8.862 21.291) 23.564 3.645 ( 2.894 -7.678 -3.514) 8.926 3.804 ( -3.268 -2.768 14.141) 14.776 4.065 ( 5.783 -5.657 -5.779) 9.942 4.635 ( 2.256 -9.520 -4.728) 10.866 5.023 ( -11.688 -9.117 11.642) 18.848 5.216 ( -5.072 -1.910 2.731) 6.069 5.404 ( -15.096 -5.777 12.102) 20.192 5.717 ( 2.849 -4.479 9.265) 10.678 5.922 ( -2.122 -8.040 3.988) 9.222 6.332 ( -0.189 -8.739 -1.918) 8.949 6.704 ( -4.236 -1.721 -2.622) 5.271 6.994 ( -6.239 3.498 1.861) 7.391 8.092 ( -0.001 7.121 8.663) 11.214 8.280 ( -5.682 -3.240 1.054) 6.626 8.962 ( -11.591 -13.077 -0.134) 17.475 9.326 ( 2.938 6.951 1.720) 7.740 9.862 ( 1.808 27.294 -7.280) 28.306 10.605 ( -1.367 10.946 7.795) 13.507 11.196 ( 1.625 -1.122 -7.627) 7.878 11.385 ( -8.260 6.683 -0.190) 10.627 11.832 ( 6.498 4.774 2.988) 8.599 12.261 ( 2.349 -3.925 -1.351) 4.770 12.668 ( 0.163 7.988 -5.278) 9.575 13.695 ( 5.383 -16.401 -19.008) 25.676 17.344 ( 10.324 -10.603 9.953) 17.835 18.057 ( -1.399 -12.331 -7.535) 14.518 18.679 ( 16.363 7.554 -6.002) 18.996 19.224 ( -10.456 -3.187 -3.561) 11.496 19.685 ( 19.288 15.970 9.108) 26.647 21.624 ( -22.079 -19.947 5.473) 30.254 23.289 ( 3.017 4.270 -3.052) 6.054 23.750 ( -9.536 2.883 -8.665) 13.204 ======================= Grid point 341 (167/361) ======================= q-point: (-0.20 0.20 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.712 ( -0.169 6.621 18.577) 19.722 1.835 ( 6.596 7.584 21.462) 23.699 3.008 ( -3.298 -6.499 -6.416) 9.710 3.453 ( -1.081 4.653 19.457) 20.035 3.686 ( -0.171 -8.085 -5.475) 9.766 3.909 ( -5.720 2.930 14.638) 15.987 4.144 ( 5.992 -9.382 -7.679) 13.524 4.654 ( 0.592 -7.265 -10.256) 12.582 5.108 ( -5.473 -2.840 16.876) 17.967 5.164 ( -7.501 -0.030 4.626) 8.813 5.379 ( -11.778 -0.302 10.382) 15.704 5.972 ( 2.360 -10.160 11.610) 15.607 6.016 ( -0.363 -6.521 7.368) 9.846 6.423 ( -1.675 -9.278 2.974) 9.886 6.642 ( -1.227 -3.444 -4.029) 5.441 6.873 ( -9.989 2.204 2.537) 10.540 8.100 ( -1.379 12.465 11.794) 17.215 8.332 ( -2.185 -9.700 3.251) 10.461 8.916 ( -8.618 -9.643 -0.888) 12.964 9.234 ( 0.547 12.154 -4.988) 13.149 9.651 ( 4.565 16.169 -2.486) 16.983 10.529 ( -5.152 14.294 5.178) 16.052 11.089 ( -1.765 3.645 -13.197) 13.804 11.258 ( 3.784 1.610 -3.464) 5.377 11.894 ( 2.779 5.716 5.123) 8.163 12.346 ( 3.424 -1.014 3.058) 4.701 12.556 ( -0.495 5.378 -2.236) 5.845 13.643 ( 1.004 -13.273 -19.000) 23.199 17.571 ( 9.151 -4.393 -4.063) 10.933 18.061 ( -7.576 -12.141 -0.758) 14.331 18.809 ( 9.339 -2.656 -6.496) 11.682 19.082 ( -4.202 0.422 -1.527) 4.490 19.905 ( 14.381 13.308 11.787) 22.866 21.594 ( -14.541 -19.403 2.607) 24.387 23.250 ( 0.828 3.297 -4.966) 6.018 23.438 ( -8.272 9.478 -8.614) 15.246 ======================= Grid point 342 (168/361) ======================= q-point: (-0.10 0.20 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.950 ( 3.781 -2.087 20.475) 20.925 2.194 ( 15.016 2.997 19.125) 24.500 2.973 ( 3.048 -5.486 -8.186) 10.315 3.564 ( -5.346 -7.061 1.356) 8.960 3.666 ( -2.994 -0.137 2.631) 3.988 3.971 ( -1.689 2.272 8.410) 8.873 4.165 ( 1.203 -4.918 -7.353) 8.928 4.526 ( -4.321 -0.180 -11.007) 11.826 5.130 ( -5.312 3.257 4.705) 7.808 5.271 ( -2.666 1.686 11.186) 11.622 5.396 ( -2.549 2.650 19.733) 20.073 6.050 ( -5.321 -2.433 4.731) 7.524 6.294 ( 4.470 -12.015 7.063) 14.636 6.458 ( -4.114 -4.490 0.277) 6.096 6.620 ( -7.255 -2.447 4.652) 8.959 6.862 ( -5.706 -11.279 12.113) 17.507 8.101 ( -5.442 12.539 12.834) 18.750 8.413 ( -0.687 -7.114 1.188) 7.245 8.863 ( -4.031 -2.739 -2.230) 5.360 9.108 ( 1.816 8.313 -1.043) 8.572 9.648 ( 9.390 2.499 -0.857) 9.755 10.330 ( -9.465 14.942 0.592) 17.698 10.878 ( 3.372 6.720 -13.238) 15.224 11.325 ( 10.570 -2.415 -5.251) 12.047 11.937 ( -0.197 5.632 7.565) 9.433 12.360 ( -5.365 -0.198 0.629) 5.406 12.552 ( 6.932 3.720 -0.488) 7.882 13.533 ( -1.953 -9.508 -14.780) 17.682 17.644 ( 8.756 -3.014 -8.171) 12.350 18.034 ( -7.123 -7.677 -1.513) 10.581 18.672 ( -11.746 4.206 -6.149) 13.909 19.090 ( -1.893 0.308 1.425) 2.389 20.176 ( 13.347 0.554 13.982) 19.338 21.587 ( -4.458 -10.826 -5.974) 13.144 23.051 ( -6.165 10.356 -4.913) 13.015 23.324 ( 5.261 1.223 -4.631) 7.114 ======================= Grid point 346 (169/361) ======================= q-point: ( 0.30 -0.70 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.426 ( -4.439 -0.000 -6.962) 8.256 2.633 ( -8.724 -0.000 2.664) 9.122 3.030 ( -10.212 -0.000 -1.920) 10.391 3.098 ( -4.486 -0.000 8.071) 9.234 3.590 ( -4.496 -0.000 4.774) 6.557 3.742 ( -2.013 -0.000 -12.927) 13.083 4.426 ( -1.209 -0.000 4.736) 4.888 4.500 ( -19.133 -0.000 -1.481) 19.190 4.540 ( 6.059 0.000 7.932) 9.982 4.792 ( 0.862 0.000 8.723) 8.765 5.287 ( -10.353 -0.000 0.172) 10.354 5.461 ( 1.081 0.000 -0.807) 1.349 6.393 ( -0.454 -0.000 -9.253) 9.264 6.545 ( -1.755 -0.000 -0.538) 1.835 6.888 ( -31.512 -0.000 10.907) 33.346 7.382 ( -5.531 -0.000 2.407) 6.032 7.727 ( -7.013 -0.000 14.372) 15.992 8.797 ( -0.490 -0.000 -9.022) 9.036 8.847 ( -6.611 -0.000 5.781) 8.782 8.883 ( 5.976 0.000 7.580) 9.652 10.307 ( 8.206 0.000 9.836) 12.810 11.122 ( 14.525 0.000 -9.897) 17.576 11.415 ( -7.163 -0.000 5.183) 8.842 11.662 ( 6.013 0.000 -7.202) 9.382 11.798 ( -12.275 -0.000 6.818) 14.042 12.095 ( -7.967 -0.000 -1.971) 8.207 12.399 ( 18.117 0.000 10.889) 21.138 13.310 ( 13.408 0.000 -18.132) 22.551 16.780 ( -6.164 -0.000 -7.625) 9.805 18.055 ( 6.156 0.000 -3.684) 7.174 18.431 ( 6.671 0.000 6.780) 9.512 18.699 ( 10.755 0.000 7.774) 13.270 20.293 ( -6.499 -0.000 -22.915) 23.819 21.773 ( -11.420 -0.000 8.836) 14.439 23.316 ( 5.627 0.000 7.853) 9.661 23.648 ( 6.050 0.000 -0.684) 6.089 ======================= Grid point 348 (170/361) ======================= q-point: (-0.60 0.30 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.252 ( -6.683 10.494 -0.690) 12.461 2.515 ( -8.722 8.604 2.374) 12.480 2.910 ( -9.968 -6.265 2.156) 11.969 3.183 ( -5.431 -10.535 7.740) 14.156 3.550 ( -7.391 -0.938 1.563) 7.612 3.602 ( -0.201 0.438 -5.849) 5.869 4.214 ( -7.699 14.357 4.530) 16.909 4.505 ( -2.194 -7.349 -1.672) 7.850 4.693 ( -0.484 -5.773 7.109) 9.171 4.891 ( -7.472 -5.708 10.849) 14.356 5.216 ( -3.563 -0.923 6.082) 7.109 5.519 ( 6.517 0.389 1.159) 6.631 6.221 ( -13.467 5.958 -4.706) 15.459 6.356 ( -19.179 -8.938 -6.397) 22.105 6.709 ( -6.652 -1.316 3.823) 7.784 7.306 ( -5.102 4.428 1.070) 6.840 7.825 ( -6.795 -3.479 14.807) 16.659 8.676 ( -1.879 3.795 -6.172) 7.485 8.826 ( -7.479 -5.173 3.021) 9.582 9.078 ( 7.269 0.288 9.574) 12.024 10.499 ( 5.962 2.035 7.347) 9.679 11.062 ( 4.640 20.214 -5.661) 21.498 11.332 ( -8.690 -4.078 -2.096) 9.825 11.674 ( -1.067 1.134 1.259) 2.003 11.725 ( -2.151 0.448 0.148) 2.202 12.039 ( -3.784 -7.925 0.342) 8.789 12.740 ( 13.464 0.167 6.828) 15.097 13.303 ( 15.124 -6.273 -20.984) 26.616 16.698 ( -0.339 -0.885 1.732) 1.975 18.044 ( 4.722 -1.448 -11.205) 12.245 18.632 ( 8.898 1.960 8.289) 12.317 19.007 ( 19.157 0.452 7.943) 20.744 19.921 ( -8.566 3.016 -18.786) 20.866 21.667 ( -18.118 -4.763 5.124) 19.422 23.434 ( 1.563 3.954 5.666) 7.084 23.732 ( 4.928 -3.715 -0.611) 6.201 ======================= Grid point 349 (171/361) ======================= q-point: (-0.50 0.30 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.066 ( -7.563 15.393 5.763) 18.094 2.297 ( -9.440 21.751 6.017) 24.463 2.910 ( -7.537 -12.380 2.694) 14.742 3.238 ( -13.019 -16.193 2.532) 20.931 3.489 ( -0.955 1.121 2.304) 2.735 3.612 ( 3.751 -3.030 -0.554) 4.854 4.149 ( 1.514 13.872 9.874) 17.095 4.463 ( -5.359 -6.061 -3.769) 8.925 4.771 ( -9.012 -6.921 10.284) 15.325 5.010 ( -6.661 -12.480 12.131) 18.636 5.313 ( -0.261 -0.337 10.066) 10.075 5.628 ( 6.421 1.425 1.134) 6.674 5.852 ( -24.683 -2.617 1.143) 24.848 6.205 ( -3.840 -6.946 -7.983) 11.257 6.698 ( -1.562 -2.668 -1.097) 3.280 7.203 ( -4.555 6.519 1.245) 8.049 7.932 ( -6.041 -5.037 12.350) 14.642 8.526 ( -4.468 6.051 -4.379) 8.703 8.801 ( -8.529 -8.095 1.491) 11.853 9.280 ( 5.905 1.304 9.620) 11.363 10.581 ( 5.970 11.116 -1.241) 12.679 10.827 ( -5.173 19.188 1.131) 19.905 11.235 ( -3.330 -3.413 -5.657) 7.399 11.606 ( -10.583 4.555 8.706) 14.441 11.783 ( 10.528 0.855 -2.450) 10.843 12.093 ( -0.399 -8.473 0.191) 8.484 12.873 ( 5.074 4.225 -2.578) 7.088 13.352 ( 12.575 -13.732 -19.263) 26.791 16.843 ( 6.819 -4.081 11.472) 13.955 17.967 ( 3.260 -4.367 -15.271) 16.214 18.789 ( 8.773 6.408 2.845) 11.230 19.276 ( 5.349 -0.603 -3.050) 6.187 19.689 ( 8.452 5.931 -1.908) 10.500 21.502 ( -21.409 -8.118 4.723) 23.378 23.431 ( -0.663 5.944 1.360) 6.133 23.803 ( 0.596 -5.383 -2.510) 5.969 ======================= Grid point 350 (172/361) ======================= q-point: (-0.40 0.30 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.922 ( -6.314 16.112 10.288) 20.132 2.072 ( -5.386 23.227 9.687) 25.736 2.923 ( -8.248 -10.681 -0.719) 13.514 3.262 ( -6.562 -13.670 4.999) 15.966 3.539 ( 0.817 -2.274 3.155) 3.974 3.720 ( 6.771 -7.186 -1.239) 9.951 4.148 ( -3.636 13.424 11.807) 18.244 4.457 ( -0.213 -9.259 -1.301) 9.353 4.866 ( -9.008 -7.689 16.624) 20.411 5.123 ( -9.797 -8.278 8.403) 15.334 5.371 ( -8.272 0.020 10.736) 13.554 5.647 ( -1.984 -3.404 5.961) 7.146 5.809 ( 2.416 -4.335 2.859) 5.727 6.165 ( -0.689 -9.250 -5.434) 10.750 6.667 ( -2.103 -2.348 -3.743) 4.893 7.097 ( -4.853 7.321 1.749) 8.956 8.038 ( -4.111 -7.310 8.840) 12.185 8.368 ( -4.978 7.710 0.148) 9.179 8.769 ( -8.738 -8.703 1.084) 12.380 9.418 ( 2.932 3.769 6.653) 8.189 10.339 ( 0.767 25.756 -13.150) 28.929 10.752 ( -4.186 6.230 10.063) 12.554 11.166 ( 0.928 -2.399 -7.855) 8.265 11.508 ( -9.269 6.652 5.220) 12.546 11.893 ( 9.280 1.245 -2.521) 9.696 12.191 ( 3.822 -3.190 5.047) 7.089 12.790 ( -1.096 6.032 -6.134) 8.673 13.401 ( 6.617 -16.267 -18.556) 25.548 17.186 ( 11.124 -7.118 14.448) 19.574 17.874 ( 0.909 -8.422 -14.013) 16.374 18.812 ( 7.798 7.583 -7.600) 13.269 19.149 ( -9.828 -4.871 -4.615) 11.900 19.950 ( 24.157 13.223 9.054) 28.989 21.356 ( -19.778 -11.130 5.691) 23.398 23.367 ( -1.257 4.421 -1.479) 4.828 23.753 ( -4.700 -1.785 -7.105) 8.704 ======================= Grid point 351 (173/361) ======================= q-point: (-0.30 0.30 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.879 ( -0.733 12.949 12.992) 18.358 2.025 ( 3.058 13.338 14.283) 19.780 2.877 ( -4.312 -8.149 -4.601) 10.304 3.363 ( -4.141 -12.220 2.097) 13.072 3.600 ( -1.582 -3.407 3.701) 5.274 3.873 ( 7.863 -10.909 -5.680) 14.598 4.129 ( -5.895 10.402 15.475) 19.556 4.537 ( 3.213 -5.240 -2.053) 6.480 5.037 ( -2.876 -5.067 16.602) 17.595 5.135 ( -9.343 -2.843 13.108) 16.346 5.402 ( -5.665 1.749 11.054) 12.543 5.789 ( -1.409 -9.521 9.449) 13.487 5.918 ( 1.115 -4.514 5.223) 6.993 6.222 ( 1.302 -12.339 -2.271) 12.614 6.598 ( -2.495 -2.230 -5.862) 6.750 6.970 ( -7.185 8.129 2.233) 11.076 8.152 ( -2.933 -10.103 5.427) 11.837 8.283 ( -3.361 7.915 7.182) 11.204 8.748 ( -6.597 -8.322 0.965) 10.663 9.434 ( 0.667 9.352 1.315) 9.467 9.981 ( 0.288 20.646 -11.514) 23.641 10.725 ( -8.118 7.990 8.161) 14.012 11.116 ( 5.623 -0.337 -11.348) 12.669 11.359 ( -4.172 8.795 -0.786) 9.766 11.950 ( 4.029 0.097 -1.382) 4.261 12.358 ( 6.002 2.821 8.624) 10.879 12.645 ( -3.198 4.541 -3.509) 6.570 13.383 ( 1.827 -15.699 -17.937) 23.907 17.498 ( 10.100 -3.622 1.281) 10.806 17.855 ( -2.214 -11.400 -0.830) 11.643 18.739 ( 0.897 -4.020 -10.937) 11.687 19.066 ( -1.405 -1.439 -1.331) 2.411 20.200 ( 14.018 18.636 10.502) 25.576 21.318 ( -8.293 -12.882 4.044) 15.845 23.292 ( -1.605 1.931 -3.415) 4.239 23.556 ( -6.549 4.048 -9.591) 12.299 ======================= Grid point 352 (174/361) ======================= q-point: (-0.20 0.30 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.969 ( -0.178 5.070 16.791) 17.540 2.257 ( 15.571 4.024 14.117) 21.399 2.866 ( 2.725 -6.228 -5.729) 8.890 3.372 ( -6.234 -11.892 -5.807) 14.629 3.635 ( -7.030 -5.186 5.520) 10.334 3.948 ( 4.750 -7.921 -11.118) 14.454 4.170 ( -0.893 7.741 12.320) 14.577 4.552 ( 2.463 2.931 -4.136) 5.636 5.153 ( -2.031 -1.141 6.582) 6.982 5.304 ( -5.562 1.802 19.653) 20.504 5.459 ( -0.038 4.365 17.119) 17.666 5.949 ( -4.041 -11.031 7.920) 14.168 6.065 ( -0.835 -9.540 9.128) 13.230 6.336 ( 0.435 -10.846 -0.589) 10.871 6.524 ( -3.111 -6.205 -2.876) 7.514 6.834 ( -8.006 6.566 5.290) 11.627 8.222 ( -8.381 -4.924 7.072) 12.021 8.313 ( 1.715 1.946 6.825) 7.301 8.751 ( -4.469 -7.304 0.300) 8.568 9.329 ( 2.791 14.266 -2.457) 14.743 9.766 ( 3.165 9.651 -6.170) 11.884 10.548 ( -14.579 10.198 2.043) 17.908 11.029 ( 6.732 9.009 -10.008) 15.055 11.310 ( 7.672 1.537 -3.894) 8.740 11.986 ( 0.761 -0.609 1.660) 1.925 12.391 ( -6.415 3.875 2.356) 7.856 12.626 ( 6.730 4.624 1.915) 8.387 13.328 ( -0.679 -13.439 -13.525) 19.078 17.581 ( 6.479 -3.735 -7.492) 10.585 17.937 ( -2.072 -3.980 4.307) 6.220 18.632 ( -9.256 -7.734 -7.845) 14.389 19.089 ( 3.146 -0.665 -1.033) 3.378 20.277 ( 0.769 11.045 11.386) 15.881 21.433 ( 7.816 -6.820 -0.885) 10.411 23.178 ( -5.119 3.784 -5.660) 8.518 23.364 ( 0.493 3.373 -6.572) 7.404 ======================= Grid point 353 (175/361) ======================= q-point: (-0.10 0.30 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.161 ( -1.085 -5.355 15.938) 16.848 2.640 ( 19.702 2.251 11.845) 23.098 2.922 ( 6.846 -3.924 -4.387) 9.029 3.302 ( -4.904 -10.958 -8.401) 14.653 3.615 ( -10.951 -5.309 3.978) 12.804 3.898 ( 3.063 -4.228 -14.311) 15.234 4.228 ( 2.375 5.743 5.407) 8.238 4.474 ( 1.785 8.340 -4.559) 9.671 5.161 ( -8.848 6.955 10.670) 15.508 5.329 ( -9.427 1.219 11.173) 14.670 5.663 ( 4.196 3.900 9.372) 10.984 5.992 ( -6.475 0.109 0.107) 6.476 6.261 ( 0.275 -14.757 6.141) 15.986 6.370 ( 0.766 -4.429 -0.726) 4.553 6.640 ( -7.102 -6.040 19.819) 21.903 6.821 ( -3.228 -9.118 8.180) 12.668 8.180 ( -11.571 4.405 8.668) 15.114 8.405 ( 1.818 -3.246 3.088) 4.835 8.748 ( -4.110 -5.242 0.166) 6.663 9.281 ( 7.725 10.434 1.566) 13.077 9.752 ( 8.031 0.182 -3.217) 8.653 10.232 ( -14.882 8.953 -3.499) 17.716 10.974 ( 11.901 12.107 -4.505) 17.564 11.396 ( 11.863 -1.793 -6.204) 13.507 12.016 ( -2.002 -0.598 3.768) 4.308 12.271 ( -8.782 1.775 1.005) 9.016 12.665 ( 4.209 5.167 -2.967) 7.295 13.310 ( 0.745 -8.352 -5.729) 10.156 17.617 ( 4.308 -4.360 -5.003) 7.912 17.929 ( -1.167 0.623 -5.166) 5.332 18.451 ( -10.720 -1.294 -3.927) 11.490 19.049 ( -10.483 4.488 3.770) 12.011 20.384 ( 2.326 -8.436 6.638) 10.983 21.574 ( 14.363 5.205 -3.793) 15.741 23.012 ( -2.507 5.893 -3.530) 7.312 23.340 ( 4.748 -1.389 -4.461) 6.661 ======================= Grid point 358 (176/361) ======================= q-point: ( 0.40 -0.60 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.241 ( -4.755 -0.000 3.418) 5.856 2.534 ( -1.432 -0.000 5.627) 5.806 2.785 ( -10.046 -0.000 4.717) 11.098 3.020 ( -17.398 -0.000 1.406) 17.455 3.505 ( -0.651 -0.000 1.700) 1.820 3.573 ( 4.640 0.000 -4.298) 6.325 4.324 ( -1.993 -0.000 13.242) 13.391 4.399 ( -4.717 -0.000 -4.289) 6.375 4.727 ( -2.999 -0.000 7.634) 8.201 4.848 ( -13.823 -0.000 16.904) 21.836 5.313 ( 0.931 0.000 9.836) 9.880 5.644 ( 8.423 0.000 1.186) 8.506 5.828 ( -29.438 -0.000 -0.261) 29.439 6.140 ( -1.703 -0.000 -8.845) 9.007 6.673 ( -1.890 -0.000 -0.321) 1.917 7.266 ( -3.188 -0.000 -0.740) 3.273 7.882 ( -8.358 -0.000 14.771) 16.972 8.583 ( -1.946 -0.000 -7.491) 7.739 8.728 ( -9.544 -0.000 4.235) 10.441 9.291 ( 5.794 0.000 10.321) 11.836 10.657 ( 4.708 0.000 5.097) 6.939 11.104 ( -13.588 -0.000 -3.260) 13.974 11.146 ( 4.200 0.000 -8.719) 9.678 11.664 ( -9.970 -0.000 6.408) 11.852 11.762 ( 10.643 0.000 -2.918) 11.035 12.008 ( 0.494 0.000 5.422) 5.444 12.918 ( 3.710 0.000 2.240) 4.334 13.216 ( 14.659 0.000 -23.709) 27.875 16.808 ( 6.494 0.000 10.375) 12.240 17.927 ( 3.467 0.000 -16.702) 17.058 18.847 ( 8.118 0.000 5.454) 9.780 19.269 ( 3.203 0.000 -5.287) 6.181 19.743 ( 11.889 0.000 -2.556) 12.160 21.431 ( -20.966 -0.000 5.096) 21.576 23.495 ( -4.085 -0.000 4.046) 5.749 23.743 ( 3.675 0.000 -4.421) 5.749 ======================= Grid point 360 (177/361) ======================= q-point: (-0.50 0.40 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.186 ( -3.768 11.353 6.111) 13.432 2.486 ( -4.273 23.104 6.297) 24.325 2.740 ( -7.727 -8.097 2.256) 11.417 2.929 ( -8.144 -21.843 2.095) 23.406 3.528 ( -0.403 0.224 2.567) 2.608 3.616 ( 7.583 -3.725 -6.732) 10.802 4.286 ( -12.744 -1.799 6.855) 14.582 4.450 ( 4.177 9.292 11.385) 15.278 4.781 ( -5.206 -1.389 13.711) 14.732 4.950 ( -8.174 -9.644 14.154) 18.977 5.373 ( -10.865 0.021 11.516) 15.832 5.607 ( -5.234 -1.112 5.001) 7.323 5.767 ( 6.587 -0.873 0.964) 6.715 6.042 ( -0.621 -4.006 -7.551) 8.570 6.634 ( -1.956 -1.134 -3.062) 3.806 7.207 ( -1.669 3.976 -0.916) 4.409 7.933 ( -9.030 -3.709 11.890) 15.385 8.467 ( -2.283 3.073 -4.128) 5.630 8.664 ( -8.700 -3.132 3.997) 10.074 9.461 ( 2.634 1.218 9.426) 9.862 10.684 ( 4.456 10.558 -14.337) 18.354 10.846 ( -12.285 5.227 7.727) 15.426 11.115 ( 3.291 -2.886 -8.689) 9.729 11.595 ( -10.359 2.782 8.209) 13.507 11.866 ( 7.539 -2.753 -4.774) 9.339 12.168 ( 7.851 0.046 10.897) 13.431 12.883 ( -4.255 4.265 -2.957) 6.711 13.166 ( 10.167 -9.033 -21.694) 25.605 17.102 ( 11.380 -2.432 15.602) 19.464 17.771 ( 1.954 -3.041 -17.568) 17.936 18.938 ( 2.571 6.511 -5.056) 8.635 19.058 ( -8.987 -5.441 -8.194) 13.323 20.118 ( 29.608 5.257 8.551) 31.264 21.225 ( -20.295 -3.823 6.040) 21.517 23.431 ( -6.062 2.355 0.263) 6.509 23.714 ( 0.043 -1.755 -7.323) 7.530 ======================= Grid point 361 (178/361) ======================= q-point: (-0.40 0.40 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.127 ( 2.087 13.086 6.912) 14.946 2.298 ( -5.198 18.081 7.778) 20.358 2.734 ( -3.354 -7.780 -1.511) 8.606 3.098 ( -1.580 -17.443 2.113) 17.641 3.539 ( -5.039 -3.039 3.316) 6.755 3.688 ( 9.849 -8.279 -9.933) 16.254 4.271 ( -9.736 2.584 16.797) 19.586 4.532 ( 7.175 5.795 1.936) 9.424 4.947 ( -2.968 -4.381 17.527) 18.308 5.072 ( -6.387 -4.268 16.891) 18.555 5.412 ( -5.967 -0.718 15.038) 16.194 5.670 ( -2.078 -3.550 6.699) 7.861 5.864 ( 2.910 -1.772 2.683) 4.337 6.032 ( 2.265 -8.527 -5.240) 10.261 6.561 ( -3.320 -1.720 -5.486) 6.639 7.120 ( -2.604 7.890 -0.294) 8.314 7.984 ( -8.442 -8.280 8.802) 14.741 8.390 ( -1.611 4.341 1.587) 4.895 8.637 ( -6.192 -4.314 3.528) 8.331 9.553 ( 0.097 4.373 6.994) 8.249 10.319 ( -2.300 16.068 -20.586) 26.216 10.821 ( -8.146 3.470 9.023) 12.642 11.098 ( 7.554 -1.381 -9.761) 12.419 11.509 ( -7.710 7.171 5.586) 11.919 11.908 ( 3.775 -3.821 -5.343) 7.576 12.428 ( 10.027 4.147 12.726) 16.724 12.715 ( -7.649 3.575 -3.288) 9.061 13.125 ( 4.060 -12.733 -18.675) 22.964 17.456 ( 11.265 -1.013 8.525) 14.163 17.675 ( 1.600 -8.529 -6.156) 10.639 18.691 ( -9.489 -1.446 -12.511) 15.769 19.043 ( 3.051 -1.047 -2.642) 4.169 20.511 ( 20.156 15.846 9.304) 27.275 21.120 ( -8.893 -10.041 4.678) 14.206 23.319 ( -5.687 1.119 -2.390) 6.270 23.595 ( -3.011 0.907 -9.690) 10.188 ======================= Grid point 362 (179/361) ======================= q-point: (-0.30 0.40 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.132 ( -1.377 12.944 8.667) 15.639 2.323 ( 9.894 3.141 10.937) 15.079 2.770 ( 4.076 -4.650 -2.151) 6.547 3.176 ( -2.858 -10.212 -3.648) 11.214 3.516 ( -10.932 -7.338 3.867) 13.723 3.784 ( 9.958 -9.160 -11.871) 18.000 4.316 ( -2.354 7.181 11.086) 13.417 4.606 ( 8.193 2.348 -2.454) 8.868 5.110 ( -4.031 -2.586 14.057) 14.850 5.313 ( -4.077 -1.373 26.142) 26.494 5.534 ( 1.190 3.666 15.845) 16.307 5.742 ( -5.541 -8.946 6.207) 12.217 5.958 ( -1.486 -4.604 7.418) 8.855 6.127 ( 4.772 -11.219 -2.452) 12.436 6.448 ( -4.907 -2.860 -6.734) 8.809 6.995 ( -4.666 10.282 1.704) 11.419 8.048 ( -8.781 -11.283 7.454) 16.123 8.384 ( -0.730 3.514 5.402) 6.485 8.647 ( -3.529 -4.462 2.638) 6.271 9.548 ( 0.404 9.821 2.398) 10.118 9.949 ( -0.894 10.354 -16.729) 19.694 10.703 ( -13.089 7.862 3.752) 15.723 11.125 ( 11.363 1.574 -8.424) 14.232 11.408 ( -0.255 9.032 0.657) 9.059 11.929 ( 0.763 -5.103 -2.933) 5.936 12.472 ( -9.471 4.540 1.196) 10.571 12.709 ( 7.483 4.515 5.925) 10.559 13.086 ( 1.606 -13.427 -12.056) 18.117 17.525 ( 4.430 -2.422 -6.656) 8.355 17.874 ( 4.504 -3.629 10.240) 11.761 18.474 ( -9.204 -8.362 -9.678) 15.758 19.070 ( 4.922 -1.281 -3.562) 6.209 20.520 ( -7.927 14.989 6.417) 18.130 21.333 ( 18.480 -5.120 3.392) 19.473 23.204 ( -5.133 0.081 -3.962) 6.485 23.423 ( -2.042 2.719 -9.160) 9.770 ======================= Grid point 363 (180/361) ======================= q-point: (-0.20 0.40 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.125 ( -6.344 1.381 10.776) 12.581 2.658 ( 18.515 -0.360 10.434) 21.256 2.868 ( 7.796 -2.238 -1.180) 8.196 3.151 ( -0.661 -5.258 -6.128) 8.102 3.469 ( -13.122 -10.241 4.298) 17.192 3.814 ( 7.896 -5.274 -15.252) 17.966 4.333 ( 1.489 5.963 2.856) 6.778 4.621 ( 5.899 7.146 -5.000) 10.529 5.229 ( -5.616 -0.054 15.000) 16.017 5.392 ( -12.252 6.405 14.057) 19.716 5.700 ( -1.924 -1.533 4.623) 5.237 5.930 ( 1.038 -7.392 13.093) 15.071 6.051 ( -3.400 -5.618 7.710) 10.127 6.258 ( 4.798 -8.029 0.580) 9.372 6.432 ( -1.740 -11.779 7.266) 13.949 6.874 ( -5.267 9.031 5.266) 11.706 8.104 ( -10.415 -10.441 8.216) 16.881 8.413 ( -0.738 2.442 4.651) 5.305 8.668 ( -2.349 -3.634 1.592) 4.611 9.475 ( 4.472 10.952 -2.615) 12.115 9.764 ( 2.194 1.047 -8.103) 8.460 10.429 ( -15.131 12.811 -0.296) 19.828 11.168 ( 11.236 8.479 -2.883) 14.369 11.395 ( 8.868 2.565 -4.694) 10.357 11.947 ( -2.773 -6.116 -0.123) 6.717 12.316 ( -9.262 2.422 0.934) 9.619 12.738 ( -0.114 1.791 -4.615) 4.952 13.171 ( 6.637 -6.066 0.915) 9.038 17.554 ( 3.561 -2.766 -1.935) 4.907 17.951 ( -1.352 1.592 -3.470) 4.050 18.369 ( -5.903 -7.070 -1.919) 9.408 19.096 ( -0.831 0.353 -0.189) 0.923 20.333 ( -9.796 2.517 0.340) 10.120 21.669 ( 22.686 5.292 3.165) 23.509 23.083 ( -3.362 2.029 -4.364) 5.871 23.319 ( 1.436 -0.793 -5.878) 6.102 ======================= Grid point 364 (181/361) ======================= q-point: (-0.10 -0.60 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.173 ( -9.305 -8.628 9.635) 15.933 2.935 ( -1.584 -4.106 -0.322) 4.413 2.986 ( 8.684 -2.554 4.143) 9.955 3.183 ( 13.136 0.083 -2.342) 13.344 3.455 ( -7.287 -5.989 5.361) 10.849 3.757 ( 6.652 -3.352 -16.241) 17.867 4.332 ( 2.441 2.798 -0.088) 3.714 4.544 ( 3.710 10.291 -5.433) 12.214 5.250 ( -14.910 12.996 10.976) 22.620 5.278 ( -11.386 -0.920 9.065) 14.583 5.663 ( -7.735 -3.713 -1.762) 8.760 5.877 ( -6.250 1.235 -4.165) 7.611 6.248 ( 1.997 -9.494 5.601) 11.202 6.468 ( 5.693 3.047 8.569) 10.729 6.673 ( -0.608 -16.556 10.506) 19.617 6.902 ( -1.586 0.438 19.801) 19.869 8.118 ( -11.861 -3.341 8.686) 15.076 8.419 ( -2.401 -0.851 2.381) 3.487 8.691 ( -0.822 -2.790 1.916) 3.483 9.453 ( 4.374 4.957 -1.558) 6.792 9.788 ( 8.072 -7.511 -5.013) 12.111 10.113 ( -10.669 14.239 0.672) 17.805 11.251 ( 13.520 10.563 3.171) 17.448 11.464 ( 11.773 -1.414 -8.287) 14.466 11.952 ( -7.054 -6.692 2.720) 10.097 12.201 ( -5.298 2.906 0.159) 6.045 12.624 ( -5.208 -0.158 -5.724) 7.740 13.333 ( 9.586 0.822 1.909) 9.809 17.584 ( -1.082 -0.598 -4.535) 4.701 17.800 ( -2.497 -1.187 -9.180) 9.587 18.361 ( -0.342 1.592 2.379) 2.883 18.982 ( -14.184 7.793 4.708) 16.855 20.280 ( -0.062 -14.380 -6.882) 15.942 21.911 ( 17.914 14.140 4.601) 23.281 23.002 ( 1.066 2.360 -2.604) 3.673 23.330 ( 3.838 -4.156 -2.867) 6.342 ======================= Grid point 370 (182/361) ======================= q-point: (-0.50 0.50 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.259 ( -1.715 -0.000 5.111) 5.392 2.574 ( -9.524 0.000 0.902) 9.567 2.627 ( -2.545 -0.000 -0.805) 2.670 2.854 ( 6.147 -0.000 7.648) 9.812 3.510 ( -6.704 -0.000 2.640) 7.205 3.613 ( 9.651 -0.000 -10.214) 14.052 4.276 ( -6.214 -0.000 15.176) 16.399 4.619 ( 2.486 0.000 0.375) 2.514 4.907 ( -3.236 -0.000 20.061) 20.320 5.017 ( -3.509 -0.000 18.456) 18.787 5.399 ( -6.898 -0.000 17.313) 18.637 5.647 ( -1.578 -0.000 6.206) 6.403 5.850 ( 3.355 -0.000 1.452) 3.656 5.952 ( 2.747 -0.000 -6.443) 7.004 6.545 ( -3.548 -0.000 -5.108) 6.219 7.199 ( 0.480 -0.000 -2.500) 2.545 7.902 ( -12.138 -0.000 11.332) 16.606 8.430 ( 0.472 -0.000 -2.158) 2.209 8.598 ( -7.435 -0.000 5.964) 9.531 9.591 ( -0.192 -0.000 8.864) 8.866 10.473 ( -4.218 -0.000 -24.926) 25.280 10.852 ( -6.512 -0.000 8.738) 10.898 11.082 ( 7.762 -0.000 -8.647) 11.620 11.578 ( -9.582 -0.000 10.484) 14.203 11.864 ( 4.394 -0.000 -7.136) 8.380 12.470 ( 11.993 0.000 14.237) 18.615 12.757 ( -13.066 -0.000 -0.860) 13.095 12.994 ( 8.097 -0.000 -21.881) 23.331 17.454 ( 12.767 -0.000 16.649) 20.981 17.590 ( 1.734 0.000 -14.161) 14.267 18.680 ( -13.483 -0.000 -12.610) 18.460 19.033 ( 4.939 -0.000 -3.418) 6.007 20.684 ( 32.565 -0.000 8.976) 33.780 21.003 ( -19.172 0.000 4.842) 19.774 23.329 ( -7.670 -0.000 -1.957) 7.916 23.601 ( -1.267 -0.000 -9.770) 9.852 ======================= Grid point 372 (183/361) ======================= q-point: (-0.40 0.50 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.350 ( 7.683 3.635 6.970) 10.992 2.379 ( -9.731 8.875 3.408) 13.604 2.690 ( 6.836 -4.739 -1.294) 8.418 3.034 ( 5.574 -4.965 1.926) 7.709 3.413 ( -13.445 -3.493 2.349) 14.088 3.663 ( 11.606 -3.964 -9.963) 15.802 4.403 ( 1.004 2.704 10.638) 11.022 4.616 ( 4.842 -0.708 -5.639) 7.466 5.096 ( -4.548 0.865 19.372) 19.917 5.261 ( -3.357 -3.229 27.246) 27.641 5.571 ( 1.651 0.617 17.290) 17.380 5.674 ( -5.303 -0.184 6.711) 8.555 5.893 ( -1.317 -2.534 3.475) 4.498 5.985 ( 6.748 -4.253 -3.351) 8.652 6.416 ( -5.480 -0.897 -6.883) 8.844 7.149 ( 0.000 5.777 -2.600) 6.335 7.881 ( -14.075 -6.205 11.871) 19.430 8.429 ( 0.963 1.553 1.232) 2.204 8.592 ( -4.453 -1.796 5.241) 7.108 9.661 ( -1.123 3.142 7.010) 7.764 10.089 ( -3.935 4.531 -25.197) 25.901 10.817 ( -8.225 4.259 4.503) 10.299 11.121 ( 11.412 -0.968 -7.842) 13.880 11.557 ( -6.543 6.082 8.812) 12.548 11.838 ( 3.414 -4.192 -8.758) 10.292 12.538 ( -14.653 2.621 0.555) 14.895 12.768 ( 6.797 1.762 5.993) 9.232 12.898 ( 6.681 -6.645 -9.434) 13.334 17.499 ( 2.883 -0.646 -6.476) 7.119 17.816 ( 10.211 -2.243 14.093) 17.547 18.376 ( -11.156 -2.657 -11.534) 16.265 19.052 ( 5.091 -0.599 -4.932) 7.114 20.738 ( -16.106 8.010 1.103) 18.022 21.252 ( 29.173 -3.426 8.139) 30.480 23.200 ( -6.483 -0.271 -3.164) 7.219 23.453 ( -2.162 0.832 -10.231) 10.490 ======================= Grid point 373 (184/361) ======================= q-point: (-0.30 0.50 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.191 ( -12.717 5.107 5.433) 14.742 2.627 ( 12.272 -2.766 9.959) 16.045 2.842 ( 13.720 -0.697 -1.015) 13.775 3.127 ( 4.446 1.678 -1.669) 5.037 3.294 ( -11.745 -8.794 2.326) 14.856 3.725 ( 9.608 -4.347 -12.449) 16.315 4.439 ( 2.231 6.415 -0.086) 6.792 4.670 ( 7.973 -2.427 -5.509) 9.990 5.209 ( -8.201 -0.580 15.537) 17.578 5.487 ( -9.811 0.497 21.409) 23.555 5.620 ( -10.310 -0.964 4.673) 11.361 5.886 ( 8.867 1.142 16.681) 18.926 5.972 ( -3.095 -5.023 8.681) 10.497 6.111 ( 8.706 -7.443 -1.003) 11.498 6.299 ( -3.507 -3.784 1.112) 5.278 7.048 ( -1.905 9.497 -0.075) 9.687 7.903 ( -14.629 -10.920 12.682) 22.228 8.451 ( 0.199 1.809 3.178) 3.662 8.617 ( -2.111 -2.309 3.258) 4.517 9.643 ( 0.821 7.932 -5.752) 9.833 9.776 ( -2.023 -0.056 -11.575) 11.750 10.649 ( -10.932 11.233 1.740) 15.771 11.226 ( 13.630 -0.790 -5.458) 14.703 11.506 ( 0.251 8.554 2.102) 8.812 11.831 ( -0.460 -6.654 -4.536) 8.066 12.347 ( -11.889 1.210 1.877) 12.097 12.701 ( -3.402 -4.869 -10.880) 12.396 13.128 ( 11.305 0.427 9.969) 15.079 17.520 ( 3.460 -1.145 0.556) 3.687 17.976 ( -3.922 1.026 -4.267) 5.886 18.246 ( 1.260 -5.820 2.201) 6.348 19.077 ( 3.999 -1.605 -3.461) 5.527 20.422 ( -16.299 5.679 -5.512) 18.119 21.748 ( 28.097 3.400 8.249) 29.480 23.090 ( -4.457 -0.605 -3.113) 5.470 23.313 ( -0.948 -0.022 -8.331) 8.385 ======================= Grid point 374 (185/361) ======================= q-point: (-0.20 -0.50 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.070 ( -15.684 -3.241 8.803) 18.275 2.819 ( -4.043 -6.245 0.652) 7.468 2.982 ( -0.150 -0.465 4.186) 4.214 3.204 ( 18.266 0.799 0.487) 18.290 3.366 ( 6.841 -2.023 4.266) 8.312 3.695 ( 5.201 -3.659 -15.803) 17.034 4.396 ( 1.867 4.958 -2.536) 5.874 4.686 ( 5.827 4.528 -6.851) 10.069 5.227 ( -13.160 -3.908 7.640) 15.711 5.475 ( -13.760 7.488 5.755) 16.689 5.553 ( -9.178 -3.505 11.215) 14.909 5.897 ( -6.517 1.709 -2.386) 7.148 6.123 ( 1.882 -5.290 7.065) 9.024 6.355 ( 7.337 -13.388 3.372) 15.634 6.550 ( 8.495 0.378 20.443) 22.141 6.972 ( -1.778 6.922 8.315) 10.964 7.955 ( -14.612 -12.249 12.949) 23.048 8.458 ( -1.752 3.373 2.818) 4.732 8.648 ( -0.437 -2.350 1.800) 2.992 9.476 ( 1.907 -1.844 -14.301) 14.545 9.738 ( 1.886 1.953 0.300) 2.731 10.394 ( -10.193 15.881 1.756) 18.952 11.372 ( 13.550 0.984 -1.757) 13.699 11.484 ( 6.217 5.673 -2.397) 8.751 11.827 ( -5.236 -7.005 0.284) 8.750 12.236 ( -5.711 1.288 1.055) 5.949 12.568 ( -6.947 -5.712 -7.022) 11.410 13.374 ( 12.070 3.319 7.045) 14.364 17.587 ( 0.427 0.915 -0.110) 1.016 17.764 ( -6.231 -2.748 -10.320) 12.365 18.388 ( 4.988 1.620 5.906) 7.899 19.072 ( -5.134 2.036 1.324) 5.680 20.121 ( -8.198 -3.985 -12.352) 15.352 22.136 ( 22.513 11.214 8.419) 26.522 23.022 ( -0.489 -0.183 -2.934) 2.980 23.256 ( 1.061 -3.864 -3.846) 5.554 ======================= Grid point 375 (186/361) ======================= q-point: (-0.10 -0.50 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.017 ( -16.771 -9.619 10.306) 21.909 2.700 ( -18.590 -11.776 -0.801) 22.021 3.073 ( 6.090 1.365 3.194) 7.011 3.401 ( 7.535 2.842 -0.234) 8.057 3.550 ( 7.206 4.677 0.020) 8.591 3.634 ( 9.675 -6.777 -7.775) 14.142 4.360 ( -0.262 1.871 -0.312) 1.915 4.615 ( 5.215 8.263 -7.033) 12.039 5.072 ( -17.702 0.070 -0.001) 17.702 5.275 ( -12.516 3.636 3.728) 13.556 5.585 ( -6.608 2.930 10.194) 12.497 5.762 ( -7.221 3.085 -1.254) 7.952 6.250 ( 0.512 -5.800 2.697) 6.417 6.618 ( 3.097 -15.049 7.115) 16.932 6.694 ( 4.086 9.233 2.542) 10.412 7.171 ( 2.379 0.107 21.034) 21.168 8.000 ( -13.696 -9.425 10.770) 19.809 8.410 ( -4.524 3.907 3.714) 7.038 8.696 ( 1.634 -2.947 1.101) 3.545 9.417 ( 0.283 -5.819 -6.848) 8.990 9.770 ( 4.883 -3.673 -3.159) 6.878 10.196 ( -3.165 13.463 4.785) 14.634 11.485 ( 10.347 -2.698 -10.653) 15.094 11.566 ( 7.069 6.077 10.180) 13.803 11.823 ( -4.161 -6.032 1.114) 7.412 12.169 ( -2.240 2.115 -1.038) 3.251 12.462 ( -7.180 -3.958 -1.188) 8.285 13.558 ( 13.590 6.848 1.195) 15.265 17.351 ( -9.569 0.501 -17.834) 20.245 17.800 ( 3.660 -1.284 6.584) 7.642 18.472 ( 5.326 6.373 2.522) 8.680 18.898 ( -15.859 8.364 3.813) 18.331 20.022 ( 2.241 -16.940 -15.032) 22.758 22.341 ( 10.986 17.722 8.282) 22.436 23.021 ( 5.431 -0.463 -3.502) 6.479 23.329 ( 4.146 -5.931 2.703) 7.725 ======================= Grid point 382 (187/361) ======================= q-point: (-0.40 -0.40 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.249 ( -17.514 -0.000 3.350) 17.832 2.594 ( 10.018 0.000 9.705) 13.948 2.838 ( 19.317 0.000 -1.562) 19.380 3.176 ( 13.127 0.000 0.736) 13.148 3.185 ( -18.300 -0.000 0.921) 18.323 3.683 ( 9.675 0.000 -10.667) 14.401 4.550 ( 4.640 0.000 3.120) 5.591 4.579 ( 5.055 0.000 -8.135) 9.577 5.213 ( -8.056 -0.000 12.692) 15.033 5.452 ( -9.721 -0.000 17.779) 20.263 5.661 ( -10.191 -0.000 16.185) 19.127 5.906 ( 9.903 0.000 16.515) 19.256 5.908 ( -1.923 -0.000 6.644) 6.917 6.038 ( 7.701 0.000 -2.094) 7.980 6.271 ( -3.231 -0.000 -1.000) 3.382 7.147 ( 1.689 0.000 -4.367) 4.682 7.790 ( -18.890 -0.000 17.055) 25.450 8.469 ( 1.248 0.000 1.873) 2.251 8.594 ( -2.664 -0.000 4.389) 5.134 9.737 ( -0.696 -0.000 5.682) 5.724 9.754 ( -3.136 -0.000 -25.151) 25.346 10.764 ( -8.727 -0.000 2.131) 8.983 11.205 ( 13.397 0.000 -6.119) 14.728 11.611 ( -8.345 -0.000 11.980) 14.600 11.748 ( 6.820 0.000 -13.798) 15.391 12.359 ( -14.175 -0.000 3.385) 14.574 12.643 ( -2.394 -0.000 -13.248) 13.462 13.139 ( 11.552 0.000 12.388) 16.938 17.511 ( 3.429 0.000 1.565) 3.769 17.984 ( -6.029 -0.000 -5.887) 8.426 18.192 ( 5.367 0.000 4.904) 7.270 19.061 ( 4.822 0.000 -4.653) 6.701 20.479 ( -17.769 -0.000 -7.991) 19.483 21.779 ( 30.147 0.000 10.355) 31.876 23.082 ( -5.270 -0.000 -2.484) 5.826 23.314 ( -1.619 -0.000 -9.367) 9.506 ======================= Grid point 383 (188/361) ======================= q-point: (-0.30 -0.40 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.045 ( -20.766 -0.301 8.411) 22.407 2.743 ( -8.394 -2.307 -1.115) 8.776 2.948 ( -3.641 -2.071 7.926) 8.965 3.218 ( 24.356 0.867 1.150) 24.399 3.379 ( 16.218 1.619 -0.094) 16.299 3.641 ( 2.816 -1.921 -13.356) 13.784 4.511 ( 3.529 7.981 -3.972) 9.588 4.664 ( 5.010 -6.552 -4.426) 9.361 5.176 ( -13.186 -1.123 6.405) 14.702 5.405 ( -14.440 -3.807 3.953) 15.448 5.686 ( -9.026 6.554 12.312) 16.613 5.949 ( -5.814 4.309 4.642) 8.598 6.038 ( -0.546 -4.626 7.759) 9.050 6.163 ( 7.936 -7.334 -0.786) 10.834 6.552 ( 14.385 -0.097 24.657) 28.546 7.098 ( 1.573 5.482 -2.580) 6.260 7.766 ( -20.708 -7.239 19.939) 29.645 8.505 ( 0.201 1.598 3.348) 3.716 8.613 ( -1.069 -1.304 2.188) 2.762 9.445 ( -1.413 -0.999 -21.819) 21.887 9.783 ( 1.106 1.795 3.026) 3.688 10.617 ( -10.202 7.904 1.655) 13.011 11.340 ( 13.517 -2.405 -5.598) 14.827 11.602 ( -2.747 5.845 6.483) 9.151 11.722 ( 2.039 -4.745 -5.962) 7.888 12.254 ( -7.144 0.868 4.285) 8.376 12.467 ( -6.307 -4.230 -9.348) 12.044 13.423 ( 11.900 1.681 9.677) 15.430 17.610 ( 2.589 1.277 5.568) 6.272 17.716 ( -9.032 -2.137 -14.240) 16.997 18.413 ( 8.303 0.942 9.452) 12.616 19.073 ( 1.053 -0.744 -1.610) 2.063 20.103 ( -13.953 0.415 -16.512) 21.622 22.283 ( 26.855 4.805 10.922) 29.386 23.005 ( -3.293 -1.094 -1.002) 3.611 23.208 ( -0.520 -1.428 -6.339) 6.519 ======================= Grid point 384 (189/361) ======================= q-point: (-0.20 -0.40 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.901 ( -21.362 -3.676 13.827) 25.711 2.496 ( -24.440 -10.049 -1.460) 26.465 3.113 ( 8.378 2.151 6.152) 10.614 3.464 ( 0.779 2.042 -3.516) 4.140 3.521 ( 11.888 -1.149 -11.380) 16.497 3.626 ( 17.514 1.264 3.383) 17.882 4.435 ( -0.781 6.665 -1.236) 6.824 4.689 ( 4.313 -1.087 -7.672) 8.868 5.039 ( -16.541 -2.168 3.088) 16.966 5.271 ( -12.905 -2.419 3.375) 13.557 5.631 ( -5.002 1.580 3.101) 6.094 5.879 ( -7.148 9.813 9.807) 15.606 6.163 ( -0.150 -4.720 5.186) 7.014 6.366 ( 7.871 -11.979 2.040) 14.478 6.890 ( 6.344 11.259 5.433) 14.019 7.158 ( 6.192 -1.853 14.066) 15.480 7.797 ( -19.973 -11.099 18.952) 29.686 8.509 ( -2.200 5.510 4.470) 7.428 8.643 ( 0.875 -2.741 0.532) 2.926 9.259 ( 1.022 -8.240 -14.963) 17.113 9.805 ( 2.567 3.666 0.095) 4.476 10.420 ( -8.604 10.803 2.875) 14.107 11.435 ( 9.954 -2.910 -11.252) 15.302 11.650 ( -3.355 3.457 14.662) 15.433 11.738 ( 4.996 -3.327 -3.461) 6.929 12.203 ( -3.243 2.072 -1.309) 4.065 12.362 ( -6.055 -6.647 -0.144) 8.993 13.660 ( 13.939 4.354 4.647) 15.324 17.358 ( -9.694 0.295 -18.828) 21.180 17.781 ( 3.211 -0.773 9.823) 10.363 18.582 ( 6.984 5.642 6.027) 10.814 19.009 ( -11.414 3.749 1.863) 12.158 19.789 ( -1.698 -9.111 -20.965) 22.922 22.626 ( 15.489 14.286 8.595) 22.756 22.999 ( 4.133 -2.124 -3.421) 5.770 23.219 ( 1.827 -6.145 3.975) 7.543 ======================= Grid point 385 (190/361) ======================= q-point: (-0.10 -0.40 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.823 ( -21.664 -6.628 14.573) 26.938 2.291 ( -22.827 -16.228 3.321) 28.204 3.142 ( -8.958 -1.999 -5.168) 10.534 3.396 ( 4.020 -0.396 1.970) 4.494 3.601 ( 8.718 6.069 -4.068) 11.375 3.806 ( 4.095 3.499 2.635) 5.996 4.360 ( -4.415 3.153 2.785) 6.098 4.673 ( 8.693 2.283 -7.394) 11.638 4.856 ( -11.816 1.125 1.339) 11.945 5.214 ( -5.244 0.580 6.637) 8.478 5.576 ( -4.828 0.199 -1.447) 5.044 5.791 ( -7.665 12.993 9.201) 17.670 6.224 ( -1.144 -3.511 0.810) 3.780 6.616 ( 4.105 -12.471 6.834) 14.802 6.853 ( 2.314 10.553 0.768) 10.831 7.370 ( 0.988 0.804 5.183) 5.338 7.837 ( -15.418 -11.268 12.154) 22.637 8.475 ( -3.878 7.130 9.180) 12.253 8.699 ( 2.500 -3.975 -0.204) 4.700 9.279 ( 3.600 -13.486 -4.987) 14.822 9.783 ( 1.867 4.084 -2.846) 5.316 10.302 ( -3.074 6.319 4.487) 8.338 11.438 ( 8.088 -4.071 -13.383) 16.159 11.662 ( -15.294 1.264 15.205) 21.603 11.865 ( 10.894 0.675 -6.220) 12.563 12.152 ( -0.495 -2.560 4.300) 5.028 12.391 ( -0.624 -2.676 3.829) 4.713 13.825 ( 15.855 8.694 -2.515) 18.256 17.013 ( -8.883 -0.206 -16.370) 18.626 17.953 ( 3.625 0.033 10.680) 11.279 18.622 ( 0.099 9.466 -1.521) 9.588 18.787 ( -9.367 4.454 1.882) 10.541 19.730 ( 4.192 -16.750 -15.714) 23.346 22.657 ( -0.967 17.569 6.367) 18.712 23.048 ( 8.699 -2.417 -7.103) 11.488 23.463 ( 9.056 -3.698 13.346) 16.547 ======================= Grid point 393 (191/361) ======================= q-point: (-0.30 -0.30 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.874 ( -23.029 -0.000 15.921) 27.997 2.399 ( -27.096 -0.000 -2.690) 27.230 3.133 ( 10.927 0.000 7.596) 13.308 3.444 ( -5.834 -0.000 -15.098) 16.186 3.586 ( 22.969 0.000 0.629) 22.978 3.605 ( 14.043 0.000 0.581) 14.055 4.570 ( -6.561 -0.000 -1.349) 6.698 4.594 ( 7.596 0.000 -5.470) 9.361 5.024 ( -14.945 -0.000 3.400) 15.327 5.245 ( -11.614 -0.000 4.864) 12.592 5.644 ( -6.047 -0.000 -0.841) 6.105 6.041 ( -5.966 -0.000 11.226) 12.713 6.063 ( -4.005 -0.000 10.553) 11.287 6.247 ( 12.369 0.000 -2.424) 12.604 7.027 ( 13.226 0.000 18.740) 22.937 7.114 ( 4.309 0.000 -5.370) 6.885 7.685 ( -24.986 -0.000 26.229) 36.225 8.563 ( -0.674 -0.000 5.625) 5.665 8.616 ( 0.218 0.000 0.578) 0.618 9.183 ( 0.021 0.000 -18.665) 18.665 9.841 ( 2.886 0.000 0.638) 2.956 10.524 ( -11.297 -0.000 2.138) 11.497 11.403 ( 10.258 0.000 -10.692) 14.818 11.682 ( -9.063 -0.000 17.412) 19.629 11.710 ( 10.413 0.000 -6.532) 12.292 12.247 ( -8.365 -0.000 -6.823) 10.795 12.269 ( -0.778 -0.000 5.469) 5.524 13.699 ( 13.800 0.000 5.890) 15.005 17.361 ( -9.712 -0.000 -19.338) 21.639 17.774 ( 3.134 0.000 11.151) 11.583 18.639 ( 7.384 0.000 8.661) 11.381 19.035 ( -7.477 -0.000 1.049) 7.551 19.711 ( -5.149 -0.000 -24.735) 25.265 22.786 ( 24.952 0.000 6.602) 25.810 22.958 ( -3.258 -0.000 1.796) 3.721 23.154 ( 0.156 0.000 1.654) 1.661 ======================= Grid point 394 (192/361) ======================= q-point: (-0.20 -0.30 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.780 ( -23.528 1.015 20.716) 31.365 2.038 ( -27.697 -10.423 2.059) 29.665 3.119 ( -16.804 -0.650 -12.287) 20.827 3.374 ( 9.978 -1.101 5.509) 11.451 3.729 ( 8.683 6.919 0.086) 11.103 3.834 ( 9.221 -1.112 -1.086) 9.351 4.424 ( -7.620 3.361 2.657) 8.742 4.657 ( 5.289 -2.703 -4.126) 7.232 4.877 ( -8.931 0.983 2.273) 9.269 5.218 ( -3.269 0.070 6.968) 7.697 5.571 ( -3.781 -0.307 -0.582) 3.838 6.001 ( -6.436 10.203 8.462) 14.736 6.152 ( -3.194 -5.441 4.546) 7.776 6.447 ( 12.872 -5.693 1.763) 14.185 7.053 ( 2.828 10.998 -2.649) 11.661 7.308 ( 1.654 -7.472 3.201) 8.295 7.689 ( -19.702 -4.079 21.748) 29.627 8.596 ( -3.325 4.969 7.966) 9.961 8.641 ( 2.218 -2.091 -0.569) 3.101 9.069 ( 3.929 -7.674 -9.405) 12.759 9.870 ( 3.668 3.349 -1.511) 5.192 10.388 ( -9.797 2.766 3.324) 10.709 11.383 ( 7.988 -1.856 -14.258) 16.448 11.735 ( -6.620 6.692 12.580) 15.712 11.845 ( 7.845 -3.921 1.940) 8.982 12.085 ( -8.268 -3.502 -0.225) 8.982 12.352 ( 2.476 -1.201 4.530) 5.300 13.931 ( 16.216 3.148 0.039) 16.519 17.010 ( -8.856 -0.096 -17.117) 19.273 17.954 ( 2.833 0.041 12.299) 12.621 18.778 ( -1.399 7.059 1.282) 7.309 18.836 ( -11.154 0.624 -0.606) 11.188 19.496 ( 6.795 -8.346 -19.101) 21.925 22.903 ( -1.390 9.112 4.096) 10.086 23.013 ( 9.975 -1.523 -9.124) 13.604 23.395 ( 10.838 -3.157 19.115) 22.199 ======================= Grid point 395 (193/361) ======================= q-point: (-0.10 -0.30 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.624 ( -25.628 -3.392 13.098) 28.980 1.918 ( -23.662 -14.394 11.080) 29.830 2.748 ( -26.729 -8.592 -0.394) 28.078 3.541 ( 5.014 1.009 2.210) 5.571 3.745 ( 2.841 6.803 2.731) 7.862 3.822 ( -3.730 4.289 -1.720) 5.939 4.396 ( -3.804 6.525 7.370) 10.552 4.674 ( 1.655 -3.565 -1.607) 4.247 4.878 ( 8.842 2.456 -0.457) 9.188 5.282 ( -0.015 1.359 8.105) 8.218 5.490 ( -3.991 1.687 -4.658) 6.362 5.896 ( -6.388 12.347 6.276) 15.252 6.181 ( -1.868 -3.113 0.647) 3.688 6.694 ( 4.083 -3.999 9.873) 11.408 6.955 ( 0.224 9.234 -1.026) 9.293 7.320 ( -4.450 -2.136 -5.792) 7.610 7.666 ( -12.391 -9.225 5.147) 16.283 8.593 ( -4.055 4.871 7.358) 9.711 8.710 ( 1.870 -4.019 4.698) 6.459 9.182 ( 6.708 -14.161 -3.019) 15.957 9.835 ( 1.208 9.116 -1.538) 9.323 10.309 ( -5.915 -1.031 3.113) 6.764 11.344 ( 6.839 -3.413 -13.739) 15.722 11.678 ( -10.628 8.869 10.364) 17.292 11.833 ( -4.148 2.156 -4.629) 6.579 12.220 ( 6.177 -12.183 6.430) 15.098 12.437 ( 2.763 -0.711 1.172) 3.084 14.071 ( 16.787 8.092 -7.264) 20.001 16.791 ( -3.345 -0.039 -2.484) 4.167 18.133 ( 2.461 0.654 12.106) 12.371 18.453 ( -11.930 0.848 -12.037) 16.968 18.882 ( 5.327 5.133 2.593) 7.838 19.509 ( 3.943 -11.387 -10.128) 15.741 22.801 ( -6.742 15.231 5.146) 17.434 23.058 ( 8.848 -2.661 -7.357) 11.810 23.771 ( 11.112 0.095 14.040) 17.906 ======================= Grid point 404 (194/361) ======================= q-point: (-0.20 -0.20 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.622 ( -27.802 -0.000 5.824) 28.406 1.753 ( -24.203 -0.000 22.616) 33.125 2.674 ( -29.713 -0.000 -1.962) 29.778 3.550 ( 6.811 0.000 2.158) 7.144 3.788 ( -5.147 -0.000 1.116) 5.266 3.883 ( 2.279 0.000 -0.823) 2.423 4.475 ( 4.605 0.000 9.545) 10.598 4.617 ( -6.456 -0.000 -0.349) 6.465 4.901 ( 9.583 0.000 -1.462) 9.694 5.295 ( 0.498 0.000 7.820) 7.836 5.506 ( -3.231 -0.000 -4.457) 5.504 6.053 ( -5.519 -0.000 6.624) 8.622 6.107 ( -3.062 -0.000 1.539) 3.427 6.664 ( 15.231 0.000 5.176) 16.087 7.119 ( 6.148 0.000 -7.019) 9.331 7.194 ( -15.090 -0.000 6.823) 16.561 7.601 ( -13.817 -0.000 1.577) 13.906 8.649 ( -7.318 -0.000 9.169) 11.731 8.665 ( 3.022 0.000 0.679) 3.097 9.046 ( 7.145 0.000 -2.764) 7.661 9.929 ( 5.415 0.000 -1.904) 5.740 10.293 ( -11.132 -0.000 3.708) 11.733 11.312 ( 7.577 0.000 -14.073) 15.983 11.811 ( -0.205 -0.000 -7.912) 7.915 11.915 ( -5.917 -0.000 14.165) 15.352 11.992 ( -3.020 -0.000 5.590) 6.354 12.434 ( 3.347 0.000 1.525) 3.678 14.143 ( 17.098 0.000 -6.304) 18.223 16.791 ( -2.893 -0.000 -1.717) 3.364 18.138 ( 2.235 0.000 13.190) 13.378 18.462 ( -15.170 -0.000 -14.796) 21.191 18.940 ( 3.090 0.000 3.995) 5.050 19.395 ( 7.330 0.000 -10.598) 12.886 22.946 ( -4.456 -0.000 5.199) 6.847 23.034 ( 9.143 0.000 -8.038) 12.174 23.769 ( 12.114 0.000 15.074) 19.338 ======================= Grid point 405 (195/361) ======================= q-point: (-0.10 -0.20 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.400 ( -23.080 -3.250 14.889) 27.658 1.535 ( -32.696 -6.193 1.175) 33.298 2.465 ( -26.733 -6.832 32.207) 42.411 3.555 ( -3.736 1.974 -2.853) 5.099 3.705 ( -6.012 -0.472 -0.509) 6.051 3.924 ( 4.322 3.868 3.882) 6.979 4.467 ( -6.521 7.426 0.359) 9.890 4.745 ( 9.809 -2.666 8.819) 13.457 5.030 ( 11.917 1.387 -2.877) 12.338 5.338 ( -6.210 -0.375 -10.419) 12.135 5.399 ( 2.201 0.727 6.495) 6.896 6.000 ( -2.381 10.817 3.636) 11.657 6.152 ( -0.964 -4.749 6.149) 7.829 6.884 ( -2.585 11.569 13.280) 17.801 7.003 ( -0.240 5.496 -0.885) 5.572 7.151 ( -5.578 -0.483 -7.552) 9.402 7.402 ( -8.709 -17.152 -7.082) 20.499 8.610 ( -7.573 3.905 5.514) 10.149 8.777 ( 2.813 -6.540 7.733) 10.511 9.137 ( 5.992 -7.106 -4.520) 10.336 9.930 ( -0.222 11.897 -0.303) 11.903 10.189 ( -9.905 -7.418 0.772) 12.399 11.268 ( 7.475 -1.008 -12.331) 14.455 11.648 ( -7.699 4.204 -5.516) 10.362 11.819 ( -8.778 10.967 5.501) 15.086 12.171 ( 1.606 -18.773 0.195) 18.842 12.457 ( 2.213 0.958 -2.619) 3.560 14.233 ( 15.038 4.681 -13.381) 20.666 16.983 ( 15.004 3.284 22.372) 27.137 18.119 ( -8.066 -3.890 -13.906) 16.540 18.334 ( 3.646 0.979 11.149) 11.771 18.986 ( 2.114 1.071 0.371) 2.399 19.399 ( 3.454 -3.976 -6.428) 8.310 22.886 ( -7.197 12.204 5.385) 15.157 23.083 ( 8.851 -1.477 -6.066) 10.832 23.989 ( 4.505 -0.142 -0.425) 4.527 ======================= Grid point 415 (196/361) ======================= q-point: (-0.10 -0.10 0.23) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.085 ( -27.302 -0.000 10.406) 29.218 1.347 ( -14.991 -0.000 23.226) 27.644 2.581 ( -22.488 -0.000 45.763) 50.990 3.437 ( -7.680 -0.000 -4.031) 8.673 3.665 ( 1.565 0.000 0.890) 1.800 4.031 ( 3.086 0.000 1.847) 3.596 4.400 ( -4.672 -0.000 -1.415) 4.882 4.895 ( 0.345 0.000 -6.039) 6.049 5.131 ( 9.038 0.000 -6.287) 11.009 5.180 ( -0.712 -0.000 1.445) 1.611 5.547 ( 6.760 0.000 10.350) 12.362 6.036 ( 0.814 0.000 -1.900) 2.067 6.282 ( 1.545 0.000 15.627) 15.703 6.807 ( -27.251 -0.000 -19.262) 33.371 6.959 ( -17.381 -0.000 12.241) 21.259 7.042 ( 5.093 0.000 -11.116) 12.228 7.250 ( 7.406 0.000 12.345) 14.396 8.599 ( -8.452 -0.000 7.926) 11.587 8.889 ( 7.559 0.000 6.272) 9.822 9.096 ( 2.767 0.000 -8.216) 8.670 9.847 ( -25.350 -0.000 -2.062) 25.434 10.066 ( 4.683 0.000 -0.035) 4.683 11.244 ( 8.536 0.000 -10.505) 13.535 11.473 ( -8.345 -0.000 -8.266) 11.745 11.726 ( -12.712 -0.000 1.624) 12.816 12.143 ( 3.402 0.000 4.435) 5.589 12.467 ( 2.147 0.000 -1.760) 2.776 14.240 ( 10.763 0.000 -19.394) 22.180 17.706 ( 37.069 0.000 27.027) 45.875 17.850 ( -1.929 -0.000 -14.461) 14.589 18.533 ( 0.985 0.000 14.267) 14.301 18.959 ( -2.139 -0.000 -4.154) 4.673 19.379 ( 5.666 0.000 -4.831) 7.446 22.923 ( -6.250 -0.000 5.286) 8.186 23.128 ( 8.108 0.000 -5.719) 9.922 23.776 ( -18.314 -0.000 -19.670) 26.875 ======================= Grid point 416 (197/361) ======================= q-point: ( 0.00 0.00 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.914 ( 11.718 0.000 15.491) 19.424 2.369 ( 0.059 0.000 27.913) 27.913 2.979 ( -2.849 -0.000 -8.386) 8.857 3.685 ( -4.427 -0.000 16.070) 16.669 3.743 ( -2.051 -0.000 -13.353) 13.510 3.904 ( 8.903 0.000 -2.920) 9.370 4.229 ( -4.143 -0.000 -4.313) 5.981 4.420 ( 0.076 0.000 -20.353) 20.353 5.245 ( 4.784 0.000 8.355) 9.627 5.307 ( -10.171 -0.000 12.616) 16.206 5.634 ( -14.158 -0.000 8.926) 16.737 6.106 ( -0.020 -0.000 -2.066) 2.066 6.281 ( 11.899 0.000 -2.253) 12.110 6.564 ( -0.415 -0.000 -8.328) 8.338 6.929 ( -12.794 -0.000 22.773) 26.120 7.537 ( -12.310 -0.000 31.299) 33.633 7.909 ( 0.043 0.000 9.076) 9.076 8.567 ( -5.364 -0.000 -1.358) 5.533 8.702 ( 2.902 0.000 -5.036) 5.812 9.254 ( -12.549 -0.000 10.625) 16.443 9.635 ( 9.833 0.000 8.693) 13.124 9.950 ( 0.580 0.000 -10.950) 10.966 10.737 ( -8.287 -0.000 -13.808) 16.103 11.138 ( 12.319 0.000 -9.894) 15.801 11.945 ( -2.204 -0.000 10.034) 10.273 12.366 ( 8.113 0.000 -2.969) 8.640 12.446 ( -3.631 -0.000 2.117) 4.203 13.537 ( 3.260 0.000 -15.648) 15.984 17.498 ( 8.555 0.000 -6.814) 10.937 18.235 ( -6.675 -0.000 -15.979) 17.317 18.760 ( -17.921 -0.000 8.575) 19.867 19.042 ( 11.331 0.000 2.203) 11.543 19.977 ( 25.763 0.000 12.450) 28.614 22.022 ( -28.231 -0.000 -17.987) 33.475 22.899 ( -5.314 -0.000 1.614) 5.554 23.160 ( 7.631 0.000 -5.764) 9.564 ======================= Grid point 417 (198/361) ======================= q-point: ( 0.10 0.00 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.261 ( 14.823 0.111 11.804) 18.949 2.642 ( 0.289 2.052 15.326) 15.465 2.907 ( 3.700 2.562 0.840) 4.578 3.531 ( -3.298 5.188 -11.128) 12.713 3.700 ( -6.064 -1.905 -5.043) 8.114 3.944 ( 1.932 -0.716 -5.652) 6.016 4.107 ( -1.627 1.944 -4.688) 5.329 4.266 ( 1.163 -3.888 -6.297) 7.491 5.301 ( -10.935 0.733 14.359) 18.063 5.415 ( -1.139 -3.474 9.992) 10.640 5.647 ( -2.838 -1.188 8.034) 8.603 6.022 ( -5.067 -0.721 -5.755) 7.702 6.334 ( 3.617 -0.177 -4.978) 6.156 6.480 ( 0.514 3.283 -3.866) 5.098 7.054 ( -9.493 2.287 27.125) 28.829 7.585 ( -8.722 23.834 19.854) 32.223 8.057 ( -9.018 -19.344 9.189) 23.237 8.505 ( -0.852 1.404 0.880) 1.863 8.762 ( 6.532 -3.113 -0.639) 7.265 9.229 ( -7.749 2.789 13.388) 15.719 9.721 ( 3.401 8.951 -5.477) 11.031 10.023 ( 6.152 -14.716 3.305) 16.289 10.519 ( 1.560 -3.228 -14.109) 14.558 11.197 ( 15.075 1.682 -11.398) 18.973 12.026 ( -2.682 -2.605 7.158) 8.075 12.408 ( -6.243 0.811 4.096) 7.511 12.437 ( 6.431 -2.415 -4.608) 8.272 13.401 ( 1.510 2.785 -11.026) 11.472 17.552 ( 8.718 0.878 -4.005) 9.634 17.937 ( -7.654 0.776 -15.599) 17.393 18.620 ( -16.781 -0.978 7.272) 18.315 19.126 ( -2.112 0.161 2.089) 2.975 20.492 ( 23.132 1.517 16.233) 28.300 21.465 ( -16.609 2.626 -18.866) 25.272 22.878 ( -2.586 -3.621 0.633) 4.495 23.210 ( 8.744 -0.270 -5.495) 10.330 ======================= Grid point 418 (199/361) ======================= q-point: ( 0.20 0.00 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.522 ( 4.744 6.100 7.259) 10.602 2.725 ( 10.055 -3.116 -2.958) 10.935 3.041 ( 4.695 6.161 11.040) 13.486 3.334 ( -1.678 9.179 -4.215) 10.238 3.539 ( -3.973 -3.187 -8.399) 9.823 3.824 ( -5.000 2.681 -7.384) 9.312 4.078 ( 3.401 -5.569 -5.831) 8.751 4.338 ( 4.227 -3.685 2.844) 6.288 5.296 ( -16.346 -4.091 12.554) 21.013 5.480 ( -8.209 -1.821 7.072) 10.987 5.686 ( -1.771 -2.076 0.111) 2.731 5.877 ( -6.796 -1.610 -5.503) 8.892 6.338 ( 3.085 -2.647 -1.844) 4.463 6.424 ( 1.834 4.267 -3.175) 5.625 7.243 ( -6.090 4.784 27.849) 28.906 7.411 ( -7.454 25.231 9.340) 27.918 8.152 ( -12.874 -14.378 7.685) 20.773 8.537 ( 1.090 0.943 4.600) 4.821 8.840 ( 0.478 1.382 2.911) 3.258 9.317 ( 1.635 2.326 8.101) 8.586 9.654 ( -1.066 -9.034 -3.059) 9.597 10.133 ( 4.449 9.396 -1.399) 10.489 10.658 ( 18.482 -15.218 -1.188) 23.971 11.253 ( 16.346 3.085 -12.691) 20.924 12.077 ( -3.147 -4.149 3.447) 6.245 12.340 ( -10.299 2.683 6.475) 12.458 12.486 ( 3.145 -5.574 -4.743) 7.966 13.281 ( 2.595 3.309 -8.943) 9.882 17.591 ( -0.218 2.179 -6.265) 6.636 17.697 ( -0.281 -3.254 -9.218) 9.779 18.485 ( -12.998 1.270 5.681) 14.242 19.064 ( -12.545 -2.925 4.064) 13.507 20.724 ( -0.136 18.231 -2.020) 18.343 21.310 ( 14.102 -14.212 -1.347) 20.067 22.900 ( 0.558 -2.904 0.405) 2.984 23.273 ( 8.778 0.718 -4.234) 9.772 ======================= Grid point 419 (200/361) ======================= q-point: (-0.70 0.00 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.495 ( -5.652 6.524 4.609) 9.785 2.837 ( 4.394 -0.863 -5.711) 7.257 3.170 ( 8.760 -0.168 2.325) 9.065 3.224 ( -0.326 9.643 0.534) 9.663 3.499 ( -1.236 -0.605 2.327) 2.704 3.668 ( 0.748 3.549 -5.583) 6.658 4.159 ( 8.692 -7.959 -4.899) 12.763 4.449 ( 1.614 -0.477 4.328) 4.643 5.179 ( -20.589 -7.356 2.611) 22.019 5.398 ( -13.901 -1.884 4.243) 14.656 5.650 ( -5.248 -2.238 0.436) 5.722 5.752 ( -7.103 -3.203 -3.239) 8.438 6.375 ( 2.213 3.423 -3.765) 5.548 6.436 ( 6.011 -4.363 0.668) 7.458 7.209 ( -4.102 22.028 6.567) 23.350 7.418 ( -4.836 5.333 20.935) 22.138 8.159 ( -11.907 -9.482 6.116) 16.404 8.590 ( -2.001 2.009 6.832) 7.397 8.840 ( -3.679 4.633 6.723) 8.955 9.322 ( -3.509 -7.234 -5.482) 9.731 9.821 ( 7.855 -4.724 6.865) 11.452 10.083 ( 8.183 13.978 -1.677) 16.284 11.101 ( 21.577 -12.644 4.868) 25.478 11.293 ( 15.933 3.799 -13.551) 21.258 12.099 ( -2.562 -4.069 1.603) 5.069 12.227 ( -13.314 4.813 7.805) 16.166 12.496 ( -2.550 -5.655 -3.231) 6.994 13.231 ( 7.002 -2.240 -9.268) 11.830 17.345 ( -9.845 -0.750 -14.520) 17.559 17.776 ( 6.026 -1.304 4.032) 7.367 18.395 ( -6.239 0.374 3.601) 7.214 18.954 ( -16.797 -6.643 5.141) 18.780 20.403 ( -0.603 18.812 -15.921) 24.653 21.762 ( 16.305 -15.435 10.769) 24.901 22.947 ( 3.657 -0.285 -0.223) 3.675 23.345 ( 8.161 1.602 -1.152) 8.396 ======================= Grid point 420 (201/361) ======================= q-point: (-0.60 0.00 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.387 ( -14.140 6.591 9.748) 18.396 2.768 ( -5.089 1.492 -5.006) 7.293 3.130 ( 3.865 3.818 -1.536) 5.645 3.327 ( 3.397 -2.852 0.578) 4.473 3.495 ( -1.244 3.717 1.852) 4.335 3.710 ( 9.720 -0.082 0.183) 9.722 4.321 ( 12.265 -5.830 -3.815) 14.106 4.462 ( -5.949 2.842 5.120) 8.347 4.969 ( -17.283 -5.955 -1.296) 18.326 5.282 ( -11.051 -4.843 2.557) 12.334 5.602 ( -7.003 -3.578 -0.531) 7.882 5.665 ( -8.355 -6.430 1.268) 10.619 6.326 ( 1.360 3.450 -3.423) 5.047 6.572 ( 5.769 -5.644 0.136) 8.071 7.083 ( 0.265 18.086 6.548) 19.237 7.467 ( -7.383 4.185 7.965) 11.639 8.149 ( -11.255 -7.054 6.916) 14.976 8.601 ( -6.309 3.475 9.675) 12.062 8.837 ( -3.433 3.034 7.800) 9.046 9.292 ( -2.706 -9.826 -4.026) 10.958 9.920 ( 11.931 19.721 -3.574) 23.325 10.165 ( 4.805 -3.024 7.941) 9.762 11.293 ( 15.037 5.446 -15.418) 22.214 11.522 ( 16.624 -8.200 2.117) 18.657 12.076 ( -14.582 5.157 7.305) 17.105 12.146 ( 0.541 -2.691 5.303) 5.971 12.453 ( -4.353 -3.215 -1.040) 5.511 13.299 ( 10.679 -10.878 -10.393) 18.450 17.046 ( -10.124 0.537 -11.727) 15.502 17.941 ( 4.701 -2.513 8.037) 9.644 18.392 ( 0.261 -2.975 0.084) 2.988 18.841 ( -15.326 -6.450 3.744) 17.044 20.060 ( 2.360 18.269 -16.337) 24.622 22.192 ( 6.948 -16.659 9.521) 20.407 22.991 ( 6.964 3.832 -2.441) 8.315 23.466 ( 8.534 0.369 4.947) 9.872 ======================= Grid point 421 (202/361) ======================= q-point: (-0.50 0.00 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.219 ( -19.830 7.130 12.166) 24.332 2.546 ( -15.835 7.793 -0.090) 17.649 3.227 ( 5.000 3.949 0.813) 6.423 3.326 ( 2.622 -5.229 -3.371) 6.751 3.505 ( 1.211 1.151 4.973) 5.247 3.815 ( 0.008 -3.695 0.190) 3.700 4.406 ( -10.004 -2.158 6.258) 11.996 4.477 ( 11.899 -2.631 -5.114) 13.216 4.833 ( -7.019 -2.905 2.465) 7.986 5.263 ( -2.357 -5.007 2.098) 5.918 5.498 ( -6.620 -1.681 -3.225) 7.553 5.677 ( -7.689 -12.329 3.945) 15.056 6.279 ( -0.906 2.479 -0.390) 2.668 6.680 ( 4.781 -5.238 -2.435) 7.498 7.044 ( 2.514 12.911 5.903) 14.417 7.333 ( -12.916 1.567 -1.154) 13.062 8.106 ( -12.529 -0.442 7.290) 14.502 8.605 ( -6.649 -0.220 8.693) 10.947 8.888 ( -1.565 1.902 10.886) 11.161 9.328 ( 1.026 -7.017 -1.006) 7.163 9.818 ( 7.539 20.850 -4.505) 22.624 10.330 ( 2.557 -1.700 5.978) 6.720 11.241 ( 12.700 7.057 -16.727) 22.156 11.704 ( 3.988 -4.982 -3.706) 7.380 11.920 ( -14.656 3.929 8.140) 17.219 12.280 ( 5.057 -0.959 4.133) 6.601 12.445 ( 0.824 -0.963 1.512) 1.973 13.457 ( 12.857 -15.752 -10.980) 23.108 16.833 ( -5.922 0.262 -2.785) 6.550 18.117 ( 1.883 -5.135 7.549) 9.322 18.399 ( 0.779 -1.111 -6.866) 6.999 18.764 ( -4.673 -2.862 2.694) 6.106 19.783 ( 1.696 14.968 -10.616) 18.428 22.447 ( -4.304 -18.203 5.452) 19.483 23.011 ( 9.250 7.101 -4.856) 12.632 23.692 ( 9.530 -2.219 9.442) 13.597 ======================= Grid point 422 (203/361) ======================= q-point: (-0.40 0.00 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.015 ( -20.649 8.851 13.859) 26.397 2.188 ( -24.904 10.664 0.442) 27.094 3.159 ( -4.851 11.789 11.985) 17.497 3.472 ( 2.480 -9.216 -2.572) 9.884 3.614 ( 6.524 -4.093 2.589) 8.126 3.792 ( -6.382 -2.900 0.913) 7.069 4.353 ( -13.170 -10.750 2.378) 17.166 4.591 ( 9.004 -2.652 -3.133) 9.895 4.898 ( 6.934 0.419 4.977) 8.546 5.295 ( -1.445 -2.867 -3.565) 4.798 5.423 ( 0.013 0.476 1.437) 1.514 5.742 ( -5.347 -13.753 2.736) 15.007 6.261 ( -3.475 0.118 5.299) 6.338 6.742 ( 3.850 -6.137 -5.944) 9.371 7.028 ( 0.508 0.571 -7.401) 7.440 7.123 ( -16.089 3.982 10.370) 19.551 7.994 ( -10.965 8.549 8.464) 16.277 8.603 ( -8.923 -3.828 5.997) 11.412 9.004 ( 0.989 2.231 11.182) 11.445 9.377 ( 5.124 5.547 -2.453) 7.940 9.700 ( -0.432 6.009 -1.280) 6.159 10.388 ( -0.199 3.156 2.240) 3.875 11.143 ( 11.067 7.116 -16.811) 21.348 11.685 ( -3.851 -0.890 -3.315) 5.159 11.824 ( -11.434 -1.785 9.057) 14.695 12.340 ( 1.403 -3.646 -4.646) 6.070 12.479 ( 4.526 8.045 0.740) 9.260 13.649 ( 13.886 -15.180 -12.557) 24.103 16.869 ( 3.532 -4.038 10.737) 12.003 18.168 ( -3.946 -3.518 -11.204) 12.388 18.329 ( 3.852 3.493 2.765) 5.889 18.843 ( 7.209 -1.601 2.151) 7.691 19.594 ( -1.665 10.325 -3.698) 11.093 22.554 ( -11.185 -20.906 3.503) 23.967 23.016 ( 9.906 7.378 -5.713) 13.608 23.921 ( 5.963 -2.033 5.056) 8.078 ======================= Grid point 423 (204/361) ======================= q-point: (-0.30 0.00 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.730 ( -26.663 13.118 6.457) 30.408 1.870 ( -16.420 8.574 17.865) 25.735 3.224 ( -3.523 6.736 21.746) 23.036 3.459 ( -7.959 -2.797 -0.479) 8.450 3.668 ( -7.832 -3.284 1.463) 8.618 3.828 ( 10.026 -3.725 -4.095) 11.453 4.306 ( -9.834 -13.958 -1.232) 17.118 4.699 ( 4.836 -6.057 -2.756) 8.226 5.072 ( 9.361 4.261 3.506) 10.866 5.199 ( -1.223 1.134 -2.969) 3.405 5.510 ( 7.000 0.961 3.408) 7.844 5.828 ( -0.982 -11.357 0.538) 11.413 6.335 ( -4.627 -6.185 13.110) 15.216 6.686 ( -10.376 -8.711 -11.741) 17.927 6.875 ( -2.676 -3.533 -8.049) 9.189 7.134 ( -6.933 0.266 15.005) 16.532 7.871 ( -7.395 17.172 12.217) 22.334 8.584 ( -10.401 -7.484 6.296) 14.277 9.102 ( 1.780 4.373 5.997) 7.633 9.271 ( 4.751 19.558 -5.648) 20.904 9.686 ( -9.725 -12.804 1.803) 16.179 10.333 ( -0.506 9.666 -0.265) 9.683 11.051 ( 10.807 4.224 -15.388) 19.273 11.559 ( -8.223 1.640 -3.072) 8.930 11.826 ( -7.664 -3.258 7.901) 11.480 12.272 ( 0.166 1.534 -7.885) 8.034 12.472 ( 3.134 7.173 1.674) 8.005 13.771 ( 12.056 -10.925 -17.576) 23.950 17.229 ( 12.352 -11.712 14.781) 22.544 17.984 ( 7.355 8.919 -11.538) 16.333 18.432 ( -0.737 -7.810 4.415) 9.002 18.995 ( 12.016 3.075 1.568) 12.502 19.444 ( -5.190 7.799 -1.188) 9.443 22.610 ( -14.625 -24.757 2.668) 28.877 23.026 ( 9.805 5.704 -6.010) 12.837 23.941 ( -3.532 3.426 -5.620) 7.470 ======================= Grid point 424 (205/361) ======================= q-point: (-0.20 0.00 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.480 ( -12.300 9.639 17.296) 23.310 1.870 ( -10.316 5.057 24.183) 26.774 3.318 ( -9.173 -2.836 -5.385) 11.008 3.399 ( -10.571 3.885 28.935) 31.050 3.638 ( 3.634 -1.161 -1.370) 4.054 3.920 ( 7.616 -2.233 -6.634) 10.344 4.303 ( -5.184 -11.958 -1.440) 13.113 4.710 ( -0.246 -0.928 -6.858) 6.925 5.054 ( 4.585 3.315 -4.470) 7.210 5.292 ( -0.695 0.526 8.687) 8.731 5.702 ( 16.554 0.772 4.427) 17.153 5.927 ( 1.288 -8.347 0.989) 8.504 6.335 ( -20.904 -9.099 -10.822) 25.237 6.589 ( -3.007 -6.203 18.095) 19.363 6.795 ( -0.171 -2.637 -9.856) 10.204 7.213 ( -13.114 -7.144 16.301) 22.107 7.804 ( -2.885 20.006 17.266) 26.584 8.607 ( -7.900 -9.251 6.069) 13.595 9.015 ( -0.473 10.413 -9.871) 14.356 9.198 ( 4.699 12.272 6.787) 14.790 9.623 ( -19.156 -14.797 0.893) 24.222 10.222 ( 2.556 14.855 -2.291) 15.246 11.019 ( 11.483 0.255 -13.289) 17.565 11.351 ( -11.445 2.617 -6.020) 13.193 11.832 ( -5.670 1.023 8.169) 9.997 12.225 ( 3.685 1.673 -1.268) 4.242 12.473 ( 1.468 3.573 0.687) 3.923 13.765 ( 9.137 -6.650 -21.021) 23.866 17.495 ( 4.980 -6.916 -7.769) 11.532 18.152 ( 27.227 4.661 8.753) 28.977 18.527 ( -5.428 -16.621 0.866) 17.507 19.125 ( 6.300 15.347 5.756) 17.560 19.314 ( 2.026 0.893 -2.605) 3.418 22.638 ( -17.375 -27.977 -0.810) 32.943 23.045 ( 8.843 3.516 -6.202) 11.359 23.623 ( -14.837 13.848 -12.090) 23.624 ======================= Grid point 425 (206/361) ======================= q-point: (-0.10 0.00 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.605 ( 3.874 3.160 19.688) 20.313 2.058 ( -3.696 0.456 27.876) 28.124 3.141 ( -7.669 -1.800 -7.508) 10.882 3.537 ( -10.018 2.780 25.975) 27.978 3.757 ( 10.974 -4.270 -3.673) 12.335 3.905 ( 3.346 2.173 -8.969) 9.816 4.303 ( -3.902 -5.812 -2.800) 7.540 4.603 ( 3.101 0.860 -13.607) 13.983 5.102 ( 5.143 -0.385 2.618) 5.784 5.314 ( -7.625 2.370 9.516) 12.422 5.849 ( -18.708 -2.791 -0.606) 18.924 6.042 ( 11.255 -4.373 2.107) 12.257 6.105 ( 5.647 1.278 -1.496) 5.980 6.681 ( -0.959 -2.248 -11.221) 11.484 6.818 ( -7.664 -4.024 20.896) 22.618 7.317 ( -16.146 -12.123 24.783) 31.966 7.834 ( 0.735 15.694 15.863) 22.326 8.631 ( -6.215 -4.852 2.191) 8.184 8.807 ( -0.917 5.746 -9.833) 11.426 9.259 ( 0.321 6.695 9.930) 11.981 9.511 ( -12.868 -11.472 3.279) 17.548 10.091 ( 3.289 12.763 -6.461) 14.678 10.996 ( 0.490 0.208 -13.587) 13.597 11.121 ( -0.916 0.413 -7.107) 7.178 11.867 ( -3.035 1.899 10.386) 10.986 12.285 ( 6.706 0.472 -0.627) 6.752 12.465 ( -0.742 1.329 0.750) 1.697 13.669 ( 6.123 -3.146 -20.047) 21.196 17.484 ( 6.628 -1.244 -9.755) 11.859 18.421 ( 1.761 -4.061 -8.842) 9.888 18.721 ( 11.343 -11.438 7.309) 17.690 18.974 ( -9.643 13.450 4.849) 17.246 19.536 ( 22.141 1.453 6.246) 23.051 22.523 ( -25.493 -22.429 -12.679) 36.245 23.021 ( -1.471 8.297 -3.712) 9.208 23.187 ( -4.246 10.341 -5.586) 12.497 ======================= Grid point 427 (207/361) ======================= q-point: ( 0.10 0.10 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.594 ( 14.249 0.000 8.887) 16.793 2.682 ( 2.650 0.000 -7.220) 7.691 3.111 ( 2.439 0.000 14.426) 14.631 3.429 ( -0.970 -0.000 -2.036) 2.255 3.493 ( -5.366 -0.000 -10.999) 12.238 3.845 ( -0.367 -0.000 -11.983) 11.988 4.028 ( -0.985 -0.000 -4.022) 4.140 4.296 ( 4.492 0.000 3.878) 5.934 5.265 ( -18.329 -0.000 13.476) 22.750 5.459 ( -6.633 -0.000 6.504) 9.290 5.666 ( -1.582 -0.000 0.542) 1.672 5.862 ( -7.126 -0.000 -5.663) 9.102 6.315 ( 2.660 0.000 -2.491) 3.644 6.461 ( 1.768 0.000 -4.542) 4.874 7.287 ( -7.505 -0.000 29.326) 30.271 7.795 ( -10.732 -0.000 -2.051) 10.926 7.864 ( -10.930 -0.000 20.709) 23.416 8.547 ( 2.804 0.000 1.708) 3.284 8.846 ( 3.383 0.000 3.573) 4.920 9.394 ( 2.567 0.000 18.060) 18.242 9.508 ( -9.968 -0.000 -14.449) 17.554 10.331 ( 19.368 0.000 13.816) 23.791 10.426 ( 11.874 0.000 -13.475) 17.960 11.285 ( 16.536 0.000 -12.478) 20.715 12.032 ( -3.518 -0.000 3.576) 5.017 12.366 ( -9.936 -0.000 7.161) 12.248 12.435 ( 3.777 0.000 -6.085) 7.162 13.312 ( 1.479 0.000 -9.862) 9.972 17.635 ( -8.408 -0.000 -16.274) 18.318 17.644 ( 8.129 0.000 -1.052) 8.197 18.496 ( -14.139 -0.000 8.120) 16.305 19.034 ( -14.858 -0.000 3.927) 15.368 21.025 ( 21.175 0.000 18.566) 28.161 21.050 ( -6.929 -0.000 -23.569) 24.566 22.872 ( 1.256 0.000 1.774) 2.174 23.279 ( 9.504 0.000 -4.417) 10.480 ======================= Grid point 428 (208/361) ======================= q-point: ( 0.20 0.10 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.592 ( 1.209 3.711 -7.872) 8.786 2.821 ( 4.564 -1.053 2.450) 5.286 3.182 ( -0.840 1.189 3.132) 3.454 3.337 ( -1.757 2.260 -5.708) 6.385 3.516 ( 1.516 2.341 10.716) 11.073 3.698 ( 3.316 0.326 -12.856) 13.280 4.047 ( 6.057 -3.737 -0.193) 7.119 4.420 ( 3.747 -2.136 4.596) 6.303 5.103 ( -21.806 -1.437 5.901) 22.636 5.365 ( -15.413 -1.464 2.967) 15.764 5.624 ( -4.175 -0.741 -0.902) 4.335 5.711 ( -7.723 -1.318 -3.280) 8.493 6.372 ( 4.865 -1.167 1.065) 5.115 6.429 ( 3.809 0.897 -6.355) 7.463 7.486 ( -9.170 2.297 24.335) 26.107 7.555 ( -8.297 15.359 2.640) 17.656 7.971 ( -12.075 -10.569 11.500) 19.742 8.609 ( 3.187 0.306 1.935) 3.741 8.912 ( -2.046 2.720 7.291) 8.046 9.217 ( -8.660 -3.733 -12.124) 15.360 9.709 ( 8.389 -4.124 15.789) 18.349 10.408 ( 17.562 17.048 -6.951) 25.444 10.860 ( 21.409 -13.400 10.828) 27.480 11.352 ( 16.268 2.308 -13.185) 21.066 12.028 ( -2.371 -2.878 1.401) 3.983 12.291 ( -13.513 1.986 8.889) 16.296 12.405 ( -0.643 -3.343 -5.165) 6.186 13.216 ( 3.429 -0.098 -11.919) 12.403 17.335 ( -9.305 -0.335 -14.369) 17.122 17.759 ( 7.060 -0.522 2.578) 7.534 18.411 ( -9.520 0.875 5.968) 11.270 18.860 ( -18.319 -3.211 5.128) 19.292 20.677 ( 0.305 10.248 -23.028) 25.207 21.534 ( 14.536 -8.687 16.714) 23.793 22.941 ( 4.685 -0.228 2.483) 5.307 23.363 ( 9.050 0.536 -2.697) 9.458 ======================= Grid point 429 (209/361) ======================= q-point: (-0.70 0.10 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.477 ( -4.338 3.270 -2.879) 6.149 2.801 ( -4.068 3.027 -1.114) 5.192 3.195 ( -1.261 1.841 -3.697) 4.318 3.260 ( -1.834 -3.470 2.088) 4.446 3.581 ( -0.253 5.528 6.067) 8.211 3.692 ( 8.973 -1.864 -6.341) 11.144 4.234 ( 11.687 -3.231 3.050) 12.503 4.506 ( -1.128 -0.014 3.243) 3.434 4.880 ( -17.854 -2.034 3.127) 18.240 5.179 ( -16.862 -6.105 1.175) 17.971 5.551 ( -7.465 -1.695 0.554) 7.675 5.596 ( -7.529 -2.353 -1.292) 7.993 6.371 ( 2.016 1.914 -5.660) 6.306 6.497 ( 6.023 -3.256 0.432) 6.860 7.374 ( -3.630 14.267 3.013) 15.027 7.532 ( -15.144 2.913 14.294) 21.027 8.010 ( -10.882 -7.837 10.100) 16.788 8.663 ( 1.603 2.712 2.806) 4.219 8.889 ( -5.263 3.011 4.049) 7.291 9.102 ( -4.745 -10.031 -2.505) 11.376 10.023 ( 8.921 -1.810 11.411) 14.597 10.409 ( 17.073 21.888 -5.028) 28.211 11.355 ( 15.584 -8.601 4.355) 18.325 11.385 ( 17.181 2.718 -11.433) 20.816 12.070 ( 1.743 -3.433 1.696) 4.207 12.174 ( -14.996 3.418 10.851) 18.823 12.361 ( -4.631 -6.073 -2.661) 8.088 13.154 ( 7.384 -5.393 -14.611) 17.237 17.053 ( -9.978 0.253 -10.744) 14.665 17.904 ( 5.619 -1.584 4.949) 7.654 18.371 ( -2.984 0.150 3.522) 4.619 18.736 ( -13.206 -4.982 5.161) 15.029 20.335 ( 1.523 12.170 -21.218) 24.507 21.937 ( 4.999 -11.466 12.898) 17.967 23.052 ( 7.946 2.757 2.646) 8.817 23.465 ( 8.279 -0.361 0.663) 8.314 ======================= Grid point 430 (210/361) ======================= q-point: (-0.60 0.10 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.335 ( -12.103 5.473 4.229) 13.939 2.663 ( -10.147 6.055 -0.030) 11.816 3.157 ( 4.990 -4.571 -5.192) 8.529 3.309 ( -1.566 -3.978 2.173) 4.796 3.586 ( -1.412 7.134 7.203) 10.235 3.738 ( 1.232 -4.567 -4.462) 6.503 4.389 ( -9.346 0.509 3.012) 9.833 4.466 ( 6.416 1.448 0.008) 6.578 4.786 ( -5.225 -2.381 5.922) 8.249 5.112 ( -6.366 -11.504 1.838) 13.275 5.464 ( -7.239 -2.122 -0.207) 7.546 5.529 ( -6.888 -4.387 2.450) 8.526 6.311 ( -0.874 1.225 -3.270) 3.599 6.597 ( 4.318 -4.157 -1.720) 6.236 7.248 ( -3.073 9.381 -2.245) 10.123 7.371 ( -20.742 3.192 9.243) 22.931 8.052 ( -8.193 -4.565 9.444) 13.310 8.648 ( -3.060 4.038 2.586) 5.689 8.906 ( 0.561 -0.446 6.630) 6.668 9.140 ( -4.349 -10.563 2.964) 11.801 10.194 ( 8.772 12.016 0.417) 14.883 10.404 ( 11.285 15.900 2.463) 19.653 11.355 ( 11.644 5.403 -14.300) 19.216 11.610 ( 5.542 -5.296 -2.906) 8.198 11.994 ( -14.453 3.631 6.623) 16.308 12.248 ( 2.655 -2.582 1.796) 4.116 12.383 ( 3.126 -5.760 6.582) 9.288 13.189 ( 11.131 -13.465 -14.851) 22.929 16.837 ( -7.475 0.127 -3.626) 8.309 18.027 ( 2.144 -4.479 0.952) 5.056 18.409 ( 2.957 1.473 3.015) 4.472 18.714 ( -2.550 -2.677 4.690) 5.972 20.016 ( -0.535 11.165 -16.673) 20.074 22.157 ( -5.774 -14.009 7.024) 16.701 23.145 ( 9.074 7.725 0.018) 11.917 23.636 ( 8.072 -4.035 5.963) 10.817 ======================= Grid point 431 (211/361) ======================= q-point: (-0.50 0.10 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.160 ( -15.995 7.669 9.791) 20.261 2.394 ( -18.822 12.542 2.075) 22.713 3.247 ( -0.313 -10.091 -1.682) 10.235 3.345 ( 7.103 1.460 -0.542) 7.272 3.602 ( -4.170 1.590 7.771) 8.961 3.736 ( -1.115 -2.030 1.904) 2.998 4.193 ( -18.195 -5.794 -0.173) 19.096 4.561 ( 5.550 -0.452 -2.057) 5.937 4.897 ( 5.352 -1.105 8.503) 10.108 5.185 ( -1.417 -9.565 0.722) 9.696 5.420 ( -2.065 -1.306 2.543) 3.526 5.542 ( -4.208 -7.545 3.979) 9.511 6.258 ( -4.718 -0.522 1.734) 5.053 6.635 ( 0.516 -5.950 -6.147) 8.570 6.999 ( -15.644 -1.899 -7.715) 17.546 7.238 ( -10.774 7.105 10.862) 16.868 8.077 ( -5.283 1.066 8.612) 10.159 8.588 ( -6.803 1.986 2.930) 7.669 9.034 ( 4.279 1.109 8.791) 9.840 9.223 ( -4.896 -13.310 3.659) 14.646 10.078 ( 6.656 26.272 -5.765) 27.709 10.480 ( 5.914 8.058 4.678) 11.036 11.272 ( 9.328 6.789 -15.323) 19.180 11.631 ( -0.862 -4.041 -3.124) 5.180 11.851 ( -13.567 3.382 8.344) 16.283 12.259 ( -0.313 -5.724 -4.937) 7.565 12.576 ( 8.138 3.256 3.475) 9.429 13.347 ( 13.198 -18.426 -12.232) 25.755 16.804 ( -0.681 -3.215 7.025) 7.756 18.049 ( -0.304 -7.411 -7.784) 10.753 18.454 ( 4.580 8.119 1.906) 9.514 18.834 ( 9.767 0.075 4.592) 10.793 19.750 ( -3.923 7.356 -9.321) 12.505 22.214 ( -13.382 -16.992 3.599) 21.926 23.168 ( 8.288 9.714 -2.735) 13.058 23.853 ( 5.142 -5.606 5.657) 9.480 ======================= Grid point 432 (212/361) ======================= q-point: (-0.40 0.10 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.010 ( -20.458 15.965 10.860) 28.131 2.016 ( -16.880 10.392 11.211) 22.773 3.276 ( -3.125 -4.878 1.947) 6.111 3.441 ( 0.627 1.450 5.205) 5.440 3.600 ( -7.156 -3.220 5.069) 9.342 3.806 ( 6.653 2.391 2.364) 7.454 4.044 ( -11.932 -14.589 -3.417) 19.154 4.604 ( 2.283 -4.394 -1.966) 5.327 5.109 ( 6.171 -1.318 10.723) 12.442 5.197 ( -1.698 -1.325 -3.452) 4.069 5.504 ( 4.536 -1.899 5.520) 7.393 5.633 ( -0.380 -9.154 3.911) 9.962 6.236 ( -10.981 -4.794 8.577) 14.735 6.524 ( -10.847 -9.894 -10.980) 18.333 6.806 ( -4.550 -3.762 -4.912) 7.680 7.172 ( -9.359 3.481 9.814) 14.001 8.096 ( -2.664 7.458 10.174) 12.892 8.500 ( -10.854 -1.214 4.566) 11.838 9.172 ( 4.996 3.308 5.557) 8.172 9.295 ( -7.936 -13.901 1.764) 16.104 9.833 ( 2.018 26.497 -5.386) 27.114 10.512 ( 4.730 10.615 2.634) 11.916 11.149 ( 8.220 6.372 -15.747) 18.872 11.581 ( -4.914 0.334 -3.076) 5.807 11.793 ( -7.511 -0.097 10.060) 12.555 12.237 ( 0.685 -4.220 -6.456) 7.744 12.616 ( 3.796 7.534 -0.621) 8.459 13.527 ( 11.113 -16.497 -14.072) 24.366 17.041 ( 7.283 -9.421 13.914) 18.314 18.003 ( 3.901 -6.613 -11.879) 14.144 18.440 ( 3.507 9.043 -0.307) 9.704 19.055 ( 16.447 3.368 3.796) 17.212 19.558 ( -6.844 4.807 -2.624) 8.765 22.198 ( -18.039 -21.019 2.974) 27.858 23.154 ( 7.746 8.724 -4.330) 12.444 23.947 ( -1.957 -2.641 -1.497) 3.612 ======================= Grid point 433 (213/361) ======================= q-point: (-0.30 0.10 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.722 ( -12.338 17.454 13.852) 25.471 1.968 ( -13.449 5.793 21.961) 26.396 3.242 ( -8.694 -5.829 -4.215) 11.283 3.484 ( -5.552 4.081 16.149) 17.557 3.611 ( 0.502 -1.870 1.435) 2.410 3.904 ( 7.777 2.294 0.068) 8.108 4.047 ( -2.753 -16.666 -3.499) 17.250 4.648 ( 0.316 -5.396 -2.852) 6.112 5.113 ( -0.473 1.704 -4.698) 5.020 5.307 ( 1.144 1.413 11.911) 12.049 5.693 ( 11.115 -2.409 5.881) 12.804 5.756 ( -2.845 -9.790 4.851) 11.290 6.152 ( -18.045 -10.324 -1.395) 20.836 6.459 ( -3.293 -8.861 7.608) 12.135 6.736 ( -2.049 -3.677 -7.409) 8.521 7.144 ( -10.816 -1.307 10.128) 14.876 8.105 ( -2.667 13.179 13.700) 19.196 8.457 ( -9.516 -6.734 7.288) 13.748 9.196 ( 1.270 9.105 -4.930) 10.432 9.275 ( -9.880 -11.380 1.545) 15.150 9.591 ( -1.488 19.242 -0.451) 19.304 10.488 ( 4.958 14.907 0.377) 15.715 11.043 ( 9.051 2.730 -15.061) 17.783 11.410 ( -9.624 3.821 -5.647) 11.795 11.846 ( -2.751 0.577 9.666) 10.066 12.228 ( 3.118 -1.413 -2.450) 4.210 12.573 ( 0.702 7.110 -0.103) 7.145 13.595 ( 7.579 -12.497 -17.703) 22.957 17.354 ( 7.296 -8.565 2.015) 11.431 18.103 ( 11.215 -13.551 -0.673) 17.603 18.405 ( 4.572 6.049 -2.427) 7.961 19.292 ( 11.889 0.830 1.233) 11.982 19.404 ( -1.340 11.772 2.726) 12.158 22.161 ( -21.150 -24.874 2.270) 32.729 23.133 ( 7.440 6.484 -5.588) 11.341 23.788 ( -10.333 4.963 -8.921) 14.525 ======================= Grid point 434 (214/361) ======================= q-point: (-0.20 0.10 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.716 ( 1.604 9.541 16.809) 19.394 2.070 ( -7.948 1.033 26.614) 27.795 3.088 ( -8.678 -4.085 -6.779) 11.745 3.589 ( -2.754 -0.041 13.052) 13.339 3.674 ( 3.530 -2.677 -0.264) 4.439 3.961 ( 4.612 4.990 0.274) 6.801 4.126 ( 1.345 -13.593 -6.386) 15.079 4.603 ( -1.460 -1.606 -8.612) 8.881 5.102 ( 3.799 0.487 1.129) 3.993 5.378 ( -5.756 4.397 11.533) 13.618 5.747 ( -19.592 -7.860 5.830) 21.900 5.977 ( 14.318 -3.952 4.680) 15.573 6.072 ( 2.700 -4.352 -0.477) 5.144 6.618 ( -5.036 -5.384 -6.274) 9.681 6.679 ( -2.014 -10.225 13.819) 17.308 7.134 ( -14.652 -6.691 14.067) 21.385 8.127 ( -2.674 14.681 17.182) 22.758 8.507 ( -6.601 -8.061 6.927) 12.511 8.975 ( -2.069 11.522 -10.465) 15.702 9.274 ( -11.663 -12.227 3.478) 17.252 9.457 ( 2.274 14.653 2.829) 15.096 10.385 ( 4.251 18.514 -3.794) 19.371 10.993 ( 5.756 -0.526 -13.693) 14.863 11.154 ( -6.912 3.632 -7.904) 11.110 11.916 ( -1.486 3.011 9.973) 10.523 12.292 ( 6.269 0.249 0.497) 6.294 12.517 ( -1.410 4.619 0.205) 4.834 13.561 ( 4.838 -9.024 -18.057) 20.758 17.444 ( 7.158 -3.026 -7.660) 10.912 18.271 ( -8.064 -12.745 -3.336) 15.447 18.581 ( 22.146 -4.103 3.281) 22.761 19.158 ( -11.394 5.629 -1.762) 12.830 19.623 ( 22.467 9.629 9.271) 26.143 22.081 ( -23.527 -24.974 -2.326) 34.389 23.114 ( 6.511 4.538 -6.473) 10.241 23.423 ( -12.731 12.102 -9.135) 19.799 ======================= Grid point 435 (215/361) ======================= q-point: (-0.10 0.10 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.939 ( 10.391 2.877 14.664) 18.201 2.340 ( -1.337 -2.837 27.481) 27.659 2.947 ( -3.226 -3.331 -8.075) 9.312 3.637 ( -1.045 -8.343 -9.480) 12.671 3.740 ( -2.857 3.643 11.184) 12.104 3.963 ( 4.988 4.771 -3.146) 7.585 4.144 ( -0.036 -8.157 -7.801) 11.287 4.445 ( -2.008 1.860 -13.735) 14.005 5.209 ( 1.648 -1.542 8.143) 8.450 5.384 ( -6.386 6.018 12.571) 15.331 5.632 ( -12.534 -0.245 10.457) 16.325 6.105 ( 0.650 -0.355 -0.979) 1.227 6.258 ( 11.646 -3.264 -0.722) 12.116 6.509 ( -2.004 -5.212 -7.804) 9.596 6.890 ( -9.800 -5.161 20.788) 23.554 7.266 ( -10.851 -19.572 20.913) 30.629 8.150 ( -3.835 16.606 16.053) 23.413 8.527 ( -6.099 -4.237 1.785) 7.638 8.783 ( 2.595 8.273 -6.245) 10.686 9.227 ( -13.535 -5.199 7.583) 16.362 9.519 ( 9.297 -2.133 3.119) 10.035 10.204 ( 2.346 20.333 -5.508) 21.196 10.762 ( -8.090 2.724 -13.605) 16.061 11.116 ( 11.852 -1.992 -10.161) 15.738 11.982 ( -1.596 3.514 9.650) 10.393 12.380 ( 6.789 1.384 -0.657) 6.960 12.461 ( -2.904 2.094 0.611) 3.632 13.484 ( 2.775 -5.963 -14.901) 16.288 17.484 ( 8.496 -1.479 -6.606) 10.863 18.164 ( -7.634 -6.453 -10.115) 14.221 18.787 ( -9.871 0.476 3.199) 10.387 19.042 ( 7.040 0.298 0.757) 7.087 20.008 ( 23.183 4.189 13.394) 27.100 21.856 ( -23.725 -15.637 -11.575) 30.682 23.010 ( -5.034 9.257 -3.603) 11.136 23.188 ( 4.388 3.437 -5.776) 8.027 ======================= Grid point 438 (216/361) ======================= q-point: ( 0.20 -0.80 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.504 ( 0.937 0.000 -10.558) 10.599 2.841 ( -5.304 -0.000 2.805) 6.000 3.183 ( -3.370 -0.000 4.352) 5.504 3.246 ( -4.742 -0.000 -5.431) 7.209 3.652 ( -1.854 -0.000 8.961) 9.151 3.658 ( 10.895 0.000 -11.683) 15.974 4.210 ( 11.992 0.000 7.345) 14.062 4.483 ( 0.405 0.000 1.928) 1.971 4.888 ( -15.091 -0.000 5.420) 16.035 5.110 ( -21.698 -0.000 -0.169) 21.699 5.538 ( -7.160 -0.000 -0.013) 7.160 5.575 ( -7.405 -0.000 -0.852) 7.453 6.393 ( 3.192 0.000 -8.028) 8.639 6.462 ( 5.162 0.000 1.777) 5.459 7.527 ( -5.939 -0.000 0.157) 5.941 7.553 ( -17.217 -0.000 14.584) 22.564 7.923 ( -11.479 -0.000 15.588) 19.359 8.685 ( 5.488 0.000 0.645) 5.526 8.939 ( -6.135 -0.000 -10.901) 12.509 8.987 ( -5.027 -0.000 10.285) 11.448 10.004 ( 9.652 0.000 13.805) 16.845 10.650 ( 20.847 0.000 -10.276) 23.242 11.234 ( 17.144 0.000 13.014) 21.524 11.423 ( 14.789 0.000 -13.527) 20.042 12.033 ( 2.719 0.000 2.537) 3.718 12.206 ( -16.058 -0.000 10.891) 19.403 12.297 ( -4.234 -0.000 -4.595) 6.248 13.108 ( 5.661 0.000 -16.128) 17.092 17.055 ( -9.888 -0.000 -10.351) 14.315 17.889 ( 5.920 0.000 3.777) 7.023 18.377 ( -4.724 -0.000 5.245) 7.059 18.688 ( -11.844 -0.000 5.315) 12.982 20.448 ( 1.162 0.000 -24.443) 24.470 21.829 ( 4.480 0.000 15.247) 15.892 23.077 ( 8.139 0.000 5.445) 9.792 23.460 ( 8.249 0.000 -1.598) 8.403 ======================= Grid point 440 (217/361) ======================= q-point: (-0.70 0.20 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.397 ( -2.046 1.618 -5.244) 5.857 2.758 ( -8.604 3.941 3.035) 9.938 3.111 ( -3.564 -1.002 -5.802) 6.882 3.218 ( -2.277 -4.319 4.410) 6.579 3.646 ( 2.773 -1.001 -8.160) 8.676 3.706 ( -3.740 1.470 8.528) 9.427 4.434 ( 1.632 4.155 3.251) 5.522 4.488 ( 3.468 -0.661 2.752) 4.476 4.772 ( -13.827 1.702 4.569) 14.662 4.916 ( -6.845 -9.263 4.462) 12.351 5.435 ( -9.249 -0.926 1.693) 9.448 5.492 ( -4.898 -0.741 0.913) 5.037 6.327 ( 0.338 0.630 -6.690) 6.728 6.539 ( 2.854 -2.051 -0.371) 3.534 7.344 ( -23.106 2.104 1.786) 23.270 7.442 ( -6.927 3.403 2.325) 8.060 7.986 ( -9.585 -2.240 16.758) 19.435 8.703 ( 1.582 1.474 -7.232) 7.549 8.871 ( 3.576 -2.122 3.499) 5.434 9.028 ( -7.974 -2.341 10.030) 13.026 10.263 ( 8.303 0.944 9.056) 12.322 10.747 ( 17.930 14.524 -7.558) 24.281 11.426 ( 9.655 3.501 -10.787) 14.894 11.517 ( 6.895 -5.512 -0.773) 8.861 12.034 ( -12.377 1.007 5.167) 13.450 12.190 ( -5.091 -3.280 -2.878) 6.706 12.294 ( 8.700 -2.753 13.629) 16.402 13.024 ( 9.359 -4.837 -18.448) 21.244 16.838 ( -8.462 0.030 -4.034) 9.374 17.972 ( 2.456 -1.604 -2.009) 3.556 18.433 ( 2.537 0.947 8.097) 8.538 18.677 ( 0.058 -1.281 5.732) 5.873 20.155 ( -1.687 4.289 -21.409) 21.900 21.983 ( -6.026 -5.325 8.865) 11.969 23.260 ( 8.727 4.441 6.592) 11.804 23.566 ( 7.237 -3.073 0.402) 7.873 ======================= Grid point 441 (218/361) ======================= q-point: (-0.60 0.20 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.284 ( -7.938 6.254 3.354) 10.648 2.601 ( -12.082 9.896 4.003) 16.123 3.064 ( -1.753 -8.380 -3.006) 9.074 3.297 ( 3.083 -5.790 0.506) 6.579 3.578 ( -2.296 -3.272 -5.219) 6.574 3.742 ( -7.326 -0.258 11.401) 13.554 4.228 ( -12.593 10.251 -1.440) 16.302 4.565 ( 0.264 -0.154 0.385) 0.492 4.812 ( 0.435 -9.267 7.392) 11.862 5.040 ( 1.900 -4.480 8.127) 9.472 5.370 ( -7.561 -3.418 5.342) 9.869 5.482 ( 0.152 -0.799 2.041) 2.197 6.246 ( -3.437 -0.665 -3.072) 4.657 6.542 ( -3.877 -4.248 -4.767) 7.470 6.980 ( -24.049 -0.328 -2.453) 24.176 7.341 ( -6.299 4.274 1.575) 7.773 8.068 ( -7.563 -0.938 15.005) 16.830 8.626 ( -1.113 0.860 -4.727) 4.932 9.026 ( 0.999 -2.796 7.340) 7.917 9.059 ( -3.373 -3.306 9.082) 10.237 10.396 ( 7.295 8.440 0.443) 11.165 10.734 ( 11.154 19.645 -1.717) 22.656 11.359 ( 4.463 3.744 -11.375) 12.780 11.570 ( 3.245 -3.605 -5.599) 7.408 11.905 ( -13.549 2.477 7.382) 15.627 12.143 ( -2.911 -6.954 -3.151) 8.171 12.609 ( 11.490 1.033 7.790) 13.920 13.051 ( 12.521 -13.818 -15.458) 24.221 16.761 ( -3.189 -1.724 4.697) 5.933 17.943 ( 0.722 -4.272 -9.955) 10.857 18.575 ( 5.586 5.157 8.174) 11.163 18.837 ( 11.938 0.163 5.905) 13.320 19.848 ( -5.119 3.796 -16.026) 17.247 21.982 ( -13.672 -9.193 4.542) 17.089 23.345 ( 6.289 10.173 1.676) 12.077 23.732 ( 4.914 -7.903 3.500) 9.942 ======================= Grid point 442 (219/361) ======================= q-point: (-0.50 0.20 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.161 ( -11.632 8.924 10.854) 18.241 2.345 ( -15.322 18.829 7.281) 25.344 3.107 ( -3.748 -12.057 -0.401) 12.632 3.405 ( 6.056 -5.697 -2.481) 8.677 3.546 ( -3.104 -3.783 0.848) 4.966 3.745 ( -14.348 -11.164 5.278) 18.931 4.033 ( 1.947 14.505 2.531) 14.853 4.550 ( -3.033 -2.085 0.337) 3.696 4.983 ( -1.746 -10.761 6.011) 12.449 5.197 ( 2.888 0.551 9.770) 10.203 5.431 ( -2.048 -6.064 9.220) 11.224 5.550 ( 4.572 -0.882 1.964) 5.054 6.170 ( -12.618 -2.755 4.004) 13.522 6.352 ( -14.991 -9.117 -9.540) 19.971 6.754 ( -6.238 -2.204 -3.025) 7.274 7.236 ( -6.490 3.396 1.772) 7.536 8.143 ( -6.090 -0.114 13.286) 14.616 8.530 ( -5.802 2.667 -0.804) 6.436 9.060 ( -11.538 -9.883 7.134) 16.783 9.230 ( 7.675 2.221 6.797) 10.490 10.292 ( 5.316 22.480 -8.917) 24.761 10.713 ( 5.368 13.245 3.581) 14.733 11.238 ( 2.231 3.019 -11.570) 12.164 11.577 ( 4.558 -0.528 -6.729) 8.144 11.813 ( -10.024 1.833 9.505) 13.935 12.146 ( 0.102 -5.707 -2.771) 6.345 12.721 ( 5.825 4.787 -2.105) 7.828 13.221 ( 10.757 -17.468 -10.561) 23.074 16.907 ( 4.241 -5.880 12.841) 14.746 17.863 ( 1.932 -7.480 -14.432) 16.369 18.639 ( 5.075 11.502 2.011) 12.732 19.103 ( 17.214 1.982 4.360) 17.868 19.609 ( -5.020 1.234 -7.265) 8.916 21.900 ( -18.397 -12.777 3.714) 22.705 23.324 ( 4.805 10.473 -1.942) 11.686 23.859 ( -0.836 -7.105 0.085) 7.154 ======================= Grid point 443 (220/361) ======================= q-point: (-0.40 0.20 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.057 ( -13.442 16.376 12.126) 24.411 2.093 ( -11.441 12.897 16.069) 23.568 3.114 ( -8.075 -8.844 -1.944) 12.132 3.468 ( -2.602 -6.252 0.717) 6.810 3.578 ( -1.073 -2.024 5.338) 5.809 3.745 ( -1.606 -16.641 -4.301) 17.263 4.050 ( 8.445 13.552 5.656) 16.940 4.549 ( -3.486 -5.176 1.331) 6.381 5.067 ( -2.416 -6.585 0.989) 7.083 5.346 ( -0.088 2.450 14.414) 14.621 5.595 ( -4.223 -7.583 11.302) 14.250 5.650 ( 6.313 -2.266 1.590) 6.893 5.993 ( -16.929 -7.862 1.375) 18.716 6.283 ( -4.142 -10.762 2.313) 11.761 6.680 ( -2.133 -2.612 -5.781) 6.693 7.151 ( -7.036 1.656 3.220) 7.913 8.215 ( -4.751 -0.426 11.586) 12.529 8.425 ( -8.232 3.022 5.203) 10.197 9.051 ( -14.459 -11.089 6.009) 19.187 9.341 ( 5.761 6.803 1.716) 9.078 10.006 ( 1.771 24.759 -10.060) 26.783 10.718 ( 4.744 10.996 2.705) 12.277 11.106 ( 3.685 3.606 -12.786) 13.787 11.484 ( -2.806 4.947 -8.613) 10.321 11.848 ( -1.358 -0.587 9.287) 9.404 12.190 ( 3.239 -2.344 1.060) 4.136 12.690 ( 1.348 5.705 -2.679) 6.445 13.345 ( 5.779 -15.378 -12.799) 20.825 17.213 ( 8.130 -7.122 9.950) 14.691 17.842 ( 4.321 -13.963 -9.411) 17.383 18.583 ( 5.615 12.135 -4.020) 13.962 19.265 ( -1.205 -3.290 -1.196) 3.702 19.599 ( 15.541 9.524 3.835) 18.626 21.799 ( -20.969 -16.147 4.127) 26.785 23.265 ( 4.248 8.388 -4.220) 10.306 23.808 ( -7.377 -2.226 -6.294) 9.949 ======================= Grid point 444 (221/361) ======================= q-point: (-0.30 0.20 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.926 ( -3.914 13.726 12.749) 19.138 2.114 ( -8.716 4.990 22.804) 24.918 3.001 ( -9.706 -5.770 -5.159) 12.414 3.498 ( -1.776 -8.252 -2.557) 8.820 3.665 ( 0.542 -1.122 7.728) 7.828 3.857 ( 4.107 -16.038 -6.795) 17.896 4.110 ( 6.661 11.715 4.292) 14.143 4.542 ( -3.498 -5.006 -3.201) 6.895 5.105 ( 2.159 -0.700 2.496) 3.373 5.453 ( -6.023 3.632 15.135) 16.689 5.615 ( -14.924 -6.282 11.217) 19.698 5.873 ( 9.892 -7.379 5.475) 13.501 5.983 ( 1.441 -5.726 2.395) 6.372 6.410 ( -5.626 -14.968 9.664) 18.684 6.591 ( -1.787 -2.201 -7.030) 7.580 7.080 ( -10.128 -0.231 5.918) 11.733 8.289 ( -2.940 1.449 10.754) 11.243 8.401 ( -7.822 -1.129 11.067) 13.599 8.996 ( -14.119 -8.415 3.647) 16.836 9.289 ( 2.083 12.488 -4.373) 13.394 9.743 ( 1.092 17.504 -4.863) 18.200 10.689 ( 4.368 14.776 -0.534) 15.417 10.992 ( 4.886 0.909 -13.358) 14.253 11.246 ( -5.541 6.996 -10.732) 13.958 11.948 ( -0.081 0.117 8.130) 8.131 12.302 ( 6.899 1.384 4.527) 8.367 12.611 ( -2.031 5.534 -1.212) 6.018 13.364 ( 2.645 -13.051 -14.301) 19.541 17.389 ( 7.729 -2.973 -4.547) 9.447 18.007 ( -0.657 -16.577 2.976) 16.855 18.568 ( 12.301 2.193 -5.178) 13.525 19.172 ( -10.066 -2.677 -2.423) 10.694 19.853 ( 23.407 14.911 8.201) 28.939 21.699 ( -21.057 -18.105 2.187) 27.856 23.203 ( 4.192 5.631 -5.695) 9.039 23.567 ( -10.885 4.449 -9.770) 15.288 ======================= Grid point 445 (222/361) ======================= q-point: (-0.20 0.20 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.013 ( 5.856 5.415 12.991) 15.244 2.300 ( -2.284 -0.764 24.584) 24.702 2.875 ( -4.137 -4.636 -6.554) 9.031 3.474 ( -3.407 -9.807 -9.004) 13.742 3.764 ( -0.953 -2.136 4.582) 5.145 3.928 ( 1.096 -10.434 -7.692) 13.009 4.125 ( 5.200 8.690 0.685) 10.150 4.462 ( -1.400 -0.150 -8.086) 8.207 5.206 ( 2.326 0.903 8.582) 8.937 5.490 ( -6.337 5.947 13.573) 16.117 5.628 ( -8.213 -0.184 13.712) 15.985 6.074 ( 1.603 -4.317 2.706) 5.341 6.148 ( 8.059 -8.204 2.863) 11.851 6.425 ( -3.834 -4.468 -6.919) 9.085 6.700 ( -3.114 -15.992 15.277) 22.335 7.036 ( -12.830 -5.313 11.400) 17.967 8.359 ( -2.281 5.277 12.070) 13.369 8.442 ( -9.044 -3.538 9.569) 13.634 8.894 ( -5.697 -0.160 -2.886) 6.389 9.174 ( -2.214 5.741 1.955) 6.456 9.614 ( 2.957 9.759 -1.761) 10.347 10.556 ( 1.128 18.876 -3.216) 19.182 10.827 ( -4.725 4.376 -12.990) 14.499 11.094 ( 10.077 0.474 -11.703) 15.451 12.029 ( -1.079 0.794 7.892) 8.005 12.422 ( 4.202 4.022 4.401) 7.294 12.522 ( -1.084 4.493 -1.347) 4.815 13.335 ( 1.489 -10.782 -12.698) 16.725 17.450 ( 8.167 -2.317 -5.993) 10.391 18.054 ( -6.335 -5.687 -1.896) 8.722 18.717 ( 2.370 -8.129 -2.265) 8.765 19.048 ( -1.021 -0.292 -1.979) 2.246 20.147 ( 18.280 11.819 13.163) 25.439 21.574 ( -16.495 -15.142 -4.780) 22.896 23.136 ( 0.397 4.943 -6.117) 7.875 23.281 ( -4.312 6.209 -7.672) 10.770 ======================= Grid point 446 (223/361) ======================= q-point: (-0.10 0.20 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.258 ( 10.028 -0.275 12.253) 15.836 2.585 ( 2.328 -3.659 16.554) 17.113 2.845 ( 3.967 -3.703 -2.052) 5.802 3.387 ( -4.299 -10.096 -10.214) 14.992 3.719 ( -3.492 -1.127 -9.031) 9.748 3.920 ( -4.912 -4.374 -1.044) 6.660 4.123 ( 5.050 4.746 -3.602) 7.810 4.348 ( 1.651 4.771 -5.816) 7.702 5.314 ( -4.515 2.534 13.067) 14.055 5.495 ( -6.664 5.030 11.404) 14.133 5.686 ( -1.696 3.017 7.984) 8.702 6.041 ( -4.942 1.167 -5.061) 7.169 6.319 ( 5.496 -4.291 -1.615) 7.157 6.389 ( -0.118 -4.897 -1.877) 5.246 6.973 ( -6.566 -8.216 23.166) 25.442 7.152 ( -8.688 -22.049 14.414) 27.738 8.341 ( -11.252 11.468 10.421) 19.150 8.463 ( -1.727 -2.954 5.111) 6.151 8.823 ( 0.519 1.308 -1.719) 2.221 9.186 ( -1.518 0.904 9.396) 9.561 9.631 ( 7.320 -0.836 -1.275) 7.477 10.293 ( -10.388 14.424 -4.298) 18.287 10.639 ( 9.663 10.619 -10.145) 17.580 11.153 ( 15.023 -2.693 -11.985) 19.405 12.083 ( -2.188 2.316 6.898) 7.598 12.397 ( -7.950 0.241 3.433) 8.663 12.515 ( 6.748 6.405 -2.620) 9.665 13.308 ( 1.801 -7.583 -9.625) 12.385 17.525 ( 7.633 -2.000 -3.121) 8.485 17.924 ( -6.028 -0.166 -9.942) 11.628 18.624 ( -14.334 -1.728 1.277) 14.495 19.113 ( 2.175 -1.669 0.987) 2.914 20.461 ( 10.077 -0.990 14.885) 18.002 21.404 ( -4.231 -3.359 -12.355) 13.485 22.976 ( -3.862 6.434 -2.744) 7.991 23.220 ( 6.835 0.749 -5.664) 8.908 ======================= Grid point 450 (224/361) ======================= q-point: ( 0.30 -0.70 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.349 ( -1.901 -0.000 -0.003) 1.901 2.691 ( -9.720 -0.000 4.307) 10.632 2.995 ( -3.863 -0.000 -3.015) 4.900 3.224 ( -0.295 -0.000 2.721) 2.736 3.544 ( -1.022 -0.000 -7.056) 7.129 3.728 ( -11.891 -0.000 9.704) 15.348 4.440 ( -0.549 -0.000 -1.969) 2.044 4.480 ( -12.661 -0.000 0.091) 12.661 4.702 ( 3.092 0.000 8.228) 8.790 5.010 ( 2.068 0.000 12.987) 13.150 5.336 ( -9.039 -0.000 4.962) 10.312 5.478 ( 1.084 0.000 1.847) 2.141 6.240 ( -2.300 -0.000 -5.923) 6.354 6.502 ( -6.131 -0.000 -3.176) 6.905 6.979 ( -26.721 -0.000 -0.864) 26.735 7.379 ( -4.233 -0.000 -2.783) 5.066 8.060 ( -9.488 -0.000 18.749) 21.013 8.623 ( 1.483 0.000 -8.538) 8.666 9.007 ( -11.894 -0.000 11.063) 16.244 9.034 ( 9.074 0.000 7.557) 11.809 10.459 ( 7.562 0.000 4.252) 8.675 10.948 ( 14.165 0.000 -7.589) 16.070 11.460 ( -8.068 -0.000 0.265) 8.073 11.461 ( 13.263 0.000 -14.938) 19.977 11.932 ( -12.264 -0.000 6.641) 13.947 12.065 ( -4.618 -0.000 -1.129) 4.754 12.619 ( 13.661 0.000 11.674) 17.969 12.920 ( 11.539 0.000 -19.736) 22.862 16.745 ( -4.001 -0.000 3.920) 5.602 17.905 ( 0.887 0.000 -10.829) 10.865 18.622 ( 5.883 0.000 11.078) 12.543 18.838 ( 12.856 0.000 6.289) 14.312 19.881 ( -5.476 -0.000 -19.141) 19.909 21.900 ( -13.558 -0.000 5.133) 14.497 23.475 ( 4.494 0.000 8.109) 9.271 23.622 ( 5.827 0.000 -2.157) 6.214 ======================= Grid point 452 (225/361) ======================= q-point: (-0.60 0.30 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.313 ( -5.760 6.930 7.075) 11.457 2.606 ( -7.906 7.826 7.246) 13.276 2.938 ( -5.070 -4.066 0.455) 6.515 3.263 ( -3.102 -8.468 0.079) 9.019 3.484 ( 1.493 -2.383 -5.441) 6.125 3.614 ( -14.354 -3.273 3.495) 15.132 4.305 ( 1.494 14.079 2.466) 14.371 4.494 ( -4.691 -5.937 3.399) 8.295 4.830 ( -0.490 -4.790 6.806) 8.337 5.183 ( -5.711 -1.786 18.561) 19.501 5.348 ( 0.314 -2.274 7.000) 7.367 5.552 ( 6.021 0.365 1.770) 6.286 6.139 ( -6.804 -0.850 -2.143) 7.184 6.232 ( -23.902 -3.855 -5.728) 24.879 6.728 ( -7.727 -0.767 -2.076) 8.038 7.278 ( -3.204 1.253 -4.052) 5.315 8.139 ( -9.804 -0.015 17.146) 19.751 8.546 ( -0.881 -0.460 -6.197) 6.276 8.962 ( -13.990 -1.928 10.951) 17.870 9.256 ( 9.190 0.718 8.068) 12.250 10.540 ( 7.270 6.199 -5.178) 10.867 10.960 ( 5.842 10.830 -4.564) 13.124 11.279 ( -8.638 3.382 -2.845) 9.703 11.529 ( 14.094 -5.385 -13.062) 19.956 11.850 ( -10.519 2.020 7.864) 13.288 12.058 ( -0.357 -3.428 2.480) 4.246 12.805 ( 8.558 5.701 -5.619) 11.718 12.956 ( 10.064 -11.948 -6.314) 16.849 16.838 ( 2.857 -1.983 11.947) 12.443 17.770 ( 1.483 -2.796 -16.289) 16.593 18.794 ( 5.006 5.193 7.295) 10.259 19.123 ( 15.970 0.372 3.579) 16.370 19.614 ( -2.108 -0.228 -12.488) 12.667 21.752 ( -17.944 -4.153 4.407) 18.938 23.509 ( 1.143 10.110 1.348) 10.263 23.712 ( 1.433 -9.023 -1.220) 9.217 ======================= Grid point 453 (226/361) ======================= q-point: (-0.50 0.30 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.240 ( -8.977 10.431 11.634) 18.021 2.453 ( -9.834 20.957 9.169) 24.899 2.939 ( -6.302 -10.321 0.506) 12.103 3.264 ( -11.143 -16.747 0.172) 20.117 3.498 ( 4.755 -6.182 -6.288) 10.019 3.576 ( -0.801 -2.331 3.696) 4.442 4.286 ( 8.297 9.635 -0.866) 12.745 4.499 ( -7.848 1.152 8.760) 11.817 4.942 ( -0.799 -5.909 6.748) 9.005 5.337 ( -10.305 -5.062 21.426) 24.308 5.497 ( 2.390 -1.820 8.648) 9.155 5.649 ( 5.224 1.490 1.287) 5.583 5.876 ( -18.704 -5.386 0.945) 19.487 6.111 ( -5.221 -7.926 0.090) 9.492 6.644 ( -2.278 -1.482 -4.518) 5.273 7.185 ( -2.214 1.716 -3.320) 4.344 8.190 ( -9.947 -1.001 14.427) 17.553 8.467 ( -3.390 0.497 -1.467) 3.727 8.916 ( -14.930 -4.169 10.691) 18.831 9.434 ( 6.953 3.686 5.669) 9.699 10.384 ( 3.406 16.562 -16.496) 23.623 10.884 ( 1.977 8.379 -0.629) 8.632 11.138 ( -5.612 0.025 -2.740) 6.245 11.572 ( 10.727 3.735 -14.909) 18.743 11.824 ( -5.190 -1.608 8.950) 10.470 12.159 ( 4.492 -1.164 6.393) 7.900 12.768 ( 4.602 3.432 -7.687) 9.594 13.093 ( 2.977 -12.212 -5.577) 13.752 17.114 ( 8.314 -3.995 15.122) 17.713 17.647 ( 3.046 -7.825 -15.810) 17.902 18.798 ( 1.966 11.724 -2.674) 12.185 19.180 ( -6.493 -6.246 -4.260) 9.966 19.726 ( 25.231 4.888 2.901) 25.863 21.595 ( -20.054 -7.405 5.140) 21.986 23.419 ( 0.008 8.980 -2.691) 9.374 23.728 ( -4.209 -6.382 -5.059) 9.167 ======================= Grid point 454 (227/361) ======================= q-point: (-0.40 0.30 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.150 ( -9.874 11.228 11.565) 18.902 2.293 ( -5.030 15.694 13.315) 21.187 2.888 ( -10.107 -7.064 -2.337) 12.550 3.299 ( -5.107 -15.207 -1.331) 16.096 3.572 ( 6.342 -9.696 -6.684) 13.375 3.664 ( -0.021 -3.910 6.460) 7.551 4.321 ( 11.585 9.147 -3.971) 15.286 4.462 ( -8.621 -1.433 4.785) 9.964 5.076 ( 2.141 -2.066 8.345) 8.859 5.454 ( -15.086 -4.442 22.163) 27.176 5.574 ( -3.969 1.957 10.130) 11.054 5.756 ( 4.749 -5.074 4.956) 8.536 5.879 ( 2.081 -5.643 4.350) 7.422 6.159 ( -6.194 -12.953 5.604) 15.413 6.562 ( -2.092 -1.312 -6.576) 7.024 7.103 ( -3.404 2.269 -1.363) 4.313 8.236 ( -8.530 -3.566 12.508) 15.554 8.429 ( -3.810 0.849 4.852) 6.227 8.872 ( -14.672 -4.813 9.997) 18.395 9.493 ( 4.076 9.472 0.393) 10.319 10.046 ( -0.445 16.154 -16.193) 22.877 10.860 ( 4.975 5.152 -2.177) 7.485 11.027 ( -4.197 2.257 -4.338) 6.444 11.407 ( 2.816 11.127 -15.122) 18.985 11.911 ( -0.810 -4.218 5.993) 7.373 12.345 ( 9.478 3.062 9.198) 13.557 12.695 ( -0.981 3.907 -3.705) 5.473 13.129 ( -0.744 -12.871 -8.676) 15.540 17.354 ( 8.029 -0.632 -1.412) 8.176 17.723 ( 5.125 -15.115 3.837) 16.415 18.643 ( 0.285 5.958 -9.085) 10.868 19.096 ( -7.666 -5.541 -2.166) 9.703 20.095 ( 28.793 11.846 5.879) 31.684 21.452 ( -19.706 -10.293 4.062) 22.600 23.307 ( -0.154 6.015 -4.730) 7.654 23.592 ( -7.593 -1.121 -9.070) 11.882 ======================= Grid point 455 (228/361) ======================= q-point: (-0.30 0.30 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.126 ( 0.450 7.605 11.356) 13.674 2.340 ( -2.087 5.466 17.737) 18.677 2.791 ( -4.449 -4.810 -3.679) 7.514 3.294 ( -5.499 -10.962 -6.917) 14.080 3.656 ( 4.360 -9.054 -7.039) 12.270 3.768 ( -3.495 -7.065 5.756) 9.760 4.299 ( 3.519 9.743 -3.189) 10.838 4.440 ( 3.547 -2.133 -5.429) 6.826 5.227 ( 2.123 1.333 11.839) 12.101 5.577 ( -6.951 2.472 19.326) 20.686 5.635 ( -2.744 2.131 13.382) 13.826 5.918 ( 0.675 -10.738 4.650) 11.721 6.046 ( 3.689 -4.666 6.776) 9.016 6.273 ( -5.952 -14.114 4.343) 15.921 6.487 ( -2.143 -5.566 -1.296) 6.103 7.021 ( -6.107 2.062 2.349) 6.860 8.308 ( -7.542 -5.437 11.633) 14.892 8.455 ( -4.065 0.511 8.920) 9.816 8.828 ( -11.822 -3.980 7.113) 14.359 9.389 ( 2.807 14.801 -5.343) 15.984 9.786 ( -0.542 8.828 -7.929) 11.878 10.825 ( -7.587 10.813 1.063) 13.252 10.890 ( 6.670 2.173 -11.217) 13.230 11.181 ( 7.712 10.406 -15.792) 20.424 11.996 ( -2.090 -4.347 5.768) 7.519 12.521 ( 2.534 6.626 7.495) 10.320 12.604 ( 1.276 4.669 -0.860) 4.916 13.122 ( -0.506 -12.871 -9.040) 15.737 17.411 ( 7.565 -1.885 -5.307) 9.431 17.956 ( -0.312 -6.145 6.666) 9.072 18.556 ( -0.108 -8.362 -7.387) 11.158 19.024 ( -1.703 -2.256 -3.141) 4.225 20.397 ( 17.307 15.711 10.008) 25.426 21.344 ( -10.492 -11.235 -1.485) 15.444 23.204 ( -0.761 3.199 -5.316) 6.251 23.367 ( -5.696 3.278 -9.510) 11.560 ======================= Grid point 456 (229/361) ======================= q-point: (-0.20 0.30 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.262 ( 2.359 1.308 12.717) 13.000 2.540 ( 6.397 -1.251 13.405) 14.906 2.794 ( 4.661 -2.026 -0.712) 5.132 3.207 ( -5.326 -9.918 -9.103) 14.477 3.661 ( 1.779 -4.613 -9.861) 11.031 3.801 ( -10.317 -8.732 3.994) 14.094 4.230 ( 5.049 6.141 -5.568) 9.706 4.428 ( 5.936 4.276 -6.530) 9.806 5.372 ( -0.912 3.107 13.691) 14.068 5.590 ( -9.422 6.165 11.986) 16.446 5.743 ( -0.765 3.205 7.353) 8.057 6.042 ( -3.561 -2.570 -0.816) 4.467 6.170 ( 2.599 -8.813 2.967) 9.655 6.325 ( 1.141 -5.495 3.003) 6.366 6.670 ( -2.450 -19.902 13.123) 23.964 6.982 ( -7.382 -1.605 9.789) 12.365 8.376 ( -8.741 -4.529 10.034) 14.057 8.483 ( -5.193 2.784 9.050) 10.799 8.789 ( -6.417 -3.236 2.886) 7.744 9.291 ( 4.175 9.100 0.703) 10.037 9.668 ( 2.197 3.993 -4.659) 6.517 10.520 ( -15.344 11.975 -4.693) 20.021 10.863 ( 13.325 12.981 -6.627) 19.748 11.125 ( 15.005 0.575 -14.133) 20.621 12.068 ( -3.302 -4.024 6.550) 8.366 12.431 ( -9.342 3.265 1.876) 10.073 12.647 ( 5.401 7.756 0.235) 9.454 13.152 ( 3.443 -9.406 -6.025) 11.689 17.491 ( 6.689 -1.704 -0.927) 6.965 17.939 ( -4.205 1.788 -5.314) 7.009 18.533 ( -9.362 -8.690 -1.215) 12.831 19.062 ( 6.167 -3.922 -1.733) 7.512 20.492 ( -6.802 4.844 9.981) 13.014 21.367 ( 12.175 -0.846 -5.201) 13.267 23.073 ( -4.383 4.211 -4.702) 7.685 23.236 ( 3.420 1.085 -6.361) 7.303 ======================= Grid point 457 (230/361) ======================= q-point: (-0.10 0.30 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.415 ( -3.370 -5.460 10.484) 12.291 2.775 ( 13.820 2.638 -0.469) 14.078 2.950 ( 8.623 -3.583 7.292) 11.848 3.152 ( -2.078 -10.506 -4.815) 11.742 3.574 ( -0.730 0.688 -8.018) 8.081 3.737 ( -10.129 -7.547 -1.558) 12.727 4.194 ( 6.938 6.284 -6.757) 11.544 4.405 ( 3.982 4.407 -0.826) 5.997 5.416 ( -10.942 8.796 11.881) 18.392 5.505 ( -11.799 1.080 6.413) 13.473 5.727 ( -3.018 2.107 -0.194) 3.686 5.911 ( -6.080 2.064 -4.600) 7.898 6.313 ( 2.679 -7.660 0.250) 8.119 6.408 ( 4.077 4.421 1.131) 6.120 6.962 ( -4.383 -24.721 10.051) 27.044 7.143 ( -2.506 -6.547 21.941) 23.033 8.324 ( -11.421 5.114 5.894) 13.833 8.520 ( -3.750 -0.752 9.522) 10.261 8.788 ( -3.640 -3.856 3.783) 6.513 9.346 ( 4.591 3.850 4.601) 7.555 9.689 ( 8.186 -3.800 -3.605) 9.718 10.153 ( -12.284 11.352 -3.644) 17.118 10.915 ( 18.511 13.974 -1.068) 23.218 11.197 ( 16.402 -2.861 -13.681) 21.549 12.118 ( -4.131 -1.265 6.037) 7.423 12.303 ( -10.448 -0.140 2.853) 10.831 12.602 ( 0.255 6.213 -2.955) 6.884 13.217 ( 6.473 -3.122 -5.476) 9.036 17.567 ( 0.623 -0.473 -2.113) 2.254 17.749 ( -2.163 2.513 -9.525) 10.086 18.452 ( -9.354 -2.487 2.793) 10.074 19.109 ( -5.048 1.332 2.677) 5.867 20.435 ( -9.956 -13.522 -3.022) 17.062 21.541 ( 21.548 12.227 2.000) 24.856 22.958 ( -0.932 3.284 -2.158) 4.039 23.254 ( 6.731 -1.414 -3.734) 7.826 ======================= Grid point 462 (231/361) ======================= q-point: ( 0.40 -0.60 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.367 ( -6.470 -0.000 8.942) 11.037 2.682 ( -0.221 -0.000 8.379) 8.382 2.872 ( -8.689 -0.000 4.858) 9.955 3.006 ( -19.351 -0.000 -2.712) 19.540 3.444 ( 5.411 0.000 -7.644) 9.366 3.559 ( -0.133 -0.000 3.979) 3.981 4.344 ( -0.840 -0.000 -2.441) 2.582 4.554 ( 1.164 0.000 7.314) 7.406 4.892 ( -0.566 -0.000 10.263) 10.279 5.259 ( -14.822 -0.000 23.990) 28.199 5.495 ( 4.441 0.000 9.432) 10.425 5.671 ( 7.494 0.000 1.611) 7.665 5.822 ( -22.067 -0.000 0.126) 22.068 6.037 ( -5.733 -0.000 -0.865) 5.798 6.630 ( -2.464 -0.000 -3.973) 4.675 7.201 ( -0.019 -0.000 -5.960) 5.960 8.184 ( -12.211 -0.000 16.478) 20.509 8.462 ( -1.336 -0.000 -4.512) 4.705 8.886 ( -15.205 -0.000 12.077) 19.417 9.467 ( 7.226 0.000 7.119) 10.144 10.534 ( 5.128 0.000 -17.851) 18.573 10.976 ( 3.456 0.000 -9.344) 9.963 11.132 ( -14.868 -0.000 6.373) 16.176 11.592 ( 19.966 0.000 -15.557) 25.311 11.814 ( -9.720 -0.000 8.295) 12.778 12.148 ( 5.629 0.000 8.676) 10.342 12.806 ( 10.046 0.000 -16.086) 18.965 12.970 ( -1.910 -0.000 3.658) 4.127 17.079 ( 8.344 0.000 16.908) 18.855 17.578 ( 2.680 0.000 -18.253) 18.449 18.940 ( 2.548 0.000 3.544) 4.365 19.087 ( -10.344 -0.000 -10.971) 15.079 19.768 ( 28.892 0.000 2.357) 28.988 21.532 ( -19.707 -0.000 5.539) 20.471 23.544 ( -6.666 -0.000 0.767) 6.710 23.626 ( 1.938 0.000 -7.551) 7.796 ======================= Grid point 464 (232/361) ======================= q-point: (-0.50 0.40 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.328 ( -7.693 7.726 8.089) 13.576 2.605 ( -8.217 18.449 5.296) 20.879 2.767 ( -9.467 -5.613 0.882) 11.041 2.985 ( -3.548 -18.944 2.947) 19.498 3.455 ( 6.351 -3.300 -6.950) 9.977 3.620 ( -2.072 -1.469 6.417) 6.902 4.340 ( 3.303 -1.556 -1.905) 4.118 4.553 ( -0.794 5.410 -2.359) 5.955 5.059 ( 2.034 0.336 15.029) 15.170 5.357 ( -14.207 -4.723 23.761) 28.085 5.615 ( -5.642 1.582 13.623) 14.830 5.709 ( 0.241 -0.668 5.912) 5.955 5.804 ( 5.623 -2.523 3.021) 6.863 5.988 ( -6.150 -5.675 2.818) 8.830 6.545 ( -2.452 -0.576 -5.778) 6.303 7.138 ( 1.475 1.220 -6.040) 6.336 8.198 ( -13.187 -0.889 16.066) 20.804 8.421 ( -0.816 -0.899 -0.388) 1.275 8.826 ( -14.696 -0.939 12.292) 19.182 9.605 ( 4.453 3.182 4.618) 7.161 10.262 ( -0.527 7.114 -25.580) 26.556 10.912 ( 5.689 1.408 -9.116) 10.837 11.047 ( -10.121 0.223 6.292) 11.919 11.593 ( 10.547 8.404 -16.385) 21.221 11.818 ( -5.309 -5.418 7.197) 10.456 12.389 ( 12.014 1.541 11.279) 16.550 12.747 ( 4.181 1.904 -9.801) 10.824 12.951 ( -7.322 -6.236 -0.062) 9.618 17.380 ( 8.133 3.912 1.909) 9.224 17.500 ( 7.092 -9.908 1.633) 12.293 18.750 ( -10.697 4.919 -11.118) 16.194 18.998 ( -1.615 -4.551 -1.628) 5.096 20.243 ( 34.438 4.512 4.236) 34.990 21.333 ( -20.445 -3.347 4.980) 21.308 23.403 ( -6.128 4.251 -3.375) 8.186 23.549 ( -2.488 -2.852 -9.217) 9.964 ======================= Grid point 465 (233/361) ======================= q-point: (-0.40 0.40 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.275 ( -0.230 8.668 7.973) 11.780 2.472 ( -6.843 8.813 9.497) 14.652 2.710 ( -3.115 -4.570 -0.641) 5.568 3.095 ( -2.921 -11.143 -2.330) 11.752 3.516 ( 7.085 -5.967 -5.780) 10.918 3.659 ( -8.859 -5.224 7.578) 12.775 4.396 ( 2.555 -1.420 -1.663) 3.363 4.444 ( 6.617 5.217 -10.425) 13.404 5.253 ( 1.167 1.646 15.027) 15.162 5.554 ( -3.516 -3.791 25.025) 25.554 5.696 ( -3.071 2.309 12.348) 12.932 5.790 ( -2.078 -1.692 6.009) 6.580 5.961 ( 2.695 -4.980 7.935) 9.748 6.038 ( -4.479 -10.550 6.055) 12.962 6.437 ( -3.738 -1.442 -6.077) 7.279 7.071 ( 0.524 2.833 -4.727) 5.536 8.228 ( -12.961 -3.398 16.978) 21.628 8.442 ( -0.644 -1.285 3.605) 3.880 8.783 ( -12.751 -1.409 10.761) 16.744 9.619 ( 2.594 10.208 -2.453) 10.814 9.903 ( -2.147 4.432 -18.991) 19.620 10.904 ( 8.159 0.272 -10.375) 13.202 10.952 ( -8.170 4.213 3.880) 9.977 11.413 ( 8.054 13.818 -16.744) 23.155 11.891 ( -3.995 -7.281 5.759) 10.106 12.628 ( -1.061 5.257 2.856) 6.076 12.680 ( 7.620 3.760 3.785) 9.302 12.909 ( -4.199 -10.791 -3.455) 12.084 17.389 ( 6.847 -0.589 -5.388) 8.733 17.838 ( 7.518 -6.468 13.633) 16.859 18.462 ( -9.457 -2.540 -11.202) 14.879 18.981 ( 0.523 -2.202 -3.991) 4.588 20.662 ( 22.965 13.596 6.468) 27.460 21.170 ( -10.662 -8.871 0.294) 13.873 23.251 ( -5.019 2.008 -4.484) 7.024 23.399 ( -3.371 0.622 -10.054) 10.622 ======================= Grid point 466 (234/361) ======================= q-point: (-0.30 0.40 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.324 ( -2.653 6.046 10.405) 12.323 2.532 ( 7.458 -0.086 10.018) 12.490 2.764 ( 4.981 -2.286 1.543) 5.693 3.063 ( -2.212 -5.775 -7.237) 9.519 3.582 ( 5.141 -3.898 -6.172) 8.929 3.634 ( -15.273 -9.662 5.549) 18.906 4.320 ( 3.916 4.301 -7.937) 9.840 4.484 ( 10.624 1.484 -7.353) 13.005 5.402 ( -2.219 0.463 13.138) 13.332 5.712 ( -7.769 6.716 14.026) 17.384 5.773 ( -4.066 -0.693 3.794) 5.604 5.928 ( 3.642 -5.671 12.625) 14.311 6.095 ( -1.840 -2.251 2.815) 4.047 6.158 ( -0.218 -11.691 6.984) 13.620 6.420 ( -1.200 -8.765 7.364) 11.511 7.002 ( -1.141 2.829 -1.085) 3.238 8.289 ( -13.273 -4.844 17.676) 22.629 8.492 ( -2.008 -0.818 5.660) 6.061 8.748 ( -9.011 -1.425 6.991) 11.493 9.454 ( 2.443 8.860 -11.029) 14.356 9.735 ( -0.603 2.917 -4.935) 5.764 10.718 ( -11.501 10.475 -2.205) 15.712 10.992 ( 12.876 1.285 -5.663) 14.125 11.240 ( 12.570 12.069 -16.248) 23.826 11.964 ( -5.066 -7.165 6.746) 11.069 12.492 ( -10.109 3.493 0.922) 10.735 12.729 ( -2.337 -0.428 -2.402) 3.379 13.030 ( 10.229 -2.618 3.074) 10.997 17.470 ( 6.495 -0.699 1.591) 6.724 17.979 ( -3.202 2.529 -2.489) 4.780 18.348 ( -3.788 -11.005 -0.309) 11.643 18.992 ( 5.845 -3.576 -4.555) 8.228 20.608 ( -17.993 7.294 2.106) 19.529 21.366 ( 26.316 0.493 0.693) 26.329 23.121 ( -4.656 1.407 -4.255) 6.462 23.255 ( 0.101 0.952 -7.630) 7.690 ======================= Grid point 467 (235/361) ======================= q-point: (-0.20 -0.60 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.352 ( -9.027 -1.447 12.387) 15.395 2.820 ( 17.174 2.436 3.403) 17.676 2.894 ( 4.324 -4.574 5.187) 8.156 3.020 ( 4.731 -2.550 -6.252) 8.244 3.559 ( -6.501 -9.720 -4.635) 12.579 3.577 ( -5.173 -2.590 0.202) 5.789 4.274 ( 6.305 3.408 -6.522) 9.691 4.497 ( 6.923 5.267 -5.601) 10.347 5.470 ( -8.504 -2.154 8.162) 11.983 5.613 ( -12.534 9.422 4.848) 16.413 5.740 ( -5.809 -0.745 3.273) 6.709 5.946 ( -5.649 2.277 -1.370) 6.242 6.179 ( 2.520 -6.672 3.059) 7.760 6.429 ( 7.202 -7.037 9.752) 14.017 6.618 ( -0.734 -9.547 7.156) 11.954 7.042 ( 1.285 -4.292 11.413) 12.261 8.337 ( -13.169 -2.757 14.519) 19.794 8.520 ( -5.093 0.682 7.886) 9.412 8.733 ( -4.915 -2.151 4.758) 7.171 9.367 ( 3.353 -2.088 -5.347) 6.648 9.672 ( 2.831 3.089 -3.864) 5.700 10.412 ( -11.614 16.133 -0.956) 19.902 11.118 ( 16.541 4.233 -3.106) 17.354 11.181 ( 16.221 5.828 -14.780) 22.705 12.034 ( -6.893 -6.969 8.521) 12.988 12.336 ( -9.864 2.815 1.006) 10.307 12.646 ( -4.676 -2.010 -4.170) 6.580 13.211 ( 11.719 2.925 1.081) 12.127 17.574 ( 1.314 1.182 1.698) 2.451 17.778 ( -5.252 0.494 -10.090) 11.386 18.407 ( -2.671 -2.298 4.218) 5.496 19.086 ( 4.362 -3.972 -0.607) 5.930 20.281 ( -20.016 -4.100 -6.308) 21.384 21.736 ( 27.938 9.937 4.290) 29.962 23.006 ( -2.406 2.172 -3.442) 4.728 23.224 ( 3.765 -1.971 -3.275) 5.365 ======================= Grid point 468 (236/361) ======================= q-point: (-0.10 -0.60 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.383 ( -12.406 -5.797 12.385) 18.463 2.869 ( 2.101 2.556 -6.442) 7.242 3.041 ( 0.499 -8.912 1.754) 9.097 3.199 ( 15.634 1.891 2.832) 16.001 3.510 ( 0.096 -0.554 -5.163) 5.193 3.571 ( -0.115 -6.611 2.452) 7.052 4.276 ( 8.381 4.206 -4.913) 10.586 4.473 ( 1.112 3.763 -0.466) 3.951 5.300 ( -18.922 3.974 -2.184) 19.458 5.435 ( -11.609 2.805 4.101) 12.627 5.699 ( -5.428 2.871 3.473) 7.055 5.820 ( -7.191 5.026 -0.000) 8.773 6.285 ( 2.768 -6.050 -1.236) 6.767 6.555 ( 5.623 8.654 0.817) 10.353 6.820 ( -0.543 -21.534 7.579) 22.835 7.311 ( 2.359 -6.779 14.698) 16.357 8.284 ( -11.949 4.161 7.570) 14.745 8.549 ( -8.117 -1.706 12.151) 14.712 8.768 ( -3.339 -3.455 6.506) 8.088 9.400 ( 1.111 -2.328 -3.449) 4.307 9.696 ( 8.039 -7.330 -5.233) 12.072 10.164 ( -4.646 15.005 4.563) 16.358 11.219 ( 16.575 -2.491 -15.780) 23.020 11.306 ( 19.228 8.837 2.526) 21.312 12.087 ( -9.972 -6.256 10.109) 15.516 12.201 ( -6.934 2.756 0.176) 7.463 12.550 ( -4.787 -0.340 -2.810) 5.561 13.311 ( 11.287 6.885 -4.133) 13.852 17.358 ( -10.739 0.622 -15.303) 18.706 17.801 ( 4.520 1.411 7.021) 8.469 18.412 ( -1.197 2.603 2.267) 3.654 19.063 ( -11.447 4.960 3.718) 13.018 20.075 ( -5.048 -17.431 -13.979) 22.907 22.036 ( 20.355 15.177 8.000) 26.621 22.950 ( 1.628 0.257 -2.966) 3.393 23.307 ( 6.629 -2.757 1.179) 7.276 ======================= Grid point 474 (237/361) ======================= q-point: (-0.50 0.50 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.367 ( -0.878 0.000 5.901) 5.966 2.606 ( -10.657 0.000 2.268) 10.896 2.630 ( -3.066 -0.000 1.212) 3.297 2.970 ( 2.285 -0.000 3.673) 4.326 3.463 ( 7.157 -0.000 -4.428) 8.416 3.608 ( -10.565 -0.000 7.219) 12.796 4.380 ( 6.385 -0.000 -1.740) 6.618 4.492 ( 2.678 -0.000 -11.819) 12.119 5.273 ( 0.554 0.000 15.420) 15.430 5.505 ( -3.121 -0.000 25.298) 25.490 5.703 ( -2.679 -0.000 10.526) 10.861 5.822 ( -3.656 0.000 15.520) 15.945 5.888 ( 1.664 -0.000 1.568) 2.286 5.946 ( -1.702 -0.000 6.979) 7.184 6.425 ( -4.192 -0.000 -6.450) 7.692 7.099 ( 3.264 -0.000 -7.501) 8.181 8.197 ( -15.916 -0.000 19.563) 25.220 8.428 ( 0.988 -0.000 1.841) 2.090 8.772 ( -12.951 -0.000 11.395) 17.251 9.713 ( 2.445 0.000 3.045) 3.905 9.942 ( -2.741 -0.000 -27.882) 28.016 10.905 ( 9.891 -0.000 -10.021) 14.080 10.989 ( -8.974 -0.000 4.565) 10.068 11.574 ( 11.217 0.000 -21.328) 24.098 11.791 ( -8.161 -0.000 11.032) 13.723 12.689 ( 2.636 0.000 -9.663) 10.016 12.726 ( 14.369 0.000 11.657) 18.503 12.783 ( -15.090 -0.000 3.384) 15.464 17.386 ( 6.368 -0.000 -5.963) 8.724 17.773 ( 10.451 -0.000 16.050) 19.153 18.444 ( -13.520 -0.000 -11.926) 18.029 18.960 ( 1.924 -0.000 -4.429) 4.829 20.812 ( 36.893 -0.000 4.518) 37.169 21.065 ( -22.324 0.000 1.408) 22.369 23.269 ( -7.619 -0.000 -4.067) 8.636 23.402 ( -1.533 -0.000 -10.224) 10.339 ======================= Grid point 476 (238/361) ======================= q-point: (-0.40 0.50 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.457 ( -6.269 7.703 6.592) 11.920 2.529 ( 7.397 -0.390 8.688) 11.418 2.688 ( 3.394 -5.544 1.414) 6.653 3.015 ( 5.056 -0.478 -4.364) 6.696 3.499 ( -18.764 -4.603 5.783) 20.167 3.536 ( 6.314 -1.359 -2.240) 6.836 4.389 ( 5.818 3.462 -10.759) 12.712 4.472 ( 9.728 -2.296 -5.435) 11.377 5.402 ( -4.586 -0.105 11.186) 12.090 5.684 ( -6.992 -3.706 8.066) 11.299 5.854 ( -1.533 6.270 12.503) 14.071 5.914 ( 4.614 1.638 14.456) 15.263 5.976 ( -1.797 -7.008 7.883) 10.700 6.058 ( -0.527 -2.977 7.939) 8.496 6.324 ( -2.785 -2.628 2.143) 4.388 7.048 ( 3.267 1.747 -7.444) 8.315 8.224 ( -17.987 -2.135 23.342) 29.545 8.478 ( 0.660 -0.489 3.892) 3.978 8.732 ( -9.947 -0.467 8.512) 13.100 9.576 ( -1.739 4.244 -21.963) 22.437 9.761 ( 0.874 0.266 -0.814) 1.224 10.871 ( -6.805 6.443 -0.039) 9.371 10.974 ( 11.715 -2.403 -7.225) 13.972 11.439 ( 11.022 8.105 -19.007) 23.419 11.843 ( -6.924 -5.425 10.040) 13.348 12.556 ( -8.932 4.116 -1.405) 9.934 12.649 ( -8.975 -6.149 -2.551) 11.174 13.043 ( 13.865 1.632 9.253) 16.749 17.464 ( 6.631 -0.056 3.245) 7.383 18.015 ( -2.383 1.191 -0.380) 2.691 18.198 ( -1.443 -4.918 -0.159) 5.127 18.947 ( 4.959 -1.423 -6.165) 8.039 20.709 ( -23.629 3.332 -4.173) 24.225 21.375 ( 35.218 0.331 4.713) 35.534 23.133 ( -5.382 0.200 -3.429) 6.385 23.266 ( -1.463 0.328 -8.393) 8.526 ======================= Grid point 477 (239/361) ======================= q-point: (-0.30 -0.50 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.364 ( -13.857 2.300 11.516) 18.164 2.791 ( 2.924 -4.750 5.750) 8.010 2.863 ( 20.063 1.402 4.134) 20.533 3.047 ( 10.524 3.697 -6.441) 12.880 3.351 ( -15.725 -11.065 2.071) 19.340 3.568 ( 1.330 -0.061 -2.552) 2.878 4.336 ( 7.207 3.826 -8.174) 11.550 4.551 ( 8.720 0.306 -5.705) 10.425 5.417 ( -10.442 -3.018 6.966) 12.909 5.644 ( -11.087 -4.036 0.352) 11.804 5.804 ( -7.803 6.805 5.261) 11.613 6.012 ( -3.958 5.461 6.214) 9.171 6.073 ( 1.265 -6.424 1.906) 6.819 6.240 ( 3.573 -8.502 9.841) 13.487 6.562 ( 9.215 -2.291 16.555) 19.084 7.008 ( 3.681 0.114 -3.255) 4.916 8.272 ( -19.437 -3.497 24.226) 31.256 8.534 ( -1.158 0.712 5.917) 6.072 8.707 ( -6.236 -0.965 5.627) 8.455 9.320 ( -1.226 -2.155 -15.592) 15.788 9.744 ( 2.000 3.707 -2.143) 4.726 10.676 ( -9.190 12.990 0.935) 15.939 11.096 ( 16.044 -2.836 -10.561) 19.416 11.346 ( 13.710 8.275 -11.782) 19.881 11.913 ( -7.733 -5.922 10.646) 14.430 12.386 ( -10.361 2.975 1.129) 10.839 12.557 ( -6.858 -6.671 -4.067) 10.396 13.287 ( 12.823 4.312 5.429) 14.577 17.605 ( 2.586 2.191 5.721) 6.650 17.762 ( -9.026 -2.013 -12.045) 15.186 18.381 ( 4.958 -0.527 8.570) 9.915 18.999 ( 8.083 -4.793 -4.587) 10.457 20.263 ( -24.780 0.773 -10.722) 27.011 21.878 ( 32.803 5.877 5.015) 33.700 23.035 ( -3.359 1.140 -2.382) 4.272 23.190 ( 0.680 -1.779 -3.626) 4.096 ======================= Grid point 478 (240/361) ======================= q-point: (-0.20 -0.50 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.309 ( -16.752 -2.439 14.858) 22.524 2.831 ( -11.479 -6.529 0.011) 13.205 3.013 ( 8.722 4.879 -0.363) 10.001 3.229 ( 17.836 1.314 1.576) 17.954 3.392 ( 6.339 -9.102 -3.467) 11.621 3.541 ( -0.445 0.440 1.591) 1.710 4.330 ( 6.514 3.279 -3.602) 8.133 4.558 ( 4.357 4.126 -5.188) 7.932 5.308 ( -16.766 -1.707 1.316) 16.904 5.467 ( -12.083 -0.228 -1.898) 12.234 5.728 ( -6.292 0.574 2.998) 6.994 5.952 ( -6.289 9.672 7.438) 13.727 6.182 ( 3.631 -5.665 -0.037) 6.729 6.481 ( 1.774 -15.759 7.947) 17.739 6.727 ( 6.305 9.813 -0.032) 11.664 7.181 ( 8.694 -7.995 8.179) 14.367 8.291 ( -18.754 -2.458 18.427) 26.407 8.564 ( -5.092 3.079 9.730) 11.405 8.720 ( -3.975 -2.108 6.512) 7.915 9.235 ( 0.688 -11.451 -8.491) 14.272 9.710 ( 3.949 4.439 -4.454) 7.426 10.447 ( -7.838 15.927 3.578) 18.108 11.170 ( 15.474 -2.774 -17.610) 23.606 11.437 ( 17.411 5.299 -0.649) 18.211 11.974 ( -10.422 -5.300 12.222) 16.914 12.251 ( -6.860 2.601 0.512) 7.355 12.490 ( -5.331 -5.702 -2.137) 8.093 13.445 ( 12.576 7.311 0.191) 14.548 17.365 ( -11.537 0.204 -16.603) 20.219 17.822 ( 3.398 0.933 10.796) 11.357 18.487 ( 3.737 5.675 3.674) 7.724 19.096 ( -0.368 -1.783 1.329) 2.254 19.833 ( -15.137 -9.358 -16.701) 24.405 22.270 ( 25.787 11.005 4.804) 28.445 22.963 ( -1.070 1.439 -2.551) 3.118 23.248 ( 4.626 -3.871 3.302) 6.877 ======================= Grid point 479 (241/361) ======================= q-point: (-0.10 -0.50 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.277 ( -19.211 -5.152 15.435) 25.176 2.686 ( -15.113 -8.593 -1.025) 17.416 3.120 ( 9.027 2.665 0.966) 9.462 3.364 ( 3.477 2.467 -2.962) 5.191 3.433 ( 3.364 -4.105 -2.213) 5.750 3.708 ( 11.616 0.108 4.982) 12.640 4.380 ( 6.186 1.427 0.602) 6.376 4.488 ( -0.098 4.910 -3.642) 6.115 5.048 ( -17.278 3.195 -1.063) 17.603 5.328 ( -7.708 0.472 1.326) 7.836 5.644 ( -6.841 1.100 -1.592) 7.109 5.838 ( -7.271 12.336 5.586) 15.370 6.254 ( 1.861 -4.359 -1.538) 4.983 6.682 ( 3.430 2.179 -0.888) 4.159 6.780 ( 5.250 -11.501 7.191) 14.544 7.387 ( 1.980 -5.119 1.025) 5.584 8.219 ( -16.891 0.330 10.644) 19.968 8.584 ( -7.501 2.278 12.814) 15.022 8.785 ( -3.781 -2.860 9.760) 10.851 9.308 ( 3.127 -11.530 -4.304) 12.699 9.687 ( 5.373 -0.991 -5.436) 7.707 10.309 ( -2.477 11.032 6.339) 12.963 11.201 ( 14.425 -4.975 -17.687) 23.359 11.636 ( 15.367 4.221 -0.543) 15.945 11.983 ( -14.254 -4.077 10.619) 18.236 12.189 ( -0.977 1.742 3.543) 4.067 12.459 ( -2.962 -2.337 0.010) 3.773 13.503 ( 12.638 11.379 -6.084) 18.062 17.035 ( -10.167 -0.674 -12.842) 16.394 17.984 ( 3.382 2.252 11.241) 11.953 18.486 ( 3.237 7.815 -1.989) 8.689 18.948 ( -16.508 5.465 1.068) 17.422 19.722 ( 3.105 -19.774 -14.184) 24.533 22.483 ( 11.707 15.303 5.841) 20.133 22.934 ( 3.732 -1.996 -4.768) 6.376 23.447 ( 9.107 -1.901 8.793) 12.801 ======================= Grid point 486 (242/361) ======================= q-point: (-0.40 -0.40 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.394 ( -17.028 -0.000 10.434) 19.970 2.745 ( 4.356 0.000 5.438) 6.967 2.876 ( 22.731 0.000 5.631) 23.418 3.099 ( 16.291 0.000 -7.898) 18.105 3.231 ( -22.305 -0.000 3.153) 22.526 3.569 ( 1.122 0.000 -1.257) 1.685 4.384 ( 9.549 0.000 -10.769) 14.393 4.536 ( 7.384 0.000 -2.686) 7.857 5.388 ( -10.910 -0.000 6.408) 12.652 5.600 ( -11.392 -0.000 2.806) 11.733 5.882 ( -10.405 -0.000 -0.007) 10.405 5.983 ( 4.541 0.000 1.376) 4.745 6.111 ( -0.563 -0.000 9.856) 9.873 6.141 ( -1.922 -0.000 10.263) 10.442 6.532 ( 12.915 0.000 19.951) 23.766 7.016 ( 4.814 0.000 -8.897) 10.116 8.239 ( -22.181 -0.000 27.878) 35.625 8.541 ( 0.546 0.000 5.721) 5.747 8.698 ( -6.888 -0.000 6.120) 9.214 9.302 ( -3.088 -0.000 -19.187) 19.434 9.778 ( 2.148 0.000 -1.925) 2.884 10.810 ( -9.114 -0.000 2.467) 9.442 11.057 ( 16.704 0.000 -11.426) 20.238 11.425 ( 12.505 0.000 -15.255) 19.726 11.856 ( -7.665 -0.000 13.210) 15.272 12.446 ( -13.582 -0.000 4.910) 14.442 12.457 ( -4.457 -0.000 -7.177) 8.448 13.328 ( 12.587 0.000 6.562) 14.195 17.632 ( 5.114 0.000 10.603) 11.772 17.734 ( -12.299 -0.000 -16.013) 20.191 18.380 ( 8.291 0.000 10.955) 13.739 18.952 ( 8.099 0.000 -6.782) 10.563 20.274 ( -25.609 -0.000 -12.682) 28.577 21.931 ( 34.749 0.000 4.973) 35.103 23.046 ( -3.567 -0.000 -0.967) 3.696 23.172 ( -0.849 -0.000 -4.390) 4.472 ======================= Grid point 487 (243/361) ======================= q-point: (-0.30 -0.40 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.293 ( -18.604 0.121 15.515) 24.225 2.736 ( -17.366 -3.374 0.313) 17.694 3.085 ( 2.455 1.947 5.074) 5.964 3.241 ( 17.947 0.094 -4.174) 18.426 3.280 ( 19.106 -2.604 -0.632) 19.293 3.547 ( -0.649 0.127 0.458) 0.804 4.396 ( 9.083 3.386 -6.562) 11.706 4.586 ( 3.362 -0.461 -3.148) 4.629 5.277 ( -15.267 -1.213 4.521) 15.968 5.443 ( -12.390 -1.382 -1.117) 12.517 5.738 ( -8.459 0.650 0.805) 8.522 6.086 ( 6.337 -3.230 -0.191) 7.115 6.124 ( -4.670 8.105 9.056) 13.020 6.276 ( -1.446 -8.324 7.846) 11.530 6.888 ( 10.996 8.313 2.922) 14.091 7.038 ( 10.406 -7.967 0.746) 13.127 8.247 ( -23.919 -1.687 25.654) 35.116 8.619 ( -0.933 2.171 8.858) 9.168 8.694 ( -5.258 -0.777 7.253) 8.992 9.085 ( -2.542 -4.762 -12.942) 14.023 9.772 ( 3.931 2.044 -4.516) 6.326 10.673 ( -10.266 8.160 3.708) 13.628 11.124 ( 15.485 -2.134 -17.794) 23.685 11.484 ( 14.353 0.560 -4.952) 15.194 11.924 ( -7.754 -0.723 15.183) 17.064 12.294 ( -6.854 2.383 -1.989) 7.524 12.385 ( -6.199 -5.076 1.180) 8.099 13.539 ( 12.432 2.926 2.155) 12.952 17.367 ( -11.913 -0.003 -17.560) 21.220 17.833 ( 2.982 0.308 13.478) 13.807 18.587 ( 6.853 4.398 8.124) 11.503 19.025 ( 8.276 -4.206 -3.556) 9.941 19.744 ( -23.364 -1.816 -19.379) 30.409 22.403 ( 29.892 3.853 0.486) 30.143 23.000 ( -2.409 2.182 1.039) 3.412 23.182 ( 2.423 -3.011 4.211) 5.716 ======================= Grid point 488 (244/361) ======================= q-point: (-0.20 -0.40 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.228 ( -20.734 -0.069 17.422) 27.082 2.504 ( -21.804 -10.697 2.273) 24.393 3.171 ( 1.408 2.348 -2.353) 3.610 3.330 ( 3.785 -5.186 0.385) 6.432 3.472 ( 13.821 7.857 -2.079) 16.034 3.701 ( 13.478 -1.781 4.078) 14.194 4.425 ( 5.518 3.789 -0.309) 6.700 4.550 ( 0.411 1.213 -5.483) 5.630 5.091 ( -16.744 1.786 2.603) 17.039 5.317 ( -5.831 -1.126 0.565) 5.966 5.647 ( -6.811 -0.391 -0.149) 6.824 6.051 ( -5.835 11.098 6.358) 14.058 6.190 ( 3.267 -2.741 -0.569) 4.302 6.463 ( 3.603 -13.867 6.713) 15.822 6.871 ( 6.458 8.517 -4.741) 11.693 7.286 ( 8.624 -6.248 -1.703) 10.785 8.187 ( -23.575 -2.576 16.855) 29.095 8.661 ( -4.378 5.302 10.211) 12.311 8.744 ( -5.497 -1.611 12.507) 13.756 9.057 ( 2.284 -12.957 -5.011) 14.079 9.747 ( 5.299 4.004 -6.216) 9.097 10.504 ( -8.947 9.830 5.178) 14.265 11.125 ( 13.654 -3.457 -19.269) 23.868 11.653 ( 12.794 -1.669 -2.201) 13.088 11.973 ( -9.489 2.829 13.037) 16.371 12.197 ( -4.232 -1.068 1.913) 4.765 12.395 ( -1.335 -3.857 1.891) 4.498 13.667 ( 13.382 6.767 -3.553) 15.411 17.024 ( -10.136 -0.477 -13.657) 17.014 18.015 ( 2.317 1.219 12.779) 13.045 18.657 ( 5.215 11.130 0.463) 12.300 19.023 ( -15.715 2.939 -1.074) 16.023 19.391 ( 2.390 -17.166 -16.981) 24.264 22.673 ( 19.133 5.377 -4.029) 20.279 22.954 ( -2.136 4.606 1.253) 5.230 23.401 ( 9.814 -3.103 12.118) 15.900 ======================= Grid point 489 (245/361) ======================= q-point: (-0.10 -0.40 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.106 ( -23.757 -5.338 12.826) 27.521 2.388 ( -19.554 -9.699 5.499) 22.509 3.083 ( -9.714 -7.943 1.356) 12.621 3.482 ( 8.642 1.222 4.476) 9.809 3.519 ( 9.696 9.993 -4.402) 14.603 3.860 ( 0.269 1.278 3.180) 3.438 4.452 ( -2.818 2.492 6.559) 7.562 4.531 ( 10.500 2.873 -7.232) 13.070 4.889 ( -10.396 3.481 2.346) 11.211 5.305 ( 0.669 0.706 1.785) 2.033 5.522 ( -6.863 1.000 -4.481) 8.257 5.914 ( -6.763 13.413 3.841) 15.505 6.232 ( -0.114 -2.518 1.273) 2.823 6.720 ( 6.864 -6.184 2.043) 9.462 6.875 ( 4.877 -0.614 2.984) 5.750 7.303 ( -1.826 -2.129 -8.953) 9.382 8.059 ( -21.932 -4.809 11.431) 25.195 8.658 ( -6.053 4.673 8.697) 11.581 8.855 ( -4.078 -1.648 14.939) 15.573 9.209 ( 6.001 -16.175 -2.871) 17.489 9.712 ( 4.398 4.814 -4.115) 7.710 10.398 ( -5.034 5.322 4.679) 8.693 11.126 ( 12.587 -5.668 -18.254) 22.886 11.745 ( 3.014 -0.693 -3.716) 4.834 11.910 ( -11.467 3.717 8.167) 14.561 12.268 ( 3.397 -2.943 5.976) 7.477 12.427 ( 0.256 -2.081 -0.826) 2.253 13.702 ( 14.136 11.497 -9.224) 20.422 16.828 ( -4.415 -0.304 -1.688) 4.737 18.178 ( 3.035 1.554 10.853) 11.376 18.469 ( -7.615 6.527 -14.180) 17.368 18.817 ( -3.178 3.580 1.481) 5.011 19.509 ( 4.939 -15.866 -6.016) 17.673 22.749 ( 2.280 13.884 2.634) 14.315 22.916 ( 5.330 -2.152 -5.327) 7.837 23.711 ( 11.263 -0.024 10.939) 15.701 ======================= Grid point 497 (246/361) ======================= q-point: (-0.30 -0.30 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.252 ( -18.375 -0.000 20.563) 27.577 2.380 ( -27.163 -0.000 0.497) 27.168 3.197 ( -5.610 -0.000 -8.999) 10.605 3.272 ( 9.947 0.000 6.315) 11.782 3.589 ( 18.659 0.000 -0.827) 18.677 3.649 ( 11.296 0.000 3.290) 11.765 4.479 ( 10.565 0.000 -5.379) 11.856 4.543 ( -5.208 -0.000 -1.295) 5.366 5.108 ( -16.390 -0.000 4.846) 17.092 5.305 ( -4.765 -0.000 0.407) 4.783 5.642 ( -6.882 -0.000 0.407) 6.894 6.163 ( 3.591 0.000 0.486) 3.624 6.192 ( -5.546 -0.000 5.996) 8.167 6.299 ( 3.972 0.000 6.107) 7.285 6.966 ( 7.109 0.000 -9.258) 11.673 7.211 ( 10.820 0.000 0.186) 10.822 8.161 ( -25.503 -0.000 18.607) 31.569 8.716 ( -7.449 -0.000 11.401) 13.618 8.739 ( -2.415 -0.000 12.612) 12.841 8.924 ( 1.136 0.000 -6.219) 6.322 9.784 ( 6.064 0.000 -6.626) 8.982 10.601 ( -12.335 -0.000 5.043) 13.326 11.091 ( 13.715 0.000 -19.807) 24.092 11.629 ( 12.107 0.000 -2.276) 12.319 12.021 ( -6.145 -0.000 15.951) 17.094 12.170 ( -7.035 -0.000 -2.072) 7.334 12.358 ( -0.305 -0.000 3.439) 3.452 13.728 ( 13.575 0.000 -2.757) 13.852 17.020 ( -10.116 -0.000 -13.946) 17.228 18.026 ( 1.935 0.000 13.095) 13.237 18.797 ( 5.557 0.000 7.529) 9.358 19.045 ( -9.787 -0.000 -0.334) 9.792 19.203 ( -3.110 -0.000 -25.720) 25.908 22.707 ( 19.754 0.000 -9.460) 21.903 23.019 ( -2.282 -0.000 4.536) 5.077 23.364 ( 10.362 0.000 14.267) 17.633 ======================= Grid point 498 (247/361) ======================= q-point: (-0.20 -0.30 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.044 ( -25.838 -1.722 6.728) 26.755 2.246 ( -21.155 -5.091 14.897) 26.370 2.989 ( -13.940 -2.661 0.382) 14.196 3.468 ( 8.341 -0.724 3.482) 9.067 3.711 ( 11.612 8.811 -3.091) 14.901 3.850 ( 3.145 -2.520 3.998) 5.677 4.476 ( -0.514 0.278 2.595) 2.660 4.568 ( 9.849 1.225 -4.255) 10.799 4.941 ( -12.921 1.874 3.892) 13.624 5.310 ( 2.381 0.061 1.279) 2.703 5.533 ( -6.187 0.328 -4.866) 7.879 6.110 ( -5.505 7.832 2.142) 9.810 6.200 ( -2.286 -1.203 4.597) 5.273 6.550 ( 12.148 -7.972 7.779) 16.481 6.945 ( 6.934 3.846 -7.236) 10.734 7.260 ( 3.094 -2.115 -9.428) 10.145 7.983 ( -27.511 -2.780 12.799) 30.469 8.728 ( -6.341 2.558 9.352) 11.585 8.837 ( -6.308 -0.393 15.112) 16.381 8.983 ( 4.503 -7.428 -0.081) 8.686 9.791 ( 7.762 2.686 -6.264) 10.330 10.479 ( -11.248 2.913 5.130) 12.701 11.055 ( 12.592 -2.214 -18.754) 22.698 11.728 ( 4.966 -0.472 -3.371) 6.021 12.017 ( -7.716 7.709 6.312) 12.602 12.165 ( -2.807 -8.202 6.550) 10.865 12.403 ( 1.804 -0.558 -0.245) 1.904 13.841 ( 14.909 4.115 -8.796) 17.793 16.824 ( -3.501 -0.138 -0.861) 3.608 18.187 ( 3.564 0.013 7.490) 8.294 18.576 ( -19.643 3.966 -14.758) 24.887 18.900 ( 2.536 5.390 3.403) 6.860 19.258 ( 9.091 -10.868 -4.899) 14.992 22.813 ( 13.572 -1.036 -9.529) 16.615 23.015 ( -3.711 6.605 5.839) 9.565 23.699 ( 12.611 -0.794 11.172) 16.867 ======================= Grid point 499 (248/361) ======================= q-point: (-0.10 -0.30 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.867 ( -21.997 -7.213 12.933) 26.518 2.031 ( -29.240 -6.837 1.361) 30.060 2.989 ( -9.081 -6.709 19.435) 22.477 3.549 ( 0.094 1.204 -0.684) 1.388 3.749 ( 11.609 8.615 -3.736) 14.931 3.824 ( -10.354 0.890 3.402) 10.935 4.526 ( -6.608 8.109 3.826) 11.138 4.630 ( 11.712 1.203 -0.621) 11.790 4.890 ( 4.567 -0.329 1.632) 4.861 5.311 ( -2.044 -0.377 -9.209) 9.440 5.415 ( 0.464 -0.203 1.268) 1.366 5.967 ( -4.265 10.596 -0.351) 11.427 6.261 ( -2.232 0.300 10.021) 10.271 6.823 ( 8.998 1.401 -2.055) 9.335 6.971 ( 4.175 -1.620 6.939) 8.259 7.123 ( -5.000 1.283 -12.536) 13.557 7.813 ( -23.678 -10.449 12.498) 28.741 8.697 ( -8.172 6.157 7.778) 12.853 8.950 ( -3.805 -4.778 13.282) 14.619 9.117 ( 4.980 -13.004 -3.837) 14.444 9.800 ( 5.064 7.289 -1.624) 9.023 10.364 ( -9.153 0.145 1.981) 9.366 11.043 ( 11.998 -3.910 -16.939) 21.122 11.683 ( -4.463 0.202 -3.580) 5.725 11.909 ( -8.841 7.143 6.536) 13.111 12.296 ( -0.036 -12.470 0.346) 12.474 12.388 ( 2.281 1.803 -3.831) 4.809 13.857 ( 14.683 8.190 -14.208) 22.012 16.936 ( 8.478 3.162 14.860) 17.398 18.119 ( -5.363 -4.924 -20.686) 21.929 18.377 ( -0.366 4.572 12.110) 12.950 18.905 ( 4.208 5.635 -0.115) 7.034 19.401 ( 1.866 -11.125 -1.768) 11.418 22.883 ( 1.513 9.204 -0.785) 9.361 22.931 ( 2.471 3.395 -1.791) 4.565 23.925 ( 6.466 -1.220 2.129) 6.916 ======================= Grid point 508 (249/361) ======================= q-point: (-0.20 -0.20 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.797 ( -21.837 -0.000 11.703) 24.776 1.968 ( -31.260 -0.000 2.290) 31.344 2.931 ( -10.678 -0.000 22.109) 24.553 3.557 ( 1.883 0.000 -1.020) 2.141 3.830 ( -11.166 -0.000 4.457) 12.023 3.835 ( 9.617 0.000 -5.113) 10.892 4.612 ( -3.107 -0.000 -0.225) 3.115 4.627 ( 13.517 0.000 6.037) 14.804 4.888 ( 1.914 0.000 0.394) 1.954 5.304 ( -2.433 -0.000 -12.056) 12.299 5.415 ( 0.410 0.000 0.923) 1.010 6.067 ( -2.410 -0.000 -4.674) 5.259 6.267 ( -4.225 -0.000 16.017) 16.565 6.810 ( 13.504 0.000 6.685) 15.068 6.983 ( 8.653 0.000 -4.139) 9.592 7.133 ( -0.257 -0.000 -14.506) 14.508 7.705 ( -32.621 -0.000 14.911) 35.868 8.786 ( -2.586 -0.000 8.932) 9.299 8.854 ( -10.948 -0.000 10.517) 15.181 9.021 ( 2.879 0.000 0.595) 2.939 9.865 ( 9.669 0.000 -3.956) 10.447 10.371 ( -13.922 -0.000 3.301) 14.308 11.009 ( 12.480 0.000 -16.739) 20.879 11.691 ( -3.262 -0.000 -4.795) 5.799 12.066 ( -10.517 -0.000 2.646) 10.845 12.082 ( -0.466 -0.000 3.667) 3.696 12.403 ( 2.537 0.000 -3.495) 4.318 13.929 ( 15.036 0.000 -15.066) 21.286 16.966 ( 10.975 0.000 16.880) 20.134 18.071 ( -6.559 -0.000 -22.774) 23.700 18.419 ( -1.882 -0.000 14.027) 14.153 18.988 ( 0.536 0.000 0.676) 0.863 19.270 ( 5.764 0.000 -2.941) 6.471 22.875 ( 12.034 0.000 -8.342) 14.643 23.064 ( -5.059 -0.000 6.681) 8.380 23.906 ( 6.382 0.000 -0.251) 6.387 ======================= Grid point 509 (250/361) ======================= q-point: (-0.10 -0.20 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.572 ( -30.026 -4.619 6.257) 31.017 1.742 ( -15.428 -4.685 18.955) 24.885 3.140 ( -7.417 -2.391 29.893) 30.892 3.495 ( -5.788 1.088 -3.345) 6.773 3.698 ( -10.574 0.537 1.927) 10.761 3.895 ( 10.430 2.671 -6.396) 12.524 4.495 ( -9.465 6.431 1.564) 11.549 4.796 ( 4.813 4.293 -4.654) 7.953 4.983 ( 8.621 -4.637 -3.041) 10.250 5.177 ( 2.644 -0.983 0.322) 2.839 5.489 ( 7.344 -0.865 1.220) 7.495 5.978 ( 0.458 4.763 -3.433) 5.889 6.426 ( -2.127 3.221 19.377) 19.757 6.830 ( -6.937 7.067 -15.829) 18.671 6.904 ( 0.204 -0.756 -11.501) 11.528 7.183 ( 3.541 5.719 15.206) 16.627 7.554 ( -21.360 -15.908 18.474) 32.413 8.734 ( -9.089 9.145 6.884) 14.617 8.952 ( 0.590 -13.224 5.198) 14.222 9.047 ( -0.333 -2.909 -0.810) 3.038 9.913 ( 1.668 9.699 -1.299) 9.926 10.186 ( -13.422 -6.511 -1.099) 14.958 11.006 ( 12.414 -1.085 -14.453) 19.083 11.544 ( -8.834 -0.061 -4.998) 10.150 11.890 ( -10.663 3.364 2.911) 11.554 12.168 ( 0.863 -6.920 0.074) 6.974 12.418 ( 3.308 -0.416 -0.837) 3.438 13.900 ( 12.904 3.720 -19.874) 23.986 17.427 ( 21.332 9.237 18.993) 30.019 17.800 ( 1.407 -9.168 -15.146) 17.760 18.582 ( 2.461 6.190 12.450) 14.120 18.960 ( 1.310 -0.836 -2.819) 3.219 19.316 ( 0.583 -5.310 -2.413) 5.862 22.945 ( 8.033 1.432 -6.563) 10.472 22.998 ( -5.428 11.015 4.062) 12.934 23.847 ( -6.930 -5.380 -11.686) 14.613 ======================= Grid point 519 (251/361) ======================= q-point: (-0.10 -0.10 0.31) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.395 ( -12.345 -0.000 18.985) 22.646 1.819 ( -8.242 -0.000 24.882) 26.211 3.344 ( -8.631 -0.000 -5.767) 10.380 3.365 ( -14.095 -0.000 32.906) 35.798 3.649 ( 5.500 0.000 -1.918) 5.825 3.944 ( 7.797 0.000 -8.968) 11.884 4.424 ( -8.149 -0.000 1.390) 8.266 4.699 ( 0.333 0.000 -11.257) 11.262 5.026 ( 6.648 0.000 -2.780) 7.206 5.287 ( -1.594 -0.000 7.332) 7.503 5.690 ( 18.340 0.000 4.036) 18.779 6.007 ( 4.716 0.000 -1.303) 4.892 6.418 ( -22.672 -0.000 -16.455) 28.014 6.658 ( -3.156 -0.000 22.012) 22.237 6.817 ( 2.003 0.000 -11.383) 11.558 7.367 ( -24.619 -0.000 25.066) 35.134 7.517 ( 7.505 0.000 14.260) 16.114 8.722 ( -8.400 -0.000 4.090) 9.343 8.895 ( 2.306 0.000 -9.250) 9.533 9.077 ( -0.094 -0.000 11.063) 11.064 9.825 ( -24.042 -0.000 -0.007) 24.042 10.029 ( 6.191 0.000 -4.101) 7.426 11.019 ( 12.349 0.000 -12.589) 17.635 11.327 ( -11.857 -0.000 -6.640) 13.590 11.819 ( -7.065 -0.000 7.111) 10.024 12.201 ( 4.244 0.000 1.386) 4.465 12.446 ( 1.942 0.000 -0.161) 1.948 13.823 ( 9.789 0.000 -22.226) 24.286 17.563 ( 2.714 0.000 -14.122) 14.380 18.099 ( 29.943 0.000 14.051) 33.076 18.831 ( -0.670 -0.000 16.137) 16.150 18.839 ( -3.879 -0.000 -7.720) 8.640 19.306 ( 7.633 0.000 -2.749) 8.113 22.976 ( 6.744 0.000 -10.603) 12.566 23.021 ( -7.539 -0.000 4.573) 8.817 23.409 ( -21.954 -0.000 -16.547) 27.491 ======================= Grid point 520 (252/361) ======================= q-point: ( 0.00 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.183 ( 9.408 0.000 12.458) 15.612 2.721 ( -4.482 -0.000 -1.957) 4.891 2.969 ( 1.784 0.000 17.325) 17.417 3.497 ( -0.872 -0.000 -10.558) 10.594 3.663 ( 0.209 0.000 -15.320) 15.322 3.870 ( 1.139 0.000 -1.184) 1.643 4.155 ( -6.291 -0.000 -2.946) 6.947 4.166 ( 2.125 0.000 -5.613) 6.002 5.432 ( 4.616 0.000 9.827) 10.857 5.565 ( -7.111 -0.000 13.172) 14.969 5.745 ( -5.490 -0.000 2.161) 5.900 6.024 ( -1.981 -0.000 -5.129) 5.498 6.225 ( 7.184 0.000 -2.602) 7.640 6.432 ( 2.832 0.000 -6.337) 6.941 7.380 ( -7.088 -0.000 21.762) 22.887 8.011 ( -3.159 -0.000 0.669) 3.229 8.090 ( -11.073 -0.000 24.483) 26.870 8.540 ( -3.242 -0.000 -0.786) 3.336 8.673 ( 4.080 0.000 2.656) 4.868 9.541 ( -16.263 -0.000 17.558) 23.932 9.660 ( 3.420 0.000 -18.371) 18.686 9.855 ( 9.621 0.000 14.595) 17.481 10.458 ( -7.379 -0.000 -14.937) 16.660 10.916 ( 10.478 0.000 -13.185) 16.841 12.100 ( -2.639 -0.000 5.727) 6.306 12.290 ( 7.284 0.000 -4.111) 8.364 12.538 ( -4.741 -0.000 7.677) 9.023 13.265 ( 5.916 0.000 -13.090) 14.365 17.418 ( 8.485 0.000 -1.030) 8.547 17.920 ( -7.519 -0.000 -15.760) 17.462 18.921 ( -17.383 -0.000 7.519) 18.939 19.078 ( 10.355 0.000 1.270) 10.433 20.268 ( 27.308 0.000 17.709) 32.548 21.626 ( -25.413 -0.000 -22.709) 34.081 22.925 ( -5.501 -0.000 1.086) 5.607 23.054 ( 7.020 0.000 -4.734) 8.467 ======================= Grid point 521 (253/361) ======================= q-point: ( 0.10 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.470 ( 12.497 0.363 9.660) 15.799 2.603 ( -0.648 -0.711 -8.472) 8.527 3.175 ( 0.050 6.789 12.029) 13.812 3.394 ( -0.321 6.176 -1.804) 6.442 3.484 ( -1.473 -3.589 -7.517) 8.460 3.785 ( -2.174 -1.816 -11.658) 11.997 4.046 ( -4.687 -0.590 -1.762) 5.041 4.238 ( 7.481 -2.676 0.868) 7.993 5.550 ( -3.573 1.801 9.419) 10.233 5.622 ( -10.840 -4.147 10.889) 15.914 5.697 ( -2.343 -1.082 -1.150) 2.825 5.911 ( -5.533 -0.925 -4.669) 7.298 6.257 ( 3.504 -0.956 -2.429) 4.370 6.390 ( 2.005 1.469 -6.112) 6.598 7.546 ( -3.181 5.152 21.278) 22.122 7.782 ( -7.720 21.365 1.269) 22.753 8.273 ( -12.737 -14.533 12.336) 22.926 8.548 ( 0.364 -3.651 2.893) 4.672 8.810 ( 6.117 -0.261 6.563) 8.975 9.425 ( -1.670 5.820 -10.512) 12.131 9.624 ( -5.929 -5.100 13.242) 15.379 10.145 ( 2.960 5.696 0.766) 6.465 10.317 ( 10.978 -11.782 0.312) 16.107 10.925 ( 16.864 1.950 -16.621) 23.758 12.115 ( -3.795 -2.842 2.400) 5.314 12.347 ( 5.466 -3.693 -4.033) 7.732 12.551 ( -7.990 1.393 10.096) 12.951 13.175 ( 4.159 1.991 -12.734) 13.543 17.539 ( 7.122 0.475 2.611) 7.600 17.641 ( -7.754 -1.782 -13.765) 15.899 18.761 ( -16.429 2.296 6.605) 17.855 19.164 ( 0.499 0.639 1.665) 1.852 20.824 ( 14.588 6.361 14.180) 21.315 21.067 ( -8.592 -5.467 -17.930) 20.621 22.894 ( -1.956 -1.583 0.921) 2.679 23.116 ( 8.911 -0.233 -3.908) 9.733 ======================= Grid point 522 (254/361) ======================= q-point: ( 0.20 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.510 ( 1.476 -2.248 -7.594) 8.056 2.741 ( 9.976 0.751 5.377) 11.358 3.161 ( 0.338 7.237 3.941) 8.248 3.281 ( -0.451 5.645 -3.901) 6.876 3.557 ( 0.386 2.825 8.488) 8.954 3.627 ( -2.164 -3.485 -11.203) 11.930 4.019 ( 1.406 -2.306 0.120) 2.703 4.391 ( 7.333 -3.339 2.036) 8.311 5.441 ( -18.831 -1.707 0.443) 18.914 5.583 ( -10.121 -1.990 3.905) 11.029 5.696 ( -4.210 -1.942 3.009) 5.527 5.808 ( -6.445 -2.627 -0.973) 7.027 6.320 ( 2.782 1.553 -6.643) 7.367 6.326 ( 4.783 -2.827 -0.372) 5.568 7.499 ( -6.002 20.041 0.916) 20.940 7.678 ( -1.384 10.640 15.028) 18.465 8.296 ( -11.647 -7.238 6.997) 15.394 8.646 ( -1.869 -7.520 5.650) 9.590 8.956 ( 1.769 2.822 9.724) 10.279 9.254 ( -3.386 -6.230 -12.146) 14.065 9.794 ( 2.248 0.235 13.797) 13.980 10.059 ( 5.283 7.393 -4.583) 10.176 10.756 ( 20.407 -10.427 9.485) 24.802 10.952 ( 19.708 3.165 -18.079) 26.931 12.109 ( -4.018 -4.753 0.559) 6.249 12.396 ( 1.447 -5.340 -4.072) 6.870 12.528 ( -10.790 1.921 11.378) 15.798 13.063 ( 4.196 0.674 -13.100) 13.772 17.369 ( -9.536 -1.030 -11.683) 15.116 17.714 ( 6.628 -1.895 6.704) 9.616 18.588 ( -13.193 4.214 4.293) 14.500 19.137 ( -9.297 -2.456 3.436) 10.212 20.455 ( -9.624 10.513 -21.364) 25.682 21.501 ( 21.160 -8.764 17.105) 28.586 22.909 ( 1.454 -0.186 0.339) 1.504 23.213 ( 9.651 -0.438 -1.572) 9.788 ======================= Grid point 523 (255/361) ======================= q-point: (-0.70 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.503 ( 2.053 -7.895 -5.697) 9.949 2.810 ( -3.383 6.104 5.855) 9.110 3.139 ( -0.911 4.292 -5.993) 7.427 3.274 ( 5.601 0.841 5.082) 7.610 3.543 ( 2.157 -1.692 -2.008) 3.398 3.619 ( 1.293 4.816 3.695) 6.207 4.120 ( 9.125 -1.201 0.527) 9.218 4.525 ( 3.449 -1.790 3.523) 5.245 5.177 ( -19.224 -2.935 -1.502) 19.504 5.447 ( -15.022 -2.568 0.804) 15.261 5.662 ( -6.698 -2.166 0.124) 7.041 5.747 ( -8.347 -4.752 2.385) 9.896 6.261 ( 4.290 1.501 -7.207) 8.521 6.453 ( 6.160 -4.180 1.125) 7.529 7.286 ( -2.166 18.171 1.194) 18.339 7.671 ( -2.675 12.556 5.783) 14.080 8.284 ( -10.087 -6.776 6.831) 13.941 8.744 ( -4.940 -6.730 8.219) 11.715 9.003 ( -6.724 0.549 6.600) 9.438 9.192 ( 0.083 -7.676 -4.158) 8.730 9.895 ( 10.977 16.700 -0.770) 20.000 10.135 ( 4.746 -2.754 8.027) 9.724 10.958 ( 20.441 5.394 -19.796) 28.962 11.233 ( 19.151 -8.207 6.642) 21.868 12.114 ( -1.958 -5.043 0.680) 5.452 12.350 ( -5.762 1.304 -0.792) 5.960 12.505 ( -9.319 -1.556 8.002) 12.381 13.013 ( 6.252 -7.584 -11.655) 15.246 17.115 ( -10.233 0.562 -8.236) 13.148 17.912 ( 4.830 -3.444 8.940) 10.729 18.445 ( -7.032 3.055 1.112) 7.747 19.038 ( -16.067 -5.751 3.444) 17.410 20.041 ( -0.138 13.064 -19.535) 23.501 22.020 ( 13.771 -10.293 14.668) 22.600 22.929 ( 4.568 3.914 -1.635) 6.234 23.365 ( 9.856 -1.971 3.378) 10.603 ======================= Grid point 524 (256/361) ======================= q-point: (-0.60 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.521 ( -7.173 -6.785 -0.303) 9.878 2.748 ( -7.464 5.739 6.410) 11.390 3.053 ( 4.043 -1.123 -5.174) 6.662 3.352 ( -0.633 1.132 1.006) 1.642 3.578 ( 1.178 7.052 6.120) 9.411 3.690 ( 7.644 -5.067 -2.139) 9.418 4.271 ( 12.990 1.482 -1.315) 13.140 4.579 ( -5.603 -0.420 6.265) 8.416 4.979 ( -13.761 -3.501 2.668) 14.448 5.294 ( -8.943 -3.947 -0.948) 9.821 5.551 ( -7.812 -1.283 -3.603) 8.698 5.723 ( -7.907 -8.054 2.971) 11.671 6.249 ( 4.709 1.024 -3.520) 5.967 6.572 ( 4.144 -4.306 0.075) 5.977 7.135 ( 0.790 14.086 -2.650) 14.355 7.545 ( -5.439 12.104 2.840) 13.570 8.286 ( -11.090 -7.127 6.741) 14.806 8.801 ( -10.598 -4.952 10.584) 15.775 8.994 ( -3.602 -4.475 4.115) 7.066 9.250 ( 1.965 -2.122 2.468) 3.802 9.850 ( 9.987 20.570 -2.513) 23.004 10.317 ( 3.540 -2.718 6.905) 8.222 10.935 ( 19.005 7.027 -21.591) 29.610 11.545 ( 10.310 -5.620 0.790) 11.769 12.131 ( -4.040 0.153 1.054) 4.178 12.265 ( -2.190 -0.135 0.309) 2.215 12.486 ( -5.446 -0.257 6.226) 8.276 13.097 ( 7.653 -15.511 -8.706) 19.363 16.919 ( -7.730 1.146 -0.947) 7.872 18.089 ( 0.611 -7.364 5.323) 9.107 18.359 ( 0.195 4.539 -3.113) 5.508 18.888 ( -14.223 -3.883 1.248) 14.796 19.779 ( 3.840 11.758 -11.253) 16.722 22.374 ( 2.635 -12.960 8.951) 15.970 22.926 ( 7.682 8.358 -4.023) 12.044 23.601 ( 10.188 -3.682 8.255) 13.620 ======================= Grid point 525 (257/361) ======================= q-point: (-0.50 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.399 ( -14.290 2.248 4.518) 15.155 2.600 ( -18.978 8.176 6.922) 21.793 3.184 ( 13.398 -10.035 -4.441) 17.319 3.299 ( -0.482 4.383 -0.066) 4.410 3.620 ( 2.656 6.593 5.422) 8.940 3.792 ( 0.534 -10.274 -2.049) 10.490 4.393 ( 7.102 2.285 -2.882) 7.998 4.551 ( -10.083 -5.552 7.414) 13.691 4.926 ( -3.770 0.520 6.953) 7.927 5.263 ( -0.904 -3.726 -1.456) 4.102 5.422 ( -2.308 0.690 -4.349) 4.971 5.732 ( -6.216 -10.129 1.085) 11.934 6.296 ( 2.924 -1.218 2.935) 4.319 6.633 ( 1.172 -3.752 -2.153) 4.481 6.971 ( -0.019 6.468 -10.929) 12.699 7.428 ( -6.268 10.774 9.226) 15.507 8.241 ( -12.544 -3.533 5.872) 14.294 8.809 ( -13.916 -5.458 12.572) 19.532 9.070 ( 0.325 -3.029 5.354) 6.160 9.316 ( 4.719 3.205 0.377) 5.717 9.773 ( 3.671 14.837 1.350) 15.344 10.416 ( 0.812 0.137 2.699) 2.822 10.859 ( 17.238 7.812 -22.419) 29.339 11.658 ( 1.516 -4.001 -1.190) 4.441 12.035 ( -9.036 2.485 3.931) 10.163 12.256 ( 0.266 -3.472 -5.306) 6.347 12.514 ( 1.026 4.322 5.138) 6.792 13.262 ( 9.533 -15.881 -8.534) 20.394 16.902 ( -0.930 -1.796 8.969) 9.195 18.084 ( -5.233 -6.002 -13.799) 15.932 18.333 ( 4.539 5.418 3.312) 7.806 18.811 ( -2.054 -1.259 2.209) 3.269 19.656 ( 1.218 7.808 -2.909) 8.420 22.546 ( -7.045 -16.759 4.926) 18.835 22.909 ( 10.154 10.386 -5.450) 15.514 23.854 ( 7.400 -3.000 6.697) 10.421 ======================= Grid point 526 (258/361) ======================= q-point: (-0.40 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.220 ( -18.383 9.074 4.607) 21.012 2.299 ( -19.985 10.161 13.532) 26.187 3.293 ( 3.413 2.367 1.716) 4.494 3.425 ( 9.458 -11.230 -2.570) 14.906 3.629 ( 5.664 7.249 -2.707) 9.589 3.853 ( -8.161 -10.951 5.731) 14.811 4.311 ( -10.737 -7.316 -4.897) 13.885 4.627 ( -0.273 -5.043 5.242) 7.279 5.025 ( 8.523 5.792 6.859) 12.379 5.211 ( -2.193 1.323 -2.719) 3.735 5.431 ( 6.488 0.545 -0.855) 6.567 5.752 ( -1.886 -8.794 -1.582) 9.132 6.430 ( -0.460 -5.748 11.654) 13.002 6.605 ( -3.045 -5.240 -8.458) 10.405 6.802 ( -0.256 -0.099 -11.033) 11.037 7.394 ( -7.851 5.276 13.349) 16.360 8.170 ( -8.549 4.085 8.577) 12.780 8.799 ( -16.589 -5.777 13.061) 21.890 9.151 ( -0.290 -0.496 4.642) 4.677 9.286 ( 6.983 14.069 -6.543) 17.015 9.759 ( -4.965 -0.964 7.750) 9.254 10.401 ( -0.738 4.914 -1.248) 5.123 10.770 ( 15.590 5.593 -20.723) 26.529 11.636 ( -4.437 0.101 -2.150) 4.932 11.974 ( -7.397 -0.802 6.431) 9.834 12.209 ( -0.133 -2.075 -6.077) 6.423 12.529 ( 1.388 7.531 3.536) 8.435 13.394 ( 10.060 -11.059 -13.336) 20.034 17.124 ( 6.505 -7.076 12.554) 15.811 17.867 ( 2.614 4.120 -14.427) 15.230 18.406 ( -0.036 -4.904 2.490) 5.500 18.881 ( 7.941 1.424 1.641) 8.233 19.572 ( -3.133 6.706 0.569) 7.424 22.618 ( -12.166 -20.393 3.028) 23.939 22.900 ( 10.673 9.087 -6.086) 15.282 23.957 ( 0.131 1.134 -1.026) 1.535 ======================= Grid point 527 (259/361) ======================= q-point: (-0.30 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.910 ( -18.822 12.254 11.175) 25.085 2.238 ( -10.024 6.845 19.412) 22.894 3.331 ( -1.036 -3.124 -3.409) 4.739 3.484 ( 0.716 2.740 -0.060) 2.832 3.690 ( 14.397 -1.709 -8.630) 16.872 3.875 ( -15.252 -4.996 13.829) 21.186 4.206 ( -5.122 -13.865 -8.349) 16.975 4.694 ( -2.636 -2.539 1.364) 3.906 5.026 ( 1.935 7.354 -3.118) 8.219 5.331 ( 8.226 0.624 11.650) 14.275 5.519 ( 11.795 2.703 -1.739) 12.225 5.816 ( 4.272 -6.269 -1.207) 7.682 6.406 ( -12.263 -6.233 -11.534) 17.952 6.667 ( -0.158 -8.472 8.634) 12.097 6.719 ( -0.684 -3.955 -0.421) 4.036 7.432 ( -9.034 -3.678 14.056) 17.109 8.144 ( -4.160 11.841 13.706) 18.584 8.764 ( -14.357 -4.557 10.156) 18.167 9.066 ( -2.118 12.714 -6.425) 14.401 9.252 ( 3.414 2.762 2.769) 5.191 9.775 ( -13.626 -7.777 8.116) 17.664 10.291 ( 0.685 11.007 -5.073) 12.139 10.727 ( 14.118 1.017 -16.426) 21.684 11.489 ( -9.800 2.744 -3.777) 10.855 11.974 ( -5.218 0.145 7.200) 8.893 12.179 ( 1.901 -0.011 -2.006) 2.764 12.515 ( 0.760 6.709 2.740) 7.287 13.420 ( 9.568 -6.424 -17.791) 21.198 17.321 ( 4.327 -5.439 -6.138) 9.272 17.927 ( 19.030 2.733 7.017) 20.465 18.462 ( -4.539 -13.068 -1.230) 13.888 19.035 ( 15.615 4.973 2.339) 16.554 19.448 ( -7.672 7.597 1.408) 10.888 22.636 ( -14.546 -21.479 -0.801) 25.953 22.907 ( 9.135 4.688 -5.459) 11.629 23.797 ( -8.962 8.132 -8.505) 14.791 ======================= Grid point 528 (260/361) ======================= q-point: (-0.20 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.811 ( -6.685 6.661 15.895) 18.485 2.340 ( -5.123 3.636 23.782) 24.598 3.191 ( -9.592 -1.839 -7.434) 12.274 3.544 ( 9.302 -1.217 -3.212) 9.915 3.742 ( 6.761 0.250 -8.263) 10.680 3.881 ( -9.401 0.076 12.165) 15.374 4.196 ( -1.349 -14.573 -9.247) 17.311 4.584 ( -5.266 5.800 -6.023) 9.882 5.057 ( 5.354 0.498 4.998) 7.341 5.475 ( -1.675 2.863 9.229) 9.807 5.749 ( 20.380 0.696 1.590) 20.454 5.937 ( 6.802 -3.795 -0.167) 7.791 6.135 ( -13.801 -3.539 -8.358) 16.518 6.598 ( -1.391 -1.223 -9.293) 9.476 6.986 ( -3.055 -12.155 19.982) 23.587 7.533 ( -10.424 -12.509 14.946) 22.103 8.158 ( -2.284 17.218 17.283) 24.503 8.720 ( -7.649 -0.869 3.659) 8.524 8.836 ( -4.054 9.883 -6.838) 12.683 9.341 ( 0.643 -3.506 7.654) 8.443 9.701 ( -19.851 -7.308 8.641) 22.850 10.119 ( 2.583 15.074 -8.343) 17.422 10.741 ( 12.628 -1.518 -14.761) 19.484 11.243 ( -13.955 3.073 -5.056) 15.158 12.000 ( -2.695 2.271 8.715) 9.401 12.203 ( 4.458 0.980 -1.423) 4.781 12.505 ( -0.119 3.847 2.943) 4.845 13.379 ( 9.091 -3.808 -18.150) 20.654 17.309 ( 6.063 -1.790 -9.107) 11.086 18.265 ( 13.854 2.218 -0.849) 14.056 18.525 ( 1.830 -16.628 1.912) 16.837 19.267 ( -9.315 4.324 0.196) 10.272 19.305 ( 19.655 8.117 10.098) 23.541 22.540 ( -17.137 -18.192 -10.026) 26.929 22.942 ( 5.514 -0.950 -3.497) 6.598 23.422 ( -13.484 14.183 -8.469) 21.324 ======================= Grid point 529 (261/361) ======================= q-point: (-0.10 0.00 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.940 ( 3.013 1.761 15.058) 15.457 2.575 ( -0.757 0.003 24.477) 24.489 2.988 ( -7.856 -1.278 -7.356) 10.838 3.606 ( 2.744 -5.791 -10.649) 12.428 3.729 ( 11.802 5.349 -8.743) 15.631 3.868 ( -7.405 0.211 6.309) 9.731 4.186 ( -1.930 -11.321 -8.032) 14.014 4.365 ( -4.819 8.495 -7.913) 12.571 5.232 ( 6.252 -0.994 9.355) 11.295 5.520 ( -4.471 2.819 10.848) 12.067 5.837 ( -8.810 -0.094 -1.024) 8.870 6.046 ( 6.129 -0.504 -2.108) 6.501 6.087 ( 12.215 -0.564 0.379) 12.234 6.488 ( -0.320 -1.779 -8.525) 8.714 7.227 ( -7.335 -5.495 19.660) 21.691 7.747 ( -7.620 -22.671 16.795) 29.225 8.157 ( -3.262 22.139 17.145) 28.191 8.639 ( -6.646 1.787 -1.230) 6.992 8.666 ( -0.246 3.602 -3.808) 5.248 9.525 ( 2.072 -9.142 10.947) 14.412 9.595 ( -19.337 -6.645 10.549) 23.008 9.913 ( 4.050 17.573 -9.945) 20.594 10.699 ( 3.734 0.131 -16.682) 17.095 10.989 ( -6.559 0.387 -7.151) 9.711 12.055 ( -1.860 2.017 8.585) 9.013 12.242 ( 6.849 1.577 -3.273) 7.753 12.515 ( -2.053 0.930 4.775) 5.280 13.325 ( 7.892 -2.089 -15.465) 17.488 17.335 ( 8.011 -0.684 -5.022) 9.479 18.184 ( -4.587 -1.386 -14.250) 15.034 18.835 ( 15.022 -6.233 4.212) 16.801 19.085 ( -15.030 3.181 5.542) 16.332 19.725 ( 26.298 3.150 13.505) 29.730 22.199 ( -24.136 -8.529 -19.929) 32.441 22.977 ( 0.718 -2.365 -1.697) 2.998 23.096 ( -5.400 9.368 -3.463) 11.354 ======================= Grid point 531 (262/361) ======================= q-point: ( 0.10 0.10 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.492 ( 1.633 0.000 -10.565) 10.690 2.746 ( 11.249 0.000 6.719) 13.103 3.248 ( -2.430 -0.000 3.168) 3.993 3.319 ( -1.382 -0.000 -5.094) 5.278 3.575 ( -2.185 -0.000 -15.409) 15.563 3.602 ( 2.438 0.000 14.121) 14.330 3.999 ( 0.575 0.000 1.516) 1.622 4.349 ( 7.518 0.000 1.090) 7.597 5.432 ( -19.873 -0.000 1.271) 19.914 5.560 ( -9.832 -0.000 3.797) 10.540 5.679 ( -4.152 -0.000 4.050) 5.800 5.785 ( -6.177 -0.000 -1.877) 6.456 6.299 ( 5.288 0.000 0.610) 5.323 6.335 ( 1.983 0.000 -8.313) 8.546 7.728 ( -7.751 -0.000 -4.453) 8.939 7.760 ( -4.123 -0.000 17.822) 18.293 8.211 ( -12.848 -0.000 15.394) 20.051 8.564 ( 3.035 0.000 -0.421) 3.064 8.984 ( 2.964 0.000 11.108) 11.496 9.191 ( -5.671 -0.000 -17.775) 18.658 9.772 ( -0.226 -0.000 19.700) 19.701 10.183 ( 12.651 0.000 -11.295) 16.960 10.633 ( 19.079 0.000 16.293) 25.089 10.985 ( 19.981 0.000 -18.535) 27.254 12.063 ( -3.659 -0.000 0.504) 3.693 12.335 ( 2.455 0.000 -4.404) 5.042 12.552 ( -11.395 -0.000 11.414) 16.128 13.072 ( 2.798 0.000 -14.451) 14.719 17.360 ( -9.126 -0.000 -11.466) 14.654 17.697 ( 6.732 0.000 6.381) 9.275 18.631 ( -14.224 -0.000 5.353) 15.199 19.108 ( -12.402 -0.000 3.603) 12.914 20.559 ( -6.945 -0.000 -26.496) 27.391 21.414 ( 19.584 0.000 21.430) 29.031 22.908 ( 2.363 0.000 1.957) 3.068 23.209 ( 10.042 0.000 -2.734) 10.407 ======================= Grid point 532 (263/361) ======================= q-point: (-0.80 0.10 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.408 ( 2.475 -2.725 -9.913) 10.575 2.890 ( 0.610 2.388 4.843) 5.434 3.212 ( -2.946 4.432 -6.159) 8.139 3.275 ( -0.847 -1.521 2.304) 2.888 3.467 ( 6.211 -3.818 -7.023) 10.123 3.728 ( -0.700 4.607 9.905) 10.947 4.120 ( 8.742 0.633 6.561) 10.948 4.463 ( 5.215 -3.675 0.421) 6.393 5.155 ( -19.070 0.039 -0.165) 19.071 5.398 ( -17.699 -2.098 0.622) 17.834 5.645 ( -6.968 0.004 2.780) 7.502 5.693 ( -8.063 -1.710 1.365) 8.355 6.275 ( 4.218 0.303 -8.355) 9.364 6.403 ( 6.040 -1.457 1.765) 6.459 7.549 ( -4.972 10.030 -1.835) 11.344 7.815 ( -8.972 2.755 8.080) 12.384 8.219 ( -11.121 -0.485 13.571) 17.553 8.629 ( 3.040 -4.992 -0.151) 5.847 8.944 ( -5.440 -4.306 -11.943) 13.812 9.135 ( -1.890 -0.117 12.474) 12.617 10.015 ( 4.819 0.231 14.525) 15.306 10.246 ( 18.076 9.006 -8.200) 21.797 11.032 ( 20.893 2.538 -19.633) 28.782 11.105 ( 19.318 -5.141 11.591) 23.107 12.045 ( -0.949 -2.310 1.111) 2.733 12.310 ( -0.894 -3.281 -4.742) 5.835 12.505 ( -14.394 0.825 12.443) 19.045 12.936 ( 2.883 -1.783 -15.450) 15.817 17.121 ( -9.600 0.149 -7.212) 12.008 17.870 ( 4.620 -1.218 8.076) 9.383 18.501 ( -9.407 2.418 3.240) 10.239 18.951 ( -17.304 -3.274 4.074) 18.076 20.207 ( 1.719 5.150 -24.236) 24.837 21.882 ( 10.319 -4.494 18.351) 21.527 22.994 ( 6.994 2.568 3.040) 8.047 23.329 ( 9.863 -1.566 -0.815) 10.020 ======================= Grid point 533 (264/361) ======================= q-point: (-0.70 0.10 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.388 ( 1.577 -6.506 -5.692) 8.787 2.862 ( -8.048 6.248 6.977) 12.348 3.050 ( 0.825 0.435 -10.475) 10.517 3.316 ( -2.390 -4.639 1.711) 5.492 3.555 ( 6.637 -3.810 -3.328) 8.345 3.776 ( -0.750 8.523 10.712) 13.710 4.319 ( 12.188 3.452 4.571) 13.467 4.539 ( -2.553 -4.173 0.843) 4.964 4.953 ( -11.551 0.885 4.017) 12.262 5.183 ( -16.427 -7.483 -0.377) 18.055 5.549 ( -7.556 1.112 -0.445) 7.650 5.630 ( -8.354 -3.378 3.425) 9.640 6.255 ( 3.932 -0.171 -4.871) 6.263 6.511 ( 4.091 -2.524 0.997) 4.909 7.369 ( -3.641 12.069 -3.907) 13.198 7.680 ( -13.929 2.151 2.478) 14.310 8.229 ( -7.814 1.367 10.953) 13.524 8.686 ( -3.230 -7.552 -0.977) 8.271 8.881 ( 1.696 -6.702 -1.497) 7.073 9.233 ( -5.573 0.234 13.394) 14.509 10.172 ( 9.595 11.090 1.133) 14.709 10.345 ( 13.700 7.480 0.933) 15.637 11.041 ( 19.748 4.635 -21.531) 29.581 11.453 ( 10.928 -4.234 2.955) 12.086 12.107 ( 2.100 -1.995 2.046) 3.546 12.248 ( -3.558 -2.658 -4.348) 6.215 12.472 ( -10.480 -0.664 13.868) 17.395 12.865 ( 4.985 -9.605 -12.898) 16.837 16.936 ( -8.752 0.723 -1.065) 8.846 17.990 ( -1.031 -3.808 2.226) 4.530 18.444 ( -0.121 4.396 4.424) 6.238 18.818 ( -11.736 -3.708 3.130) 12.700 19.941 ( 2.932 6.460 -18.324) 19.649 22.176 ( -1.362 -8.564 11.449) 14.362 23.094 ( 10.169 9.807 1.513) 14.209 23.512 ( 9.399 -6.145 4.196) 11.988 ======================= Grid point 534 (265/361) ======================= q-point: (-0.60 0.10 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.390 ( -5.022 -2.569 1.379) 5.807 2.744 ( -12.927 7.725 7.242) 16.710 3.029 ( 7.625 -6.631 -6.621) 12.081 3.318 ( -2.080 -2.920 -1.453) 3.868 3.607 ( 1.153 -6.735 -3.586) 7.716 3.812 ( 0.917 10.858 9.646) 14.553 4.429 ( -16.546 -1.999 -0.452) 16.673 4.487 ( 8.173 2.794 3.954) 9.499 4.932 ( -1.808 -1.325 7.836) 8.150 5.137 ( -3.333 -9.002 1.637) 9.738 5.441 ( -2.704 1.648 -2.119) 3.810 5.604 ( -6.686 -4.705 4.185) 9.185 6.269 ( 1.071 -1.892 -0.016) 2.175 6.570 ( 0.125 -3.204 -0.658) 3.273 7.109 ( -8.016 8.984 -10.654) 16.077 7.518 ( -14.168 -0.907 4.619) 14.930 8.235 ( -4.441 3.743 9.045) 10.749 8.686 ( -7.006 -8.543 2.191) 11.264 9.008 ( 5.542 -3.726 3.829) 7.698 9.300 ( -7.378 -1.747 12.676) 14.770 10.129 ( 9.113 20.597 -5.254) 23.128 10.471 ( 8.886 6.073 2.348) 11.016 10.989 ( 17.750 6.405 -23.327) 30.004 11.575 ( 1.579 -4.438 -0.370) 4.725 12.084 ( -7.967 2.298 2.821) 8.759 12.190 ( -1.646 -4.066 -4.809) 6.510 12.563 ( 2.265 1.663 7.913) 8.397 12.963 ( 7.886 -17.110 -6.182) 19.828 16.876 ( -4.337 -1.150 7.227) 8.507 17.949 ( -4.810 -6.922 -9.007) 12.336 18.490 ( 5.033 9.484 4.611) 11.685 18.790 ( 0.184 -1.142 3.090) 3.299 19.750 ( -0.162 3.232 -10.260) 10.759 22.282 ( -10.115 -12.346 6.208) 17.126 23.125 ( 9.907 13.567 -1.903) 16.906 23.761 ( 6.920 -7.544 6.318) 12.030 ======================= Grid point 535 (266/361) ======================= q-point: (-0.50 0.10 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.334 ( -8.619 4.235 7.695) 12.306 2.512 ( -20.287 13.575 9.549) 26.211 3.198 ( 7.698 -13.430 -2.817) 15.734 3.310 ( 4.175 -1.472 -2.864) 5.273 3.651 ( -1.948 -10.731 -0.989) 10.951 3.824 ( 4.460 13.691 4.167) 14.990 4.180 ( -21.733 -7.427 -1.274) 23.003 4.583 ( 1.041 0.392 4.880) 5.005 5.089 ( 6.310 -1.886 9.819) 11.823 5.186 ( -0.493 -1.664 0.155) 1.742 5.428 ( 5.188 0.019 -1.776) 5.484 5.633 ( -2.464 -4.635 4.906) 7.185 6.331 ( -1.068 -5.687 5.813) 8.202 6.526 ( -8.803 -3.787 -4.434) 10.559 6.813 ( -6.615 1.745 -10.229) 12.306 7.404 ( -13.430 -3.530 5.103) 14.795 8.265 ( -1.281 6.753 10.650) 12.675 8.683 ( -11.533 -7.603 6.466) 15.252 9.149 ( 5.863 0.245 3.200) 6.684 9.355 ( -7.551 -3.648 9.498) 12.671 9.963 ( 3.238 21.053 -5.490) 21.997 10.528 ( 7.392 9.143 -0.123) 11.758 10.882 ( 15.743 6.595 -24.312) 29.705 11.601 ( -3.008 -3.907 -0.258) 4.938 11.989 ( -8.479 2.133 5.726) 10.451 12.159 ( -0.192 -3.293 -3.483) 4.797 12.628 ( 2.500 3.435 1.717) 4.582 13.164 ( 8.775 -14.471 -6.172) 18.014 17.016 ( 2.323 -5.198 13.030) 14.220 17.818 ( -1.329 -7.460 -13.763) 15.711 18.483 ( 3.397 11.566 0.562) 12.068 18.910 ( 11.132 1.567 3.035) 11.644 19.632 ( -3.888 0.180 -3.529) 5.254 22.289 ( -15.066 -16.050 4.420) 22.453 23.100 ( 8.936 13.073 -4.272) 16.401 23.923 ( 0.571 -4.920 1.386) 5.143 ======================= Grid point 536 (267/361) ======================= q-point: (-0.40 0.10 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.176 ( -15.983 17.348 9.800) 25.543 2.342 ( -11.443 5.106 17.116) 21.212 3.256 ( -4.634 -6.237 -2.248) 8.089 3.453 ( 7.758 -6.019 -1.064) 9.877 3.687 ( -1.049 -5.793 -1.928) 6.194 3.824 ( 6.531 7.048 0.899) 9.651 3.983 ( -13.605 -11.422 -2.986) 18.013 4.646 ( -2.290 -1.755 5.884) 6.554 5.123 ( -3.301 1.223 -3.098) 4.690 5.351 ( 9.747 2.310 12.643) 16.131 5.521 ( 10.486 -2.005 -2.468) 10.958 5.733 ( 2.757 -2.839 5.650) 6.898 6.294 ( -16.691 -6.241 -8.319) 19.666 6.484 ( -2.358 -10.470 12.302) 16.326 6.679 ( -1.926 -1.932 -6.819) 7.344 7.341 ( -11.663 -6.512 6.417) 14.820 8.322 ( -0.940 8.468 12.894) 15.455 8.660 ( -14.289 -6.950 10.097) 18.826 9.210 ( 2.883 5.555 -1.433) 6.421 9.347 ( -6.075 0.594 3.359) 6.967 9.768 ( -4.574 11.683 0.411) 12.553 10.512 ( 7.866 13.513 -4.201) 16.190 10.764 ( 13.693 3.336 -21.737) 25.906 11.525 ( -8.436 0.649 -2.436) 8.805 11.973 ( -4.462 0.072 8.232) 9.364 12.168 ( 2.127 -0.927 -0.215) 2.330 12.626 ( 0.568 4.885 1.029) 5.025 13.277 ( 6.921 -9.501 -11.005) 16.102 17.228 ( 4.428 -4.779 1.666) 6.725 17.842 ( 8.418 -12.464 -0.070) 15.041 18.413 ( 0.983 7.833 -2.709) 8.346 19.115 ( 17.095 3.994 2.328) 17.709 19.535 ( -5.985 1.872 -0.578) 6.298 22.260 ( -18.427 -19.327 3.419) 26.921 23.053 ( 8.253 10.580 -5.909) 14.662 23.871 ( -7.072 0.483 -5.950) 9.254 ======================= Grid point 537 (268/361) ======================= q-point: (-0.30 0.10 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.989 ( -8.913 13.518 13.009) 20.770 2.400 ( -8.618 2.779 21.912) 23.709 3.145 ( -10.471 -3.441 -5.498) 12.317 3.517 ( 1.656 -2.509 -2.742) 4.069 3.731 ( 2.860 -3.276 -0.115) 4.351 3.894 ( 7.603 2.765 -2.126) 8.364 3.935 ( -2.658 -13.797 -5.630) 15.137 4.633 ( -6.798 0.399 -0.433) 6.824 5.086 ( 2.584 2.180 3.547) 4.900 5.532 ( 0.775 3.452 9.878) 10.493 5.735 ( 17.330 -2.742 1.218) 17.588 5.874 ( 3.633 -2.672 5.582) 7.176 6.053 ( -11.784 -5.288 -5.573) 14.067 6.574 ( -3.142 -1.543 -8.122) 8.844 6.731 ( -3.322 -15.550 16.406) 22.847 7.343 ( -11.692 -9.922 9.069) 17.815 8.386 ( -1.897 8.953 14.384) 17.049 8.665 ( -11.413 -5.727 11.513) 17.193 9.044 ( -4.215 12.553 -7.951) 15.446 9.325 ( -1.344 0.399 2.102) 2.526 9.649 ( -10.988 3.438 7.640) 13.818 10.399 ( 8.505 16.909 -10.959) 21.872 10.715 ( 12.146 -1.189 -16.314) 20.373 11.309 ( -13.558 3.906 -4.402) 14.781 12.032 ( -1.807 0.984 9.085) 9.315 12.224 ( 5.164 1.511 1.138) 5.500 12.592 ( -1.374 5.287 2.062) 5.839 13.284 ( 5.961 -6.682 -13.927) 16.558 17.270 ( 6.049 -2.402 -7.533) 9.956 18.196 ( 4.065 -20.022 6.955) 21.582 18.337 ( 8.758 6.264 -3.360) 11.280 19.284 ( -1.050 -0.652 -1.385) 1.856 19.497 ( 14.110 10.882 6.279) 18.893 22.181 ( -21.682 -20.177 -0.617) 29.624 23.012 ( 7.650 7.057 -6.461) 12.250 23.605 ( -12.101 6.626 -9.632) 16.826 ======================= Grid point 538 (269/361) ======================= q-point: (-0.20 0.10 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.007 ( 1.028 6.060 13.340) 14.688 2.569 ( -4.698 -0.911 23.802) 24.278 2.952 ( -9.287 -2.591 -6.710) 11.747 3.502 ( -0.492 -5.849 -7.916) 9.855 3.815 ( 6.474 0.510 1.110) 6.588 3.838 ( 1.783 -2.765 -15.096) 15.450 4.015 ( 2.079 -5.561 0.115) 5.938 4.472 ( -7.400 3.617 -5.270) 9.778 5.221 ( 5.146 0.365 9.911) 11.173 5.595 ( -2.606 5.056 10.570) 12.004 5.830 ( -8.634 -0.740 1.675) 8.826 6.034 ( 9.888 -1.524 2.205) 10.245 6.056 ( 9.996 -2.550 -1.045) 10.369 6.444 ( -3.266 -2.639 -7.729) 8.795 7.030 ( -3.284 -16.422 17.115) 23.945 7.410 ( -12.068 -15.475 12.430) 23.230 8.446 ( -2.498 9.933 14.894) 18.076 8.676 ( -9.825 0.474 8.468) 12.979 8.791 ( -2.275 10.280 -6.984) 12.635 9.346 ( -1.694 -5.435 1.884) 5.997 9.577 ( -11.890 1.796 12.058) 17.029 10.229 ( 8.701 17.994 -10.947) 22.789 10.695 ( 8.482 -0.795 -16.361) 18.446 11.017 ( -11.796 3.183 -6.712) 13.940 12.103 ( -1.518 2.451 8.946) 9.399 12.294 ( 7.615 4.263 -0.576) 8.746 12.551 ( -3.641 3.334 3.819) 6.242 13.255 ( 5.861 -5.713 -13.771) 16.020 17.313 ( 8.119 -1.707 -4.562) 9.468 18.145 ( -6.581 -2.781 -9.361) 11.776 18.675 ( 15.703 -10.824 5.501) 19.850 19.132 ( -12.266 1.179 -0.777) 12.347 19.833 ( 25.877 8.961 12.672) 30.174 21.966 ( -24.629 -15.820 -9.746) 30.852 22.993 ( 6.180 3.567 -5.228) 8.845 23.266 ( -10.427 8.750 -7.044) 15.326 ======================= Grid point 539 (270/361) ======================= q-point: (-0.10 0.10 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.196 ( 8.656 1.518 11.993) 14.868 2.717 ( -5.154 -0.635 -0.225) 5.198 2.909 ( 0.118 -5.960 14.894) 16.042 3.430 ( -2.129 -6.479 -9.108) 11.378 3.672 ( -1.090 -0.873 -15.896) 15.958 3.883 ( 4.607 1.535 -4.065) 6.333 4.073 ( 0.890 -2.635 0.906) 2.925 4.275 ( -4.331 5.543 -5.573) 8.975 5.411 ( 3.226 -0.809 11.118) 11.605 5.626 ( -5.323 5.487 12.105) 14.316 5.757 ( -4.902 1.366 2.220) 5.551 6.040 ( -2.006 1.640 -4.692) 5.360 6.221 ( 8.002 -0.830 -1.951) 8.278 6.395 ( 2.029 -3.821 -4.844) 6.495 7.298 ( -4.496 -9.666 19.005) 21.790 7.590 ( -8.511 -25.035 11.085) 28.671 8.453 ( -8.357 17.848 14.393) 24.403 8.560 ( -6.265 2.199 1.823) 6.886 8.712 ( 4.509 4.274 -0.272) 6.219 9.404 ( -5.040 -9.377 3.932) 11.348 9.601 ( -4.189 -2.346 9.168) 10.349 10.099 ( 8.581 18.498 -2.248) 20.515 10.493 ( -6.558 3.974 -13.844) 15.826 10.890 ( 9.368 -2.414 -13.128) 16.307 12.140 ( -2.580 3.725 6.350) 7.801 12.337 ( 7.651 5.368 -2.851) 9.772 12.534 ( -5.679 -0.196 6.874) 8.919 13.226 ( 5.375 -4.438 -12.528) 14.336 17.411 ( 8.415 -0.724 -0.448) 8.458 17.923 ( -7.220 0.484 -13.661) 15.459 18.882 ( -12.818 -4.880 5.771) 14.881 19.053 ( 7.964 -2.500 0.154) 8.348 20.307 ( 25.251 4.501 17.544) 31.075 21.556 ( -23.891 -7.235 -18.931) 31.329 22.963 ( -2.565 3.755 -1.260) 4.719 23.080 ( 3.350 2.830 -5.016) 6.663 ======================= Grid point 542 (271/361) ======================= q-point: ( 0.20 0.20 -0.62) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.328 ( 3.378 0.000 -7.369) 8.106 2.924 ( -6.424 -0.000 6.594) 9.206 3.064 ( -0.760 -0.000 -14.145) 14.166 3.251 ( -2.767 -0.000 1.600) 3.196 3.524 ( 6.023 0.000 -1.779) 6.281 3.861 ( -2.681 -0.000 13.615) 13.877 4.364 ( 12.189 0.000 7.031) 14.071 4.479 ( 0.542 0.000 -1.303) 1.411 4.982 ( -7.676 -0.000 3.761) 8.548 5.094 ( -22.954 -0.000 -1.098) 22.980 5.578 ( -8.771 -0.000 4.027) 9.652 5.586 ( -7.689 -0.000 0.908) 7.743 6.252 ( 3.582 0.000 -5.372) 6.457 6.488 ( 4.034 0.000 1.254) 4.224 7.503 ( -3.996 -0.000 -2.887) 4.929 7.665 ( -18.443 -0.000 -1.081) 18.475 8.268 ( -10.569 -0.000 18.294) 21.127 8.600 ( 2.956 0.000 -9.949) 10.379 8.814 ( 3.992 0.000 -1.000) 4.115 9.238 ( -7.502 -0.000 15.272) 17.015 10.238 ( 5.824 0.000 9.438) 11.090 10.462 ( 21.370 0.000 -9.050) 23.208 11.084 ( 20.055 0.000 -21.830) 29.644 11.413 ( 11.295 0.000 5.357) 12.501 12.086 ( 3.551 0.000 2.992) 4.643 12.207 ( -3.341 -0.000 -4.939) 5.963 12.468 ( -12.770 -0.000 15.934) 20.420 12.782 ( 3.509 0.000 -15.637) 16.026 16.943 ( -9.130 -0.000 -1.068) 9.192 17.957 ( -1.548 -0.000 1.570) 2.205 18.488 ( -0.778 -0.000 6.766) 6.811 18.780 ( -10.449 -0.000 3.948) 11.170 19.998 ( 2.647 0.000 -21.361) 21.524 22.098 ( -2.250 -0.000 12.434) 12.636 23.208 ( 10.980 0.000 8.076) 13.630 23.432 ( 8.689 0.000 -1.564) 8.828 ======================= Grid point 543 (272/361) ======================= q-point: (-0.70 0.20 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.343 ( 3.296 -1.865 -0.206) 3.793 2.848 ( -8.497 3.280 1.920) 9.308 2.958 ( 1.433 -1.449 -5.197) 5.583 3.241 ( -1.025 -3.796 -1.804) 4.326 3.537 ( -0.968 -1.540 -2.392) 3.005 3.956 ( -5.830 4.003 14.874) 16.470 4.428 ( -7.200 2.806 -1.687) 7.910 4.552 ( 6.087 2.234 1.813) 6.733 4.839 ( -11.666 -6.784 3.724) 14.000 5.042 ( 3.396 -1.683 6.945) 7.912 5.482 ( -5.038 2.945 1.093) 5.937 5.539 ( -7.191 -3.310 4.687) 9.200 6.240 ( -0.642 -1.050 -1.020) 1.599 6.529 ( -0.255 -1.248 -0.115) 1.279 7.267 ( -17.532 8.228 -8.044) 20.971 7.439 ( -10.706 -6.265 -3.415) 12.866 8.326 ( -7.840 4.374 16.783) 19.034 8.549 ( 1.057 -5.494 -6.503) 8.579 8.955 ( 9.408 -1.874 4.282) 10.505 9.285 ( -11.727 -0.189 15.766) 19.650 10.360 ( 6.224 5.298 -0.185) 8.175 10.618 ( 18.909 7.750 -5.683) 21.211 11.068 ( 18.322 2.431 -24.480) 30.674 11.524 ( 0.591 -1.311 0.639) 1.574 12.107 ( -6.053 0.460 2.520) 6.572 12.121 ( -3.328 -3.021 -3.271) 5.559 12.591 ( 2.695 2.022 12.078) 12.540 12.718 ( 5.916 -9.350 -8.198) 13.770 16.862 ( -6.299 -0.385 6.357) 8.957 17.866 ( -5.027 -2.387 -9.007) 10.588 18.616 ( 4.983 4.185 9.966) 11.902 18.773 ( 2.201 -0.682 3.904) 4.533 19.781 ( -1.007 0.612 -16.858) 16.899 22.133 ( -10.775 -4.385 7.193) 13.677 23.365 ( 8.477 13.192 3.152) 15.995 23.596 ( 7.026 -10.934 3.220) 13.389 ======================= Grid point 544 (273/361) ======================= q-point: (-0.60 0.20 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.395 ( -2.679 3.133 7.571) 8.620 2.725 ( -11.112 8.513 7.026) 15.662 2.986 ( 4.012 -8.324 -3.279) 9.805 3.256 ( 3.504 -4.266 -3.761) 6.680 3.507 ( -2.393 -5.391 -2.314) 6.336 3.956 ( -15.065 -2.960 8.498) 17.548 4.187 ( -7.054 12.492 -2.401) 14.546 4.603 ( -0.827 -0.612 4.017) 4.146 4.941 ( 0.206 -9.581 5.963) 11.287 5.215 ( 7.890 2.027 7.995) 11.414 5.445 ( 2.392 1.923 -0.061) 3.070 5.564 ( -4.188 -3.819 8.245) 10.005 6.240 ( -3.900 -4.223 3.291) 6.624 6.472 ( -10.853 -2.244 -1.756) 11.220 6.859 ( -15.416 2.960 -8.916) 18.053 7.317 ( -7.707 -5.024 -4.448) 10.219 8.380 ( -5.710 5.451 15.955) 17.801 8.549 ( -2.955 -6.776 -1.719) 7.589 9.156 ( 9.849 0.469 4.804) 10.968 9.297 ( -14.247 -2.078 15.601) 21.230 10.297 ( 5.687 13.944 -10.043) 18.101 10.714 ( 12.802 11.382 -1.306) 17.179 10.979 ( 17.450 4.281 -27.370) 32.740 11.523 ( -4.115 -4.360 0.646) 6.030 12.026 ( -8.851 1.615 4.819) 10.206 12.103 ( -0.524 -2.904 0.127) 2.954 12.643 ( 4.892 -1.628 -5.360) 7.437 12.937 ( 7.111 -9.634 5.347) 13.114 16.945 ( -0.448 -2.757 13.577) 13.861 17.694 ( -3.069 -5.478 -14.980) 16.243 18.707 ( 4.118 11.712 4.663) 13.262 18.931 ( 13.382 0.777 3.606) 13.881 19.593 ( -4.175 -3.786 -10.297) 11.738 22.075 ( -15.628 -8.235 5.501) 18.502 23.342 ( 6.078 14.184 -2.052) 15.567 23.792 ( 1.234 -9.736 2.353) 10.092 ======================= Grid point 545 (274/361) ======================= q-point: (-0.50 0.20 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.400 ( -7.436 5.832 12.719) 15.845 2.524 ( -14.549 17.785 10.088) 25.095 3.088 ( -1.720 -12.296 -1.161) 12.470 3.345 ( 8.416 -5.614 -3.043) 10.564 3.524 ( -1.293 -10.049 -3.412) 10.691 3.796 ( -18.712 -9.229 2.081) 20.968 4.056 ( 6.350 14.977 -1.918) 16.380 4.640 ( -3.754 0.416 7.331) 8.247 5.050 ( -2.667 -7.130 2.400) 7.982 5.415 ( 10.527 3.717 9.575) 14.707 5.504 ( 8.010 0.515 -1.093) 8.100 5.684 ( -0.844 -3.414 11.836) 12.348 6.196 ( -19.608 -4.601 -5.443) 20.863 6.316 ( -7.676 -8.492 10.444) 15.496 6.653 ( -3.477 -0.865 -6.193) 7.155 7.224 ( -6.082 -6.087 -3.050) 9.130 8.437 ( -7.619 4.559 16.796) 18.998 8.540 ( -5.891 -6.152 1.654) 8.677 9.287 ( -14.730 -3.294 15.461) 21.606 9.307 ( 6.697 4.425 1.100) 8.102 10.066 ( 2.685 17.327 -13.784) 22.304 10.734 ( 6.220 10.064 -1.509) 11.927 10.854 ( 19.075 8.151 -27.396) 34.364 11.497 ( -6.322 -3.915 -0.868) 7.487 11.979 ( -5.889 0.533 7.337) 9.423 12.155 ( 2.636 -0.491 3.520) 4.425 12.660 ( 3.341 -1.206 -3.938) 5.303 13.118 ( 3.415 -7.556 -0.313) 8.297 17.162 ( 3.965 -2.592 9.460) 10.580 17.602 ( 2.423 -12.666 -7.806) 15.074 18.633 ( 1.740 15.150 -2.423) 15.441 19.164 ( 14.245 1.248 2.081) 14.450 19.513 ( 0.636 -3.928 -3.754) 5.471 21.988 ( -18.782 -11.561 5.421) 22.711 23.258 ( 4.876 12.387 -4.800) 14.151 23.823 ( -5.665 -5.607 -3.676) 8.778 ======================= Grid point 546 (275/361) ======================= q-point: (-0.40 0.20 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.265 ( -11.822 17.018 9.562) 22.821 2.447 ( -9.212 3.499 18.554) 21.009 3.067 ( -9.929 -5.728 -2.746) 11.787 3.438 ( -1.436 -6.688 -2.702) 7.354 3.553 ( 2.616 -14.516 -7.556) 16.572 3.776 ( -3.774 -5.729 7.434) 10.115 4.014 ( 12.482 10.138 -8.529) 18.202 4.624 ( -8.494 -1.014 2.181) 8.828 5.104 ( 1.761 -0.302 5.526) 5.808 5.592 ( 3.791 3.172 7.315) 8.829 5.680 ( 14.334 -2.600 3.451) 14.971 5.834 ( -5.077 -2.179 12.789) 13.931 5.962 ( -8.692 -5.092 -2.251) 10.322 6.462 ( -7.562 -14.068 12.213) 20.106 6.554 ( -2.349 -1.334 -5.282) 5.933 7.185 ( -6.372 -7.867 0.205) 10.126 8.484 ( -9.077 1.943 16.343) 18.795 8.554 ( -5.680 -5.021 6.569) 10.031 9.218 ( -12.349 3.037 3.678) 13.238 9.337 ( -0.959 5.786 4.786) 7.570 9.812 ( 0.437 12.133 -8.754) 14.968 10.697 ( 5.471 6.477 -5.369) 10.035 10.717 ( 18.010 11.834 -25.125) 33.101 11.360 ( -11.585 1.516 -3.375) 12.161 12.027 ( -2.293 -1.512 8.531) 8.963 12.262 ( 6.732 2.699 5.061) 8.844 12.657 ( 0.355 1.412 -1.049) 1.795 13.165 ( 0.667 -6.165 -5.724) 8.439 17.235 ( 5.749 -1.280 -6.415) 8.709 17.853 ( 5.596 -18.407 10.254) 21.801 18.486 ( 2.520 10.603 -5.760) 12.327 19.240 ( -5.901 -4.608 -1.770) 7.693 19.661 ( 23.675 7.641 2.667) 25.020 21.879 ( -21.632 -13.830 3.822) 25.958 23.160 ( 4.585 9.400 -6.355) 12.238 23.659 ( -10.341 -0.171 -8.766) 13.557 ======================= Grid point 547 (276/361) ======================= q-point: (-0.30 0.20 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.151 ( -3.364 10.024 10.551) 14.938 2.552 ( -7.294 -0.423 21.144) 22.370 2.902 ( -10.557 -3.056 -4.852) 12.014 3.391 ( -4.578 -7.533 -7.325) 11.461 3.634 ( 2.562 -12.225 -8.457) 15.084 3.871 ( 1.814 -0.405 5.389) 5.700 4.020 ( 12.623 5.058 -9.560) 16.623 4.492 ( -8.937 -1.039 -3.739) 9.743 5.245 ( 4.944 2.097 10.838) 12.095 5.682 ( -0.088 4.659 9.538) 10.616 5.813 ( -7.297 -1.047 5.735) 9.340 5.947 ( 10.169 -6.849 3.829) 12.844 6.041 ( 6.023 -0.378 3.870) 7.170 6.406 ( -5.562 -2.018 -6.453) 8.755 6.711 ( -4.223 -18.211 14.412) 23.605 7.187 ( -8.641 -10.415 4.275) 14.192 8.539 ( -7.878 1.742 15.757) 17.703 8.618 ( -5.758 -5.291 8.923) 11.864 8.990 ( -5.855 10.829 -7.114) 14.218 9.328 ( -8.543 2.030 11.574) 14.528 9.664 ( -1.184 7.165 -2.898) 7.819 10.548 ( 13.232 18.453 -15.737) 27.627 10.676 ( 10.490 -0.824 -14.555) 17.960 11.093 ( -14.035 4.970 -5.633) 15.919 12.113 ( -2.078 -1.525 8.471) 8.855 12.392 ( 9.666 6.721 3.696) 12.340 12.617 ( -3.934 3.343 2.054) 5.556 13.139 ( 1.235 -6.866 -9.421) 11.723 17.280 ( 8.276 -1.888 -3.973) 9.372 18.077 ( -4.517 -5.786 0.904) 7.396 18.505 ( 11.385 -6.801 0.111) 13.262 19.115 ( -10.559 -3.068 -3.548) 11.554 20.016 ( 28.250 11.024 8.934) 31.613 21.701 ( -23.713 -13.587 -2.309) 27.427 23.081 ( 4.839 6.058 -6.249) 9.958 23.380 ( -10.506 4.119 -9.173) 14.543 ======================= Grid point 548 (277/361) ======================= q-point: (-0.20 0.20 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.241 ( 6.126 3.780 10.911) 13.072 2.693 ( -6.750 -2.165 6.781) 9.809 2.804 ( -1.248 -4.914 6.863) 8.533 3.295 ( -4.947 -8.624 -8.513) 13.089 3.608 ( 0.046 -5.255 -10.971) 12.165 3.933 ( 4.747 3.050 -4.170) 7.016 4.049 ( 4.027 -0.521 -0.540) 4.096 4.339 ( -3.851 1.657 -5.572) 6.973 5.426 ( 3.658 2.213 11.963) 12.704 5.727 ( -4.552 5.767 11.249) 13.436 5.789 ( -3.334 2.166 2.547) 4.722 6.075 ( -2.536 2.186 -3.161) 4.605 6.170 ( 8.420 -5.705 1.283) 10.252 6.332 ( 1.048 -2.382 -2.411) 3.547 7.016 ( -2.084 -21.782 14.752) 26.390 7.239 ( -9.158 -14.401 7.818) 18.772 8.587 ( -8.319 1.005 10.464) 13.406 8.642 ( -9.308 3.199 11.136) 14.862 8.803 ( 2.247 5.891 -4.773) 7.908 9.344 ( -6.141 1.644 11.040) 12.739 9.584 ( -2.107 1.242 0.969) 2.631 10.417 ( 10.801 17.207 -9.755) 22.536 10.587 ( -0.697 6.370 -11.274) 12.968 10.859 ( 3.680 -0.278 -11.953) 12.509 12.185 ( -2.747 0.287 7.958) 8.424 12.468 ( 8.069 8.756 -0.905) 11.941 12.551 ( -7.123 2.793 5.575) 9.467 13.119 ( 3.730 -7.367 -10.499) 13.358 17.396 ( 8.491 -0.851 1.199) 8.618 17.943 ( -6.522 1.819 -9.485) 11.654 18.737 ( -2.975 -11.592 3.948) 12.602 19.002 ( 1.562 -3.243 -2.829) 4.578 20.425 ( 21.744 8.815 15.577) 28.163 21.407 ( -19.743 -9.005 -12.295) 24.941 23.035 ( 1.619 4.164 -3.818) 5.877 23.142 ( -2.829 3.807 -6.379) 7.950 ======================= Grid point 549 (278/361) ======================= q-point: (-0.10 0.20 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.465 ( 9.172 0.072 9.393) 13.129 2.625 ( 1.508 1.668 -5.652) 6.083 3.014 ( 0.343 -9.737 9.992) 13.956 3.247 ( -2.219 -9.785 -3.471) 10.617 3.521 ( -0.246 0.375 -4.898) 4.918 3.830 ( -1.937 2.565 -10.868) 11.334 4.064 ( -2.567 1.150 -0.513) 2.859 4.297 ( 6.811 3.070 -0.331) 7.478 5.555 ( -2.506 2.358 10.321) 10.880 5.692 ( -10.797 3.164 4.997) 12.311 5.738 ( -2.783 3.663 2.109) 5.061 5.940 ( -5.625 2.359 -3.747) 7.159 6.281 ( 5.331 0.528 -1.684) 5.615 6.348 ( 1.594 -2.058 -3.476) 4.343 7.341 ( -5.707 -26.362 8.352) 28.236 7.389 ( -1.182 -12.171 13.768) 18.414 8.466 ( -11.894 6.602 3.744) 14.109 8.657 ( -5.443 6.846 12.760) 15.470 8.817 ( 4.764 0.348 2.383) 5.338 9.369 ( -0.850 0.899 1.485) 1.932 9.633 ( 0.140 -4.558 6.726) 8.126 10.179 ( -9.482 9.309 -6.706) 14.884 10.537 ( 16.590 13.053 0.574) 21.118 10.872 ( 16.560 -3.498 -16.654) 23.745 12.190 ( -4.101 4.554 3.918) 7.274 12.451 ( 2.636 5.253 -2.324) 6.320 12.523 ( -6.553 0.989 8.092) 10.460 13.113 ( 5.047 -4.721 -10.972) 12.967 17.535 ( 5.214 0.228 3.456) 6.260 17.689 ( -5.860 3.363 -12.261) 14.000 18.689 ( -14.901 -5.650 4.315) 16.510 19.128 ( 5.666 -3.878 0.538) 6.887 20.693 ( -9.805 -7.040 4.028) 12.725 21.182 ( 13.550 6.936 -4.908) 15.994 22.940 ( -2.830 3.392 -1.124) 4.558 23.124 ( 7.796 0.639 -3.653) 8.633 ======================= Grid point 553 (279/361) ======================= q-point: ( 0.30 -0.70 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.431 ( 2.004 0.000 7.983) 8.231 2.758 ( -3.520 -0.000 -2.144) 4.122 2.959 ( -1.224 -0.000 4.563) 4.724 3.201 ( 2.622 0.000 -4.244) 4.989 3.462 ( -4.558 -0.000 -2.172) 5.049 3.907 ( -21.895 -0.000 6.655) 22.884 4.392 ( -2.228 -0.000 -2.280) 3.188 4.521 ( -2.106 -0.000 4.241) 4.735 4.861 ( 1.433 0.000 8.333) 8.456 5.231 ( 9.796 0.000 7.472) 12.320 5.489 ( 3.661 0.000 -1.922) 4.135 5.503 ( -8.607 -0.000 12.918) 15.522 6.200 ( -5.471 -0.000 3.042) 6.260 6.452 ( -11.164 -0.000 -1.211) 11.230 6.890 ( -21.156 -0.000 -7.338) 22.393 7.267 ( -2.575 -0.000 -8.954) 9.317 8.432 ( -10.512 -0.000 19.221) 21.908 8.482 ( 2.090 0.000 -5.453) 5.840 9.161 ( 12.262 0.000 5.052) 13.263 9.280 ( -16.027 -0.000 16.772) 23.198 10.416 ( 5.837 0.000 -9.221) 10.914 10.836 ( 13.738 0.000 -3.907) 14.283 11.025 ( 22.000 0.000 -30.120) 37.299 11.475 ( -8.276 -0.000 2.122) 8.543 12.042 ( -8.473 -0.000 4.422) 9.558 12.071 ( -0.491 -0.000 2.270) 2.322 12.612 ( 7.007 0.000 -11.316) 13.310 12.857 ( 5.481 0.000 12.944) 14.056 16.921 ( -1.428 -0.000 13.758) 13.832 17.645 ( -3.601 -0.000 -15.660) 16.069 18.823 ( 4.389 0.000 8.995) 10.009 18.937 ( 14.117 0.000 3.785) 14.616 19.548 ( -4.384 -0.000 -15.344) 15.958 22.003 ( -15.610 -0.000 5.946) 16.704 23.556 ( 4.850 0.000 -4.763) 6.798 23.617 ( 1.513 0.000 6.214) 6.395 ======================= Grid point 555 (280/361) ======================= q-point: (-0.60 0.30 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.505 ( -5.170 5.884 11.541) 13.947 2.749 ( -2.636 0.652 5.282) 5.939 2.956 ( -4.187 4.895 2.403) 6.875 3.220 ( 0.618 -9.705 -3.036) 10.188 3.386 ( -3.157 -4.080 -4.378) 6.766 3.678 ( -15.129 -3.634 2.804) 15.810 4.287 ( 0.328 9.484 -2.518) 9.818 4.614 ( -1.674 -3.528 5.433) 6.691 4.968 ( 0.063 -1.359 7.942) 8.058 5.440 ( 9.988 -0.475 4.247) 10.864 5.541 ( 6.054 3.245 2.921) 7.465 5.619 ( -3.084 -3.521 16.151) 16.815 6.150 ( -19.943 -0.184 -0.339) 19.947 6.196 ( -13.562 -5.013 7.020) 16.073 6.647 ( -5.235 -0.091 -5.390) 7.514 7.147 ( -0.621 -2.386 -9.248) 9.571 8.454 ( -2.427 -2.168 -0.935) 3.386 8.493 ( -10.439 0.968 17.306) 20.234 9.246 ( -18.466 -1.018 17.680) 25.585 9.370 ( 11.139 1.956 3.118) 11.731 10.288 ( 4.100 6.929 -19.196) 20.816 10.824 ( 5.820 1.708 -15.438) 16.587 11.048 ( 24.108 10.320 -17.553) 31.556 11.398 ( -8.867 -6.117 2.203) 10.996 11.989 ( -7.398 0.475 6.123) 9.615 12.148 ( 3.338 -0.289 6.479) 7.293 12.611 ( 6.754 -2.700 -7.837) 10.692 13.035 ( 0.591 -2.078 7.873) 8.164 17.137 ( 3.848 -0.507 17.517) 17.942 17.440 ( 0.118 -5.105 -15.931) 16.730 18.886 ( 0.747 11.666 1.489) 11.785 19.142 ( 3.276 -3.746 -1.104) 5.098 19.434 ( 13.723 -3.406 -6.452) 15.542 21.856 ( -18.410 -3.671 6.362) 19.821 23.470 ( 1.975 11.108 -5.092) 12.378 23.690 ( -4.373 -8.819 -1.316) 9.931 ======================= Grid point 556 (281/361) ======================= q-point: (-0.50 0.30 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.484 ( -11.092 6.721 12.211) 17.813 2.618 ( -9.753 16.859 7.475) 20.862 2.942 ( -5.403 -8.054 -0.010) 9.698 3.238 ( -9.484 -15.576 -3.310) 18.535 3.373 ( 4.816 -5.117 -4.071) 8.121 3.689 ( 1.083 -4.043 6.119) 7.413 4.194 ( 5.768 8.976 -6.469) 12.478 4.598 ( -7.952 -2.054 -0.858) 8.258 5.101 ( 3.800 0.758 10.218) 10.928 5.616 ( 8.010 -2.389 2.041) 8.604 5.660 ( 6.093 1.724 6.683) 9.207 5.814 ( -5.239 -0.095 19.838) 20.519 5.880 ( -12.088 -3.585 0.788) 12.633 6.243 ( -10.144 -10.182 11.781) 18.585 6.541 ( -2.825 -0.356 -5.098) 5.839 7.078 ( 0.113 -4.148 -7.143) 8.261 8.444 ( -4.439 -3.055 4.318) 6.906 8.537 ( -10.542 0.303 16.244) 19.367 9.200 ( -19.624 -1.652 17.010) 26.022 9.482 ( 7.995 6.948 -0.788) 10.621 10.001 ( 0.950 8.501 -21.042) 22.714 10.710 ( 9.794 0.484 -19.270) 21.622 11.015 ( 12.427 15.786 -11.009) 22.909 11.350 ( -6.403 -3.014 -3.119) 7.733 11.990 ( -4.907 -2.205 7.734) 9.421 12.307 ( 8.409 2.099 8.037) 11.820 12.640 ( 4.103 -2.472 -4.800) 6.781 13.090 ( -4.750 -2.381 3.423) 6.321 17.234 ( 5.098 1.147 -7.971) 9.531 17.576 ( 6.292 -12.642 14.341) 20.126 18.695 ( -4.149 12.699 -7.197) 15.175 19.121 ( -7.504 -8.842 -2.755) 11.920 19.760 ( 31.607 3.660 0.638) 31.824 21.703 ( -20.970 -6.388 5.793) 22.674 23.327 ( 0.798 9.449 -6.445) 11.466 23.611 ( -8.357 -4.922 -6.918) 11.914 ======================= Grid point 557 (282/361) ======================= q-point: (-0.40 0.30 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.336 ( -9.124 10.314 8.000) 15.925 2.579 ( -5.715 4.125 14.645) 16.253 2.843 ( -11.220 -3.696 -2.213) 12.018 3.222 ( -4.924 -11.478 -6.132) 13.913 3.459 ( 4.914 -7.357 -3.207) 9.411 3.826 ( -0.124 -3.886 8.155) 9.034 4.141 ( 12.202 7.522 -12.016) 18.705 4.453 ( -9.096 -2.865 -4.982) 10.759 5.284 ( 5.482 2.214 11.625) 13.042 5.748 ( 4.218 1.989 6.006) 7.604 5.793 ( -6.683 -2.135 11.285) 13.288 5.835 ( 5.085 -3.725 3.921) 7.423 6.029 ( 2.728 -0.958 11.412) 11.773 6.319 ( -10.091 -10.036 5.188) 15.148 6.478 ( -3.440 -5.657 2.481) 7.070 7.047 ( -1.559 -5.626 -4.168) 7.173 8.494 ( -3.919 -4.370 7.953) 9.885 8.584 ( -10.191 0.006 16.911) 19.744 9.104 ( -16.681 2.070 8.099) 18.659 9.437 ( 0.485 10.126 -1.481) 10.245 9.765 ( 1.018 3.324 -11.690) 12.196 10.651 ( 14.328 -0.634 -19.757) 24.413 10.883 ( 8.955 17.428 -10.628) 22.291 11.174 ( -10.580 3.946 -5.303) 12.476 12.057 ( -3.666 -4.339 8.069) 9.868 12.512 ( 12.248 6.326 7.161) 15.534 12.640 ( -0.401 -0.932 -2.198) 2.421 13.043 ( -6.494 -3.537 -1.299) 7.508 17.252 ( 8.461 -1.229 -3.914) 9.403 17.934 ( 3.847 -9.429 12.745) 16.314 18.472 ( -2.493 2.314 -8.016) 8.708 19.035 ( -7.735 -5.636 -4.442) 10.551 20.192 ( 33.500 8.471 4.566) 34.855 21.509 ( -23.270 -8.182 1.629) 24.720 23.193 ( 1.195 6.426 -6.464) 9.193 23.412 ( -8.953 -0.295 -9.118) 12.782 ======================= Grid point 558 (283/361) ======================= q-point: (-0.30 0.30 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.326 ( 2.458 5.636 9.562) 11.369 2.652 ( -7.501 -1.829 10.961) 13.407 2.748 ( -0.518 -2.040 0.687) 2.214 3.140 ( -5.977 -8.576 -8.100) 13.224 3.525 ( 2.166 -3.811 -3.384) 5.538 3.919 ( -6.423 -4.463 7.228) 10.650 4.091 ( 10.757 4.826 -13.905) 18.230 4.339 ( 0.076 -1.334 -5.837) 5.988 5.468 ( 3.940 2.034 11.335) 12.171 5.822 ( -2.534 3.120 4.730) 6.207 5.827 ( -1.769 3.462 7.494) 8.443 6.037 ( 4.121 -7.743 7.943) 11.834 6.112 ( -2.038 1.551 -1.728) 3.090 6.296 ( -0.237 -3.170 2.076) 3.797 6.644 ( -4.025 -18.303 12.380) 22.460 7.044 ( -2.842 -8.302 -0.346) 8.782 8.564 ( -5.738 -3.073 7.963) 10.284 8.655 ( -9.121 0.102 17.874) 20.067 8.913 ( -7.170 5.725 -2.783) 9.588 9.382 ( -6.793 2.411 9.886) 12.235 9.644 ( 1.253 4.083 -8.046) 9.109 10.617 ( 11.970 3.480 -18.871) 22.617 10.763 ( 10.692 15.121 -6.136) 19.510 10.909 ( -6.485 6.100 -8.611) 12.386 12.144 ( -3.904 -4.496 8.865) 10.680 12.571 ( -3.101 2.296 -1.835) 4.273 12.667 ( 4.636 9.496 6.161) 12.232 12.991 ( 0.670 -6.406 -5.625) 8.552 17.384 ( 9.108 -0.513 3.233) 9.679 17.986 ( -5.511 2.973 -5.375) 8.253 18.506 ( 0.099 -13.605 3.419) 14.029 18.940 ( -0.839 -3.802 -5.526) 6.760 20.600 ( 20.955 10.627 11.047) 25.963 21.258 ( -15.259 -7.852 -7.306) 18.651 23.104 ( 0.923 3.641 -4.445) 5.819 23.198 ( -4.791 2.327 -7.574) 9.259 ======================= Grid point 559 (284/361) ======================= q-point: (-0.20 0.30 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.479 ( 4.930 1.601 10.169) 11.414 2.658 ( 3.854 1.927 -1.501) 4.563 2.873 ( 2.976 -5.705 6.546) 9.178 3.073 ( -3.423 -9.657 -3.495) 10.826 3.516 ( -0.028 -0.314 -2.365) 2.386 3.835 ( -10.100 -2.933 -4.694) 11.517 4.085 ( 5.776 1.590 -4.495) 7.489 4.338 ( 7.299 1.821 -2.856) 8.047 5.602 ( -0.633 1.671 9.425) 9.593 5.739 ( -9.014 2.559 -1.737) 9.530 5.814 ( -5.870 4.601 5.486) 9.258 5.992 ( -5.444 3.676 -0.678) 6.603 6.214 ( 3.225 -6.124 0.917) 6.982 6.374 ( 5.965 2.527 0.057) 6.479 6.896 ( -5.872 -23.023 9.195) 25.477 7.164 ( 2.948 -12.894 6.852) 14.896 8.540 ( -8.843 2.565 4.836) 10.400 8.734 ( -9.250 2.108 18.310) 20.622 8.820 ( 0.176 0.250 0.188) 0.359 9.416 ( -5.628 0.320 10.255) 11.702 9.555 ( 2.626 -0.383 -6.195) 6.740 10.397 ( -8.046 13.742 -7.283) 17.510 10.762 ( 17.180 10.987 -7.352) 21.678 10.829 ( 14.648 0.622 -11.046) 18.357 12.223 ( -4.570 -1.834 8.723) 10.017 12.463 ( -8.377 0.702 0.869) 8.451 12.642 ( -0.865 6.823 -0.308) 6.885 13.042 ( 8.730 -1.878 -5.820) 10.659 17.550 ( 5.011 1.485 5.994) 7.952 17.749 ( -6.102 3.180 -11.941) 13.782 18.574 ( -10.326 -7.207 3.995) 13.211 19.025 ( 9.986 -7.518 -1.901) 12.643 20.604 ( -23.836 -2.959 -0.610) 24.026 21.299 ( 26.388 6.177 0.696) 27.110 23.000 ( -3.870 3.239 -2.855) 5.798 23.137 ( 5.665 0.739 -3.207) 6.551 ======================= Grid point 560 (285/361) ======================= q-point: (-0.10 -0.70 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.571 ( 0.258 4.203 1.927) 4.631 2.720 ( 6.434 -1.162 -0.039) 6.539 3.049 ( 7.068 -4.824 4.360) 9.604 3.143 ( 1.117 -8.830 0.975) 8.954 3.512 ( -0.981 -2.360 1.981) 3.234 3.662 ( -5.657 -0.329 -6.419) 8.562 4.077 ( 5.065 4.153 -3.818) 7.582 4.427 ( 6.354 0.740 2.451) 6.851 5.494 ( -16.550 3.539 -3.348) 17.252 5.610 ( -10.122 0.696 4.574) 11.129 5.747 ( -3.975 3.638 1.785) 5.676 5.878 ( -6.966 5.529 1.670) 9.049 6.268 ( 2.243 -4.149 -4.875) 6.784 6.406 ( 6.325 6.011 -0.664) 8.751 7.108 ( -4.288 -23.299 4.950) 24.202 7.448 ( 4.307 -14.417 8.575) 17.319 8.420 ( -9.798 6.660 4.627) 12.719 8.767 ( -8.290 5.352 13.439) 16.672 8.896 ( 0.340 -3.838 7.954) 8.838 9.374 ( -1.762 6.463 -4.755) 8.215 9.645 ( 4.727 -13.026 1.213) 13.910 10.131 ( -4.727 12.954 2.155) 13.957 10.855 ( 20.011 -2.385 -16.308) 25.924 10.975 ( 19.814 8.997 2.172) 21.869 12.205 ( -5.100 5.450 2.447) 7.855 12.396 ( -8.603 -4.887 4.293) 10.785 12.562 ( -3.353 3.902 0.718) 5.195 13.078 ( 8.532 3.460 -8.325) 12.413 17.391 ( -10.701 1.240 -12.535) 16.528 17.760 ( 6.385 3.256 7.918) 10.680 18.513 ( -9.690 -3.650 2.618) 10.680 19.158 ( -0.698 -1.024 2.370) 2.674 20.250 ( -17.729 -11.425 -14.876) 25.809 21.677 ( 25.367 10.339 11.147) 29.574 22.919 ( -0.725 1.109 -2.014) 2.411 23.219 ( 8.457 0.104 0.624) 8.480 ======================= Grid point 565 (286/361) ======================= q-point: ( 0.40 -0.60 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.562 ( -10.355 -0.000 10.425) 14.694 2.811 ( 2.434 0.000 4.753) 5.340 2.926 ( -15.762 -0.000 -5.108) 16.569 2.979 ( -10.367 -0.000 5.055) 11.534 3.331 ( 3.563 0.000 -3.178) 4.775 3.651 ( 2.631 0.000 4.758) 5.437 4.283 ( 0.499 0.000 -3.749) 3.782 4.570 ( -4.592 -0.000 -4.205) 6.227 5.118 ( 4.577 0.000 11.567) 12.440 5.577 ( 2.983 0.000 6.508) 7.159 5.690 ( 9.994 0.000 0.531) 10.008 5.800 ( -2.115 -0.000 18.611) 18.731 5.863 ( -17.909 -0.000 7.493) 19.413 6.143 ( -10.916 -0.000 11.291) 15.705 6.538 ( -3.119 -0.000 -4.625) 5.579 7.042 ( 2.921 0.000 -9.917) 10.338 8.417 ( -0.510 -0.000 -0.048) 0.512 8.538 ( -14.479 -0.000 20.109) 24.779 9.186 ( -19.814 -0.000 18.038) 26.795 9.544 ( 9.315 0.000 0.387) 9.323 10.081 ( 0.687 0.000 -26.007) 26.016 10.715 ( 9.925 0.000 -20.543) 22.814 11.228 ( 19.799 0.000 -16.988) 26.088 11.254 ( -11.736 -0.000 4.709) 12.646 11.968 ( -6.940 -0.000 7.277) 10.056 12.326 ( 9.034 0.000 8.985) 12.741 12.612 ( 5.558 0.000 -5.389) 7.742 13.071 ( -6.524 -0.000 6.652) 9.317 17.257 ( 4.332 0.000 -13.657) 14.327 17.450 ( 6.883 0.000 20.820) 21.928 18.878 ( -13.724 -0.000 -10.516) 17.290 18.973 ( -0.860 -0.000 -0.385) 0.942 19.792 ( 34.578 0.000 -0.010) 34.578 21.648 ( -20.655 -0.000 6.332) 21.603 23.457 ( 0.461 0.000 -9.400) 9.411 23.520 ( -8.811 -0.000 -3.199) 9.374 ======================= Grid point 567 (287/361) ======================= q-point: (-0.50 0.40 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.478 ( -11.472 4.974 6.831) 14.248 2.687 ( -6.419 6.455 3.451) 9.736 2.781 ( -11.389 -2.728 0.530) 11.723 3.030 ( -0.946 -8.529 1.596) 8.728 3.373 ( 4.923 -2.484 -1.263) 5.657 3.763 ( 0.130 -2.401 7.319) 7.703 4.248 ( 6.164 3.841 -6.903) 10.020 4.409 ( -6.164 -1.746 -10.008) 11.883 5.319 ( 5.635 1.471 10.989) 12.437 5.700 ( 0.662 -3.304 9.089) 9.693 5.789 ( -2.786 0.563 7.990) 8.481 5.833 ( 6.287 0.881 3.397) 7.200 6.015 ( -2.010 -0.401 18.143) 18.258 6.152 ( -11.416 -6.088 11.746) 17.474 6.442 ( -3.995 -0.515 -3.358) 5.244 6.985 ( 3.465 -1.610 -9.132) 9.900 8.442 ( 0.117 -1.447 3.545) 3.831 8.581 ( -14.612 -0.221 21.941) 26.362 9.112 ( -19.642 -0.126 15.112) 24.783 9.609 ( 5.734 7.333 -5.450) 10.787 9.776 ( -0.737 -1.479 -20.503) 20.569 10.643 ( 14.072 -0.181 -19.792) 24.286 11.114 ( -3.505 7.257 -2.283) 8.376 11.228 ( 4.811 2.214 -13.255) 14.274 11.985 ( -5.809 -2.986 8.611) 10.808 12.581 ( 11.531 0.484 5.725) 12.883 12.620 ( 4.922 0.387 -2.264) 5.432 13.012 ( -11.850 -0.514 5.014) 12.877 17.239 ( 8.621 -0.333 -4.542) 9.750 17.802 ( 7.103 -4.407 17.895) 19.751 18.535 ( -12.962 3.179 -10.991) 17.290 18.943 ( -2.809 -3.747 -4.436) 6.450 20.296 ( 38.087 3.113 1.764) 38.255 21.415 ( -23.782 -2.618 3.324) 24.155 23.298 ( -2.724 5.437 -7.065) 9.322 23.378 ( -6.514 -3.436 -7.965) 10.848 ======================= Grid point 568 (288/361) ======================= q-point: (-0.40 0.40 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.427 ( 0.437 5.488 7.574) 9.363 2.640 ( -8.035 0.327 6.776) 10.516 2.714 ( 0.381 -2.239 1.243) 2.589 3.017 ( -5.023 -5.010 -5.376) 8.901 3.478 ( 4.365 -1.675 2.404) 5.257 3.826 ( -11.272 -5.010 9.057) 15.303 4.171 ( 7.035 3.686 -16.123) 17.973 4.309 ( 5.554 -1.632 -6.220) 8.497 5.490 ( 2.836 0.591 9.354) 9.792 5.810 ( -0.990 -3.232 1.112) 3.558 5.893 ( 1.478 2.387 8.506) 8.958 5.961 ( 3.051 -0.407 11.804) 12.199 6.130 ( -3.043 0.433 2.867) 4.204 6.194 ( -7.386 -6.896 9.630) 13.958 6.432 ( -1.808 -6.264 7.805) 10.170 6.947 ( 2.409 -3.068 -7.652) 8.589 8.515 ( -0.561 -2.109 5.760) 6.159 8.655 ( -13.767 -0.119 23.731) 27.436 8.981 ( -14.536 2.014 4.282) 15.287 9.441 ( -4.704 3.924 -5.089) 7.964 9.688 ( 3.991 0.800 -7.954) 8.936 10.637 ( 17.080 0.140 -19.209) 25.705 10.973 ( -4.983 6.778 -1.445) 8.535 11.068 ( 5.595 11.034 -13.009) 17.953 12.052 ( -5.247 -5.160 9.470) 11.994 12.569 ( -1.411 -1.865 -5.305) 5.798 12.815 ( 1.582 6.444 6.226) 9.099 12.919 ( 0.139 -1.746 2.363) 2.942 17.379 ( 10.099 -0.131 4.700) 11.140 18.032 ( -2.307 1.773 0.548) 2.961 18.305 ( -4.281 -8.242 0.290) 9.292 18.877 ( -0.117 -3.003 -6.917) 7.542 20.777 ( 25.885 9.078 5.775) 28.032 21.133 ( -15.866 -6.441 -3.976) 17.579 23.158 ( -2.710 2.473 -4.500) 5.806 23.222 ( -3.466 0.518 -7.650) 8.415 ======================= Grid point 569 (289/361) ======================= q-point: (-0.30 0.40 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.523 ( 1.104 3.504 9.810) 10.476 2.683 ( 6.730 0.727 4.000) 7.862 2.814 ( 6.291 -2.042 3.063) 7.289 2.928 ( -3.391 -6.135 -4.742) 8.463 3.523 ( -1.436 1.252 0.851) 2.087 3.734 ( -16.985 -7.504 2.098) 18.686 4.119 ( 10.014 2.018 -9.006) 13.618 4.363 ( 10.108 0.965 -5.288) 11.448 5.595 ( -3.192 -1.963 7.429) 8.320 5.762 ( -6.272 -0.627 -4.331) 7.648 5.890 ( -6.805 3.905 4.079) 8.843 6.076 ( -3.876 5.873 5.358) 8.845 6.121 ( 1.388 -3.815 2.868) 4.970 6.339 ( 4.583 -8.144 6.886) 11.608 6.614 ( -0.113 -7.571 8.417) 11.322 6.967 ( 4.635 -8.771 -2.076) 10.135 8.569 ( -3.924 1.038 6.677) 7.814 8.748 ( -13.142 0.000 23.338) 26.784 8.831 ( -5.117 0.879 -1.116) 5.310 9.355 ( -9.643 -4.363 5.772) 12.056 9.622 ( 4.355 4.711 -8.578) 10.711 10.602 ( 6.190 8.006 -12.415) 16.017 10.823 ( 4.340 3.683 -11.136) 12.507 11.000 ( 13.922 11.275 -3.741) 18.301 12.145 ( -5.708 -5.770 10.849) 13.549 12.480 ( -5.843 -0.147 -3.049) 6.592 12.692 ( -10.140 0.106 -0.785) 10.171 13.083 ( 13.788 5.525 1.422) 14.922 17.583 ( 6.154 2.192 8.813) 10.970 17.790 ( -8.709 1.306 -13.084) 15.772 18.452 ( -2.201 -6.078 7.862) 10.178 18.891 ( 8.876 -7.034 -5.699) 12.678 20.582 ( -29.769 -0.066 -4.906) 30.171 21.392 ( 34.201 4.300 2.473) 34.559 23.050 ( -4.158 2.327 -2.827) 5.541 23.147 ( 2.840 0.361 -2.945) 4.108 ======================= Grid point 570 (290/361) ======================= q-point: (-0.20 -0.60 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.607 ( -6.502 -0.496 13.664) 15.140 2.756 ( 9.433 5.914 -8.009) 13.715 2.973 ( 4.632 -5.897 1.469) 7.641 3.024 ( 10.677 -2.750 6.106) 12.603 3.461 ( -5.265 -4.149 -2.415) 7.125 3.620 ( -7.243 -3.276 0.333) 7.956 4.147 ( 8.555 3.396 -5.519) 10.732 4.438 ( 6.989 1.082 -0.351) 7.081 5.533 ( -14.889 0.435 -3.590) 15.322 5.605 ( -9.280 -1.027 1.363) 9.435 5.806 ( -4.768 2.786 0.959) 5.605 6.008 ( -6.500 9.058 5.651) 12.499 6.183 ( 1.974 -5.278 -2.338) 6.100 6.513 ( 9.461 4.091 -0.992) 10.356 6.736 ( -4.254 -16.456 6.359) 18.148 7.197 ( 9.056 -13.970 2.965) 16.910 8.528 ( -7.952 5.762 6.330) 11.683 8.805 ( -6.592 -2.238 10.341) 12.465 8.850 ( -6.073 0.178 14.279) 15.518 9.362 ( -9.455 -9.351 6.320) 14.723 9.545 ( 6.548 3.900 -9.574) 12.237 10.403 ( -4.185 16.435 -0.214) 16.961 10.804 ( 17.952 -2.251 -19.913) 26.904 11.137 ( 18.164 8.313 2.316) 20.109 12.234 ( -6.711 -4.117 10.716) 13.298 12.344 ( -9.197 1.295 -0.643) 9.310 12.572 ( -5.009 -2.335 -3.078) 6.326 13.193 ( 11.996 8.712 -2.626) 15.057 17.407 ( -12.201 0.591 -14.097) 18.653 17.821 ( 6.054 3.473 10.375) 12.504 18.479 ( -4.024 0.109 2.056) 4.520 19.080 ( 9.002 -7.822 0.339) 11.931 20.093 ( -27.546 -6.055 -12.065) 30.676 21.837 ( 30.172 7.583 5.596) 31.609 22.953 ( -2.602 2.845 -1.756) 4.237 23.213 ( 6.560 -0.921 2.344) 7.027 ======================= Grid point 571 (291/361) ======================= q-point: (-0.10 -0.60 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.648 ( -9.774 3.859 10.930) 15.162 2.722 ( 3.560 0.531 -4.493) 5.757 3.049 ( -0.184 -5.547 -1.581) 5.771 3.262 ( 9.935 -0.467 3.829) 10.658 3.461 ( -0.033 -6.844 0.323) 6.851 3.617 ( 3.887 0.350 1.470) 4.170 4.170 ( 10.182 4.247 -5.512) 12.333 4.525 ( 1.267 -0.778 5.178) 5.388 5.242 ( -17.221 3.819 -2.622) 17.833 5.465 ( -12.149 -0.564 -0.626) 12.178 5.708 ( -6.750 2.409 -1.418) 7.306 5.876 ( -7.668 10.000 3.462) 13.069 6.218 ( 4.251 -3.368 -5.082) 7.432 6.547 ( 6.525 6.388 -0.965) 9.182 6.950 ( 0.395 -19.528 4.728) 20.096 7.433 ( 3.813 -13.706 -0.118) 14.227 8.421 ( -10.032 7.955 7.294) 14.736 8.833 ( -10.941 2.667 14.445) 18.316 8.956 ( -3.367 -2.965 11.766) 12.592 9.313 ( -2.579 2.193 -6.218) 7.080 9.602 ( 7.425 -12.095 -2.193) 14.361 10.276 ( -0.433 12.043 6.345) 13.620 10.861 ( 19.328 -5.365 -20.775) 28.878 11.367 ( 18.042 6.656 3.575) 19.560 12.201 ( -5.227 3.966 0.088) 6.562 12.279 ( -8.447 -4.833 6.240) 11.561 12.516 ( -4.295 -1.329 0.790) 4.565 13.195 ( 9.496 12.150 -6.754) 16.835 17.101 ( -10.958 -0.995 -9.682) 14.656 17.984 ( 4.785 4.465 10.588) 12.447 18.422 ( -3.058 1.003 -2.185) 3.890 19.126 ( -11.565 3.658 2.638) 12.414 19.778 ( -5.367 -16.149 -14.816) 22.564 22.200 ( 20.355 8.980 8.016) 23.648 22.890 ( -0.108 0.262 -2.808) 2.822 23.385 ( 9.672 0.225 6.669) 11.751 ======================= Grid point 577 (292/361) ======================= q-point: (-0.50 0.50 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.485 ( 0.511 0.000 6.106) 6.127 2.653 ( -6.684 -0.000 2.129) 7.015 2.679 ( -2.101 -0.000 3.832) 4.371 2.973 ( -3.723 -0.000 -3.305) 4.978 3.464 ( 5.707 -0.000 4.642) 7.356 3.776 ( -13.057 -0.000 9.620) 16.218 4.206 ( 3.304 -0.000 -16.502) 16.829 4.293 ( 9.014 -0.000 -6.324) 11.011 5.494 ( 1.998 -0.000 8.079) 8.323 5.771 ( -1.110 -0.000 2.738) 2.954 5.926 ( 5.268 -0.000 13.351) 14.353 5.948 ( 0.735 0.000 4.573) 4.631 6.126 ( -6.702 -0.000 8.180) 10.575 6.140 ( -4.615 0.000 10.615) 11.575 6.381 ( -2.872 -0.000 5.785) 6.459 6.923 ( 4.565 -0.000 -10.216) 11.190 8.496 ( 1.067 -0.000 5.046) 5.157 8.653 ( -15.409 -0.000 25.845) 30.090 8.996 ( -16.701 -0.000 7.531) 18.320 9.484 ( -5.546 -0.000 -13.572) 14.661 9.689 ( 6.377 -0.000 -5.854) 8.657 10.638 ( 18.040 -0.000 -19.338) 26.446 11.030 ( -8.299 -0.000 0.093) 8.299 11.181 ( 8.751 -0.000 -14.940) 17.314 11.999 ( -5.918 -0.000 10.303) 11.881 12.545 ( -0.056 -0.000 -6.970) 6.971 12.874 ( -16.363 0.000 5.304) 17.201 12.909 ( 15.890 -0.000 6.832) 17.297 17.378 ( 10.640 -0.000 5.184) 11.836 18.043 ( 1.955 -0.000 6.471) 6.759 18.236 ( -9.859 -0.000 -4.598) 10.879 18.848 ( 0.681 -0.000 -7.305) 7.336 20.877 ( 39.795 -0.000 2.681) 39.885 21.058 ( -27.938 0.000 -1.984) 28.009 23.183 ( -6.029 -0.000 -4.414) 7.472 23.224 ( -1.067 -0.000 -7.560) 7.635 ======================= Grid point 579 (293/361) ======================= q-point: (-0.40 -0.50 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.600 ( -0.899 4.801 7.287) 8.772 2.676 ( 8.793 -1.972 5.399) 10.505 2.762 ( 3.367 -2.831 6.631) 7.957 2.882 ( 2.559 -0.191 -8.003) 8.404 3.555 ( -4.575 2.164 3.622) 6.223 3.616 ( -18.439 -5.082 4.454) 19.638 4.148 ( 10.925 1.036 -10.758) 15.368 4.369 ( 11.776 -0.099 -5.665) 13.069 5.560 ( -5.150 -1.408 6.190) 8.174 5.732 ( -6.067 -1.650 -2.532) 6.778 5.956 ( -4.440 3.791 2.702) 6.433 6.059 ( -6.282 -4.317 0.717) 7.656 6.157 ( 2.170 0.622 10.307) 10.551 6.225 ( 1.550 -0.136 8.780) 8.916 6.537 ( 5.893 -3.022 11.699) 13.443 6.874 ( 5.045 -2.107 -9.968) 11.368 8.581 ( 0.378 0.327 7.476) 7.493 8.745 ( -17.310 -0.151 27.041) 32.108 8.843 ( -7.979 0.395 -1.561) 8.140 9.301 ( -11.048 -1.565 0.686) 11.179 9.679 ( 5.460 1.634 -8.567) 10.290 10.669 ( 19.751 1.061 -20.598) 28.557 10.911 ( -6.153 4.034 -0.478) 7.373 11.148 ( 10.627 4.751 -7.565) 13.883 12.061 ( -5.814 -2.924 11.763) 13.443 12.453 ( -2.186 -1.718 -7.019) 7.550 12.695 ( -16.313 0.364 3.776) 16.749 13.169 ( 14.527 3.013 3.578) 15.261 17.619 ( 8.618 1.419 11.703) 14.603 17.794 ( -12.849 -0.461 -15.156) 19.875 18.379 ( 4.923 -2.050 11.994) 13.127 18.801 ( 5.870 -2.825 -9.083) 11.178 20.587 ( -31.260 0.310 -7.754) 32.209 21.444 ( 37.945 1.535 2.471) 38.056 23.079 ( -3.544 0.960 -1.702) 4.047 23.149 ( 0.349 -0.021 -3.202) 3.221 ======================= Grid point 580 (294/361) ======================= q-point: (-0.30 -0.50 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.600 ( -9.846 0.164 11.258) 14.957 2.858 ( 6.886 0.585 -0.564) 6.934 2.892 ( 9.364 1.590 -1.379) 9.598 3.008 ( 16.464 -0.272 5.079) 17.231 3.355 ( -14.836 -6.965 -1.147) 16.429 3.587 ( -4.271 -0.484 2.597) 5.022 4.192 ( 9.985 1.852 -5.438) 11.519 4.463 ( 9.343 1.355 -3.112) 9.941 5.515 ( -12.769 -1.710 2.650) 13.153 5.580 ( -9.515 -1.693 -4.441) 10.636 5.850 ( -7.283 2.636 1.126) 7.826 6.079 ( 0.225 -5.509 -0.757) 5.565 6.178 ( -3.799 8.295 7.224) 11.637 6.410 ( 2.674 -9.266 7.141) 12.000 6.693 ( 6.013 5.390 -2.403) 8.425 6.970 ( 11.365 -11.618 -0.941) 16.280 8.620 ( -7.183 4.608 7.155) 11.136 8.750 ( -3.963 -3.125 6.269) 8.048 8.858 ( -10.159 0.100 19.429) 21.924 9.214 ( -14.186 -6.287 8.058) 17.484 9.621 ( 6.074 3.409 -10.674) 12.746 10.644 ( 8.161 8.573 -11.015) 16.169 10.801 ( 5.660 2.972 -10.309) 12.130 11.244 ( 14.781 3.587 -0.269) 15.212 12.151 ( -6.677 -3.586 12.458) 14.582 12.355 ( -4.944 -1.413 -3.612) 6.284 12.531 ( -10.267 -1.137 0.316) 10.335 13.334 ( 12.577 6.274 -0.418) 14.061 17.412 ( -13.276 -0.010 -15.604) 20.488 17.872 ( 5.613 2.203 13.353) 14.652 18.521 ( 2.349 4.546 4.079) 6.544 18.909 ( 12.396 -10.577 -3.536) 16.675 20.031 ( -32.360 -1.609 -11.956) 34.536 21.934 ( 33.245 3.495 0.596) 33.434 23.013 ( -2.537 3.646 0.638) 4.487 23.187 ( 4.302 -1.885 3.265) 5.720 ======================= Grid point 581 (295/361) ======================= q-point: (-0.20 -0.50 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.607 ( -12.849 -2.587 14.182) 19.311 2.798 ( -9.151 -0.394 -2.920) 9.614 3.011 ( 10.302 3.466 0.316) 10.874 3.255 ( 12.093 -0.727 1.598) 12.220 3.344 ( 1.374 -5.556 -1.455) 5.906 3.607 ( 4.586 -1.243 4.034) 6.233 4.246 ( 10.244 3.736 -5.551) 12.236 4.525 ( 2.107 0.971 2.277) 3.251 5.300 ( -14.931 2.797 -1.479) 15.262 5.436 ( -10.967 -2.461 -1.321) 11.317 5.737 ( -7.231 0.948 -1.889) 7.534 6.066 ( -4.492 9.949 3.619) 11.500 6.156 ( 3.060 -2.528 -2.307) 4.592 6.631 ( 2.185 -15.693 6.688) 17.198 6.665 ( 5.998 6.309 -4.558) 9.826 7.208 ( 9.328 -11.708 -4.325) 15.582 8.529 ( -11.085 3.413 6.957) 13.525 8.833 ( -5.522 -0.559 13.183) 14.304 8.941 ( -7.319 0.428 16.005) 17.605 9.206 ( -10.858 -9.696 7.233) 16.255 9.558 ( 7.921 2.843 -10.309) 13.308 10.516 ( -2.364 13.922 2.182) 14.289 10.782 ( 16.268 -3.282 -20.453) 26.339 11.448 ( 15.789 2.219 1.534) 16.018 12.181 ( -9.165 -2.723 4.531) 10.580 12.279 ( -5.159 1.672 4.638) 7.136 12.465 ( -2.967 -3.764 -0.292) 4.802 13.395 ( 10.856 9.739 -4.702) 15.323 17.083 ( -11.302 -0.982 -10.862) 15.706 18.052 ( 3.537 2.946 10.884) 11.817 18.497 ( 2.298 7.860 -3.402) 8.867 19.132 ( 2.474 -4.559 2.496) 5.756 19.523 ( -20.423 -11.050 -13.128) 26.675 22.303 ( 25.295 2.855 -1.516) 25.501 22.951 ( -2.683 6.179 1.722) 6.953 23.372 ( 9.296 -1.722 8.672) 12.829 ======================= Grid point 582 (296/361) ======================= q-point: (-0.10 -0.50 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.545 ( -19.874 -3.733 8.273) 21.848 2.686 ( -8.741 -2.518 3.395) 9.709 3.113 ( 9.949 4.425 -0.590) 10.904 3.297 ( -0.617 -1.908 -3.878) 4.366 3.466 ( 5.657 -4.814 3.870) 8.375 3.785 ( 10.088 3.608 3.187) 11.178 4.285 ( 12.103 3.149 -7.026) 14.344 4.570 ( -4.561 -1.065 8.325) 9.553 5.058 ( -15.196 5.158 2.202) 16.198 5.315 ( -3.991 -0.794 -2.591) 4.824 5.576 ( -8.236 1.043 -5.355) 9.880 5.912 ( -6.687 12.708 1.787) 14.471 6.219 ( 5.265 -2.117 -1.019) 5.765 6.651 ( 3.922 4.113 -2.039) 6.038 6.886 ( 6.005 -14.021 1.703) 15.348 7.319 ( 0.975 -12.343 -4.186) 13.070 8.411 ( -15.235 5.042 8.837) 18.320 8.865 ( -13.506 3.094 16.650) 21.661 9.031 ( -4.364 0.557 11.793) 12.587 9.225 ( 3.101 -7.034 -5.366) 9.375 9.602 ( 6.246 -5.326 -0.396) 8.218 10.423 ( -2.270 9.061 5.017) 10.603 10.812 ( 17.651 -6.515 -22.051) 28.987 11.624 ( 9.968 2.619 -0.307) 10.311 12.102 ( -8.827 -1.836 2.297) 9.304 12.281 ( 0.078 1.414 2.689) 3.039 12.465 ( -2.975 -2.669 1.601) 4.306 13.359 ( 9.651 13.395 -7.862) 18.286 16.899 ( -6.424 -1.112 -0.598) 6.546 18.190 ( 3.951 0.540 7.366) 8.377 18.354 ( -2.152 7.637 -10.685) 13.309 18.946 ( -16.493 2.642 -0.482) 16.710 19.539 ( 5.479 -15.504 -3.976) 16.918 22.550 ( 14.852 3.945 0.467) 15.374 22.868 ( -2.015 4.452 -1.024) 4.993 23.637 ( 11.046 0.479 9.859) 14.814 ======================= Grid point 589 (297/361) ======================= q-point: (-0.40 -0.40 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.605 ( -11.201 -0.000 9.818) 14.894 2.832 ( 3.859 0.000 3.925) 5.504 2.946 ( 16.684 0.000 -6.278) 17.826 3.003 ( 17.593 0.000 5.940) 18.569 3.280 ( -20.143 -0.000 1.363) 20.189 3.586 ( -3.825 -0.000 2.329) 4.478 4.210 ( 10.724 0.000 -6.031) 12.303 4.475 ( 10.217 0.000 -3.200) 10.706 5.497 ( -11.647 -0.000 5.176) 12.745 5.561 ( -9.783 -0.000 -5.769) 11.358 5.888 ( -10.687 -0.000 0.817) 10.718 6.006 ( 2.292 0.000 0.812) 2.432 6.279 ( -1.564 -0.000 7.793) 7.948 6.314 ( -1.166 -0.000 6.208) 6.316 6.791 ( 14.952 0.000 5.758) 16.022 6.814 ( 6.450 0.000 -11.372) 13.074 8.677 ( -11.572 -0.000 1.993) 11.742 8.707 ( 0.832 0.000 11.848) 11.877 8.857 ( -10.373 -0.000 19.092) 21.728 9.157 ( -16.548 -0.000 9.133) 18.901 9.652 ( 6.298 0.000 -11.100) 12.763 10.697 ( 20.752 0.000 -23.826) 31.596 10.861 ( -6.838 -0.000 2.864) 7.413 11.269 ( 12.693 0.000 -2.034) 12.855 12.123 ( -5.249 -0.000 13.850) 14.811 12.329 ( -3.042 -0.000 -6.298) 6.994 12.527 ( -13.270 -0.000 2.944) 13.592 13.391 ( 12.543 0.000 0.022) 12.543 17.411 ( -13.608 -0.000 -16.183) 21.144 17.892 ( 5.371 0.000 14.737) 15.685 18.592 ( 6.211 0.000 10.700) 12.372 18.782 ( 11.427 0.000 -10.910) 15.799 20.019 ( -33.260 -0.000 -12.262) 35.449 21.964 ( 34.117 0.000 -1.482) 34.149 23.054 ( -1.637 -0.000 2.091) 2.656 23.163 ( 2.885 0.000 3.412) 4.468 ======================= Grid point 590 (298/361) ======================= q-point: (-0.30 -0.40 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.589 ( -11.313 0.167 13.665) 17.741 2.741 ( -19.719 -3.176 -0.021) 19.974 3.089 ( 11.709 2.921 -3.601) 12.594 3.207 ( 8.631 -3.157 2.138) 9.436 3.327 ( 13.398 1.956 1.898) 13.672 3.580 ( 2.450 -1.445 3.061) 4.178 4.291 ( 10.082 1.330 -3.991) 10.925 4.546 ( 3.298 0.912 -0.662) 3.485 5.345 ( -12.238 2.473 -0.301) 12.489 5.390 ( -10.996 -2.678 -0.424) 11.325 5.747 ( -8.576 0.328 -2.098) 8.835 6.084 ( 6.354 -1.979 -0.005) 6.655 6.258 ( -4.850 8.552 4.843) 10.960 6.408 ( -1.552 -9.553 6.162) 11.474 6.764 ( 7.935 4.004 -9.390) 12.929 7.040 ( 13.463 -6.406 -4.912) 15.698 8.541 ( -11.380 -0.697 2.011) 11.577 8.862 ( -1.624 2.822 15.542) 15.879 8.940 ( -8.797 -0.614 17.486) 19.583 9.075 ( -17.556 -4.506 14.521) 23.225 9.603 ( 8.244 1.581 -12.617) 15.154 10.682 ( 14.703 2.792 -18.722) 23.969 10.775 ( -4.378 3.075 -0.971) 5.437 11.449 ( 13.439 -1.137 0.175) 13.489 12.183 ( -5.705 3.009 5.733) 8.630 12.258 ( -4.358 -4.006 3.821) 7.045 12.421 ( -5.259 -0.846 1.011) 5.422 13.514 ( 11.296 3.559 -4.291) 12.596 17.070 ( -11.345 -0.402 -11.455) 16.127 18.084 ( 2.273 0.823 9.202) 9.514 18.688 ( 6.971 13.159 0.187) 14.892 18.952 ( 12.715 -13.983 -1.332) 18.947 19.424 ( -32.221 -1.667 -11.388) 34.215 22.323 ( 25.733 0.171 -7.241) 26.733 23.059 ( -1.396 4.470 4.876) 6.760 23.334 ( 8.979 -1.893 9.898) 13.497 ======================= Grid point 591 (299/361) ======================= q-point: (-0.20 -0.40 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.460 ( -22.587 -4.795 5.384) 23.709 2.630 ( -13.879 -3.136 10.262) 17.544 3.103 ( -0.817 -3.169 -3.225) 4.594 3.389 ( 8.910 1.059 1.922) 9.176 3.415 ( 11.669 6.848 -2.790) 13.815 3.797 ( 12.757 -2.088 6.194) 14.334 4.358 ( 10.655 4.181 -5.976) 12.912 4.549 ( -4.204 -1.151 4.823) 6.501 5.149 ( -14.944 4.824 3.286) 16.044 5.289 ( -1.858 -1.777 -3.268) 4.159 5.584 ( -7.899 -0.033 -6.549) 10.261 6.116 ( -4.907 7.132 -2.456) 8.999 6.208 ( 5.116 4.003 5.838) 8.734 6.602 ( 3.033 -12.145 6.590) 14.147 6.756 ( 9.160 1.663 -6.135) 11.149 7.139 ( 6.216 -7.830 -11.006) 14.869 8.425 ( -16.268 -2.440 7.628) 18.132 8.936 ( -12.852 4.836 19.088) 23.514 9.014 ( -1.820 -2.328 7.774) 8.316 9.104 ( -9.994 -4.317 12.777) 16.786 9.587 ( 10.065 0.984 -7.860) 12.809 10.594 ( -5.316 8.821 2.315) 10.556 10.720 ( 14.511 -3.667 -20.620) 25.480 11.626 ( 9.335 -1.791 -0.823) 9.541 12.105 ( -6.340 2.303 1.968) 7.026 12.290 ( -2.580 -1.080 5.258) 5.956 12.407 ( -1.834 -2.900 -0.759) 3.514 13.542 ( 10.848 7.266 -8.717) 15.699 16.883 ( -5.360 -0.665 -0.165) 5.404 18.155 ( 3.124 -2.338 -5.144) 6.457 18.580 ( -2.686 15.790 -2.702) 16.243 18.976 ( -17.786 0.586 -1.293) 17.842 19.250 ( 8.376 -16.770 0.861) 18.765 22.535 ( 18.485 -2.584 -8.635) 20.566 23.031 ( -3.134 10.144 5.656) 12.030 23.623 ( 11.776 -1.717 9.746) 15.382 ======================= Grid point 592 (300/361) ======================= q-point: (-0.10 -0.40 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.307 ( -18.704 -7.516 8.136) 21.738 2.475 ( -24.329 -5.712 3.849) 25.285 3.160 ( 1.977 -6.394 4.267) 7.936 3.417 ( 13.687 12.529 -6.079) 19.526 3.540 ( 4.437 -3.090 1.078) 5.514 3.953 ( -1.550 6.585 6.530) 9.403 4.396 ( 11.224 2.833 -6.236) 13.149 4.601 ( -2.281 -0.504 7.847) 8.188 4.952 ( -10.793 3.744 4.148) 12.154 5.273 ( 1.025 -1.642 -4.684) 5.068 5.413 ( -3.129 -0.407 -5.340) 6.202 5.925 ( -5.128 10.305 -3.398) 12.001 6.326 ( 2.998 3.134 9.078) 10.061 6.690 ( 3.525 2.398 -3.705) 5.648 6.880 ( 8.054 -4.285 -8.061) 12.174 7.196 ( 0.881 -13.960 3.649) 14.455 8.283 ( -21.157 -0.390 10.026) 23.416 8.900 ( -15.193 5.167 15.744) 22.481 9.109 ( -3.149 -0.142 8.970) 9.507 9.145 ( 3.659 -9.768 -3.687) 11.063 9.682 ( 5.624 0.117 3.854) 6.819 10.468 ( -7.168 5.540 2.343) 9.357 10.736 ( 16.987 -5.793 -21.522) 28.024 11.688 ( 1.103 -0.429 -2.270) 2.560 12.028 ( -7.331 2.031 4.307) 8.742 12.309 ( 1.097 2.446 -5.110) 5.770 12.407 ( -1.714 -7.764 3.053) 8.517 13.492 ( 10.832 10.087 -11.945) 19.020 16.935 ( 2.993 1.896 11.372) 11.912 18.044 ( -1.343 -7.032 -21.891) 23.032 18.421 ( -3.162 11.643 8.186) 14.580 18.841 ( -2.353 2.757 0.881) 3.730 19.477 ( 3.046 -12.398 1.475) 12.851 22.700 ( 13.727 -4.260 -6.630) 15.829 22.910 ( -6.405 14.605 3.639) 16.357 23.866 ( 7.850 -1.422 4.931) 9.379 ======================= Grid point 600 (301/361) ======================= q-point: (-0.30 -0.30 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.412 ( -23.856 -0.000 2.778) 24.017 2.600 ( -15.016 -0.000 13.998) 20.529 3.071 ( -2.546 -0.000 -5.023) 5.631 3.367 ( 9.472 0.000 3.373) 10.054 3.538 ( 14.105 0.000 -4.706) 14.869 3.752 ( 13.806 0.000 7.391) 15.660 4.400 ( 10.521 0.000 -2.703) 10.863 4.537 ( -4.938 -0.000 1.363) 5.122 5.201 ( -16.403 -0.000 4.481) 17.004 5.267 ( 0.629 0.000 -3.888) 3.938 5.582 ( -7.549 -0.000 -7.121) 10.378 6.143 ( 1.252 0.000 -3.102) 3.345 6.361 ( -5.785 -0.000 11.985) 13.308 6.404 ( 9.154 0.000 5.102) 10.480 6.781 ( 8.366 0.000 -9.163) 12.408 7.065 ( 8.927 0.000 -13.202) 15.937 8.392 ( -15.495 -0.000 5.352) 16.393 8.969 ( -12.703 -0.000 10.915) 16.748 9.038 ( -11.274 -0.000 20.260) 23.185 9.039 ( -5.477 -0.000 16.654) 17.532 9.599 ( 11.220 0.000 -10.943) 15.673 10.671 ( 17.905 0.000 -22.888) 29.059 10.697 ( -11.536 -0.000 4.389) 12.343 11.602 ( 9.719 0.000 -0.848) 9.756 12.145 ( -3.295 -0.000 -0.788) 3.388 12.258 ( -6.178 -0.000 8.205) 10.271 12.385 ( -0.915 -0.000 -1.215) 1.521 13.606 ( 11.258 0.000 -9.251) 14.571 16.877 ( -4.958 -0.000 0.034) 4.958 18.133 ( 2.796 0.000 -8.610) 9.052 18.823 ( -18.054 -0.000 -5.444) 18.857 18.924 ( 3.210 0.000 5.222) 6.130 19.057 ( 3.163 0.000 0.265) 3.174 22.509 ( 18.228 0.000 -10.331) 20.952 23.133 ( -1.909 -0.000 7.042) 7.296 23.601 ( 12.185 0.000 9.202) 15.269 ======================= Grid point 601 (302/361) ======================= q-point: (-0.20 -0.30 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.189 ( -20.291 -4.387 8.753) 22.530 2.407 ( -27.461 -2.046 2.907) 27.690 3.083 ( 2.951 -2.213 5.436) 6.569 3.503 ( 5.765 -1.086 0.058) 5.866 3.601 ( 12.015 6.689 -7.802) 15.811 4.009 ( 0.873 0.525 11.818) 11.862 4.473 ( 9.405 5.034 -3.751) 11.308 4.554 ( 3.441 -4.018 3.502) 6.344 5.022 ( -14.199 2.822 4.191) 15.071 5.239 ( 0.713 -1.493 -8.250) 8.414 5.408 ( -2.953 -0.158 -5.792) 6.504 6.044 ( -2.997 3.030 -6.815) 8.038 6.423 ( -1.401 6.517 15.503) 16.875 6.697 ( 10.029 -2.133 3.955) 10.989 6.817 ( 11.823 -2.321 -4.610) 12.900 7.004 ( 3.700 -6.236 -12.258) 14.242 8.239 ( -22.526 -2.729 11.003) 25.217 8.932 ( -9.347 -1.717 8.057) 12.459 9.060 ( -7.745 2.485 7.216) 10.874 9.129 ( -9.377 -0.529 16.191) 18.718 9.684 ( 11.041 -0.137 -1.461) 11.138 10.562 ( -11.856 3.572 2.975) 12.735 10.667 ( 17.167 -2.002 -20.675) 26.948 11.672 ( 2.125 -0.692 -2.561) 3.399 12.093 ( -3.747 4.454 2.483) 6.328 12.264 ( -7.096 -7.153 1.631) 10.207 12.339 ( 1.776 0.878 -3.739) 4.231 13.610 ( 11.581 3.343 -14.379) 18.764 16.961 ( 5.868 0.873 13.424) 14.677 17.946 ( -1.124 -3.179 -24.674) 24.903 18.592 ( -11.137 5.517 10.367) 16.184 18.937 ( 0.915 8.168 0.257) 8.223 19.244 ( 5.735 -12.502 2.122) 13.917 22.628 ( 15.054 -2.382 -9.449) 17.933 23.142 ( -4.274 8.526 6.910) 11.777 23.823 ( 7.807 -2.397 1.887) 8.382 ======================= Grid point 602 (303/361) ======================= q-point: (-0.10 -0.30 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.069 ( -27.988 -6.668 3.619) 28.998 2.140 ( -15.338 -7.771 15.034) 22.840 3.246 ( 6.703 -2.178 5.096) 8.697 3.527 ( -1.874 -0.725 -2.071) 2.885 3.622 ( 14.311 6.152 -8.650) 17.818 3.995 ( -16.770 4.882 13.732) 22.217 4.455 ( 1.205 9.212 -7.742) 12.093 4.705 ( 3.838 1.503 3.529) 5.426 4.936 ( 1.236 -2.939 2.156) 3.848 5.157 ( 0.801 -4.008 -2.956) 5.045 5.408 ( 5.356 -1.538 -1.760) 5.844 5.895 ( -0.740 6.291 -5.760) 8.562 6.543 ( -0.957 6.994 15.679) 17.194 6.704 ( 1.908 5.752 -7.536) 9.670 6.802 ( 2.707 -0.137 -13.577) 13.845 7.243 ( 6.414 -10.554 14.152) 18.784 8.094 ( -21.558 -4.878 13.414) 25.855 8.884 ( -12.572 3.047 8.305) 15.373 9.031 ( 0.514 -9.303 -4.994) 10.572 9.181 ( -6.696 1.413 12.856) 14.564 9.816 ( 3.892 1.809 4.342) 6.105 10.376 ( -11.856 1.788 -0.931) 12.026 10.697 ( 16.234 -2.669 -17.768) 24.215 11.618 ( -5.199 -1.095 -3.311) 6.261 12.013 ( -7.346 3.236 4.140) 9.032 12.207 ( -1.590 -3.214 -5.361) 6.449 12.402 ( 2.262 -5.219 3.108) 6.482 13.539 ( 11.283 5.428 -17.858) 21.810 17.255 ( 12.052 7.405 14.112) 19.981 17.726 ( 2.731 -9.283 -16.433) 19.071 18.578 ( -1.209 10.401 7.733) 13.017 18.883 ( 3.503 2.824 -1.869) 4.873 19.409 ( -1.264 -11.209 2.123) 11.478 22.749 ( 12.628 -4.465 -8.430) 15.826 23.002 ( -8.607 18.200 4.329) 20.593 23.887 ( -1.141 -6.224 -5.035) 8.086 ======================= Grid point 611 (304/361) ======================= q-point: (-0.20 -0.20 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.009 ( -29.916 -0.000 3.523) 30.123 2.064 ( -15.012 -0.000 15.394) 21.503 3.227 ( 7.890 0.000 5.807) 9.796 3.516 ( -0.333 -0.000 -3.827) 3.841 3.686 ( 11.511 0.000 -8.853) 14.522 4.034 ( -19.497 -0.000 16.130) 25.304 4.582 ( 3.461 0.000 -3.193) 4.709 4.669 ( 11.357 0.000 -4.050) 12.057 4.928 ( -6.426 -0.000 3.494) 7.315 5.111 ( 2.778 0.000 -3.718) 4.642 5.393 ( 4.535 0.000 -2.596) 5.226 5.951 ( -0.044 -0.000 -6.829) 6.829 6.622 ( -0.584 -0.000 14.717) 14.729 6.758 ( 4.688 0.000 -7.244) 8.628 6.818 ( -2.909 -0.000 -11.072) 11.447 7.114 ( 17.923 0.000 12.425) 21.809 8.039 ( -26.067 -0.000 15.462) 30.308 8.884 ( -3.389 -0.000 0.149) 3.392 8.982 ( -9.664 -0.000 0.770) 9.695 9.197 ( -11.966 -0.000 19.933) 23.249 9.822 ( 8.705 0.000 0.230) 8.708 10.406 ( -16.357 -0.000 0.599) 16.368 10.674 ( 16.843 0.000 -16.955) 23.898 11.610 ( -5.255 -0.000 -3.839) 6.508 12.065 ( -10.732 -0.000 -1.409) 10.824 12.137 ( 0.472 0.000 1.942) 1.999 12.364 ( 3.070 0.000 0.319) 3.087 13.586 ( 11.795 0.000 -19.460) 22.755 17.339 ( 17.750 0.000 19.577) 26.426 17.623 ( -1.236 -0.000 -22.037) 22.072 18.669 ( 0.718 0.000 10.782) 10.806 18.957 ( -2.362 -0.000 -3.982) 4.630 19.264 ( 1.719 0.000 2.405) 2.956 22.706 ( 13.568 0.000 -9.082) 16.327 23.196 ( -6.071 -0.000 6.611) 8.976 23.806 ( -2.742 -0.000 -8.769) 9.188 ======================= Grid point 612 (305/361) ======================= q-point: (-0.10 -0.20 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.765 ( -19.677 -4.158 12.277) 23.563 2.132 ( -8.844 -3.966 20.790) 22.938 3.380 ( 2.825 2.648 -3.290) 5.081 3.428 ( 2.026 -2.916 -2.875) 4.569 3.730 ( 11.083 1.604 -8.985) 14.357 3.929 ( -21.549 1.354 17.854) 28.017 4.447 ( -3.157 12.719 -7.131) 14.919 4.661 ( -2.626 -7.270 -7.659) 10.881 4.948 ( 3.665 -0.862 1.675) 4.121 5.322 ( 10.111 -0.416 11.119) 15.035 5.463 ( 12.166 -2.392 -2.782) 12.708 5.905 ( 4.698 2.900 -3.900) 6.760 6.493 ( -9.527 2.994 -15.524) 18.459 6.709 ( 1.723 0.179 -8.891) 9.058 6.857 ( -2.597 6.455 21.901) 22.980 7.478 ( 7.386 1.816 14.421) 16.304 7.938 ( -18.716 -9.096 18.265) 27.688 8.816 ( -6.156 1.472 -0.699) 6.368 8.881 ( -3.533 -5.890 -4.894) 8.433 9.264 ( -9.261 1.684 18.392) 20.661 9.888 ( 0.811 3.303 -1.456) 3.700 10.158 ( -16.293 -3.554 -1.228) 16.721 10.721 ( 15.251 0.013 -14.110) 20.777 11.452 ( -10.729 -1.157 -4.481) 11.685 11.963 ( -6.376 -0.778 4.825) 8.034 12.169 ( 1.734 -0.683 -0.309) 1.889 12.429 ( 2.369 -2.538 2.023) 4.019 13.495 ( 11.119 2.131 -20.958) 23.820 17.399 ( 3.007 2.819 -13.971) 14.567 17.857 ( 22.976 -3.015 13.585) 26.862 18.735 ( -2.803 15.053 -0.332) 15.315 18.937 ( 9.717 -7.032 3.626) 12.531 19.306 ( -5.027 -6.481 2.020) 8.447 22.774 ( 10.001 -1.286 -10.414) 14.496 23.078 ( -9.374 16.935 3.173) 19.615 23.604 ( -12.836 -11.846 -12.115) 21.258 ======================= Grid point 622 (306/361) ======================= q-point: (-0.10 -0.10 0.38) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 1.754 ( -5.858 -0.000 17.054) 18.032 2.302 ( -3.131 -0.000 24.494) 24.693 3.208 ( -9.036 -0.000 -8.093) 12.130 3.558 ( 14.086 0.000 -3.857) 14.605 3.738 ( 6.204 0.000 -11.390) 12.970 3.879 ( -15.271 -0.000 16.396) 22.406 4.403 ( -7.015 -0.000 -2.867) 7.578 4.452 ( 0.929 0.000 -14.244) 14.275 5.059 ( 6.057 0.000 5.611) 8.256 5.447 ( -2.611 -0.000 8.467) 8.861 5.739 ( 21.517 0.000 2.035) 21.613 5.975 ( 8.000 0.000 -2.213) 8.300 6.166 ( -15.101 -0.000 -9.483) 17.832 6.611 ( -0.213 -0.000 -9.694) 9.696 7.101 ( -4.848 -0.000 21.803) 22.335 7.778 ( 7.304 0.000 11.817) 13.892 7.856 ( -18.103 -0.000 23.606) 29.749 8.727 ( -1.554 -0.000 -6.719) 6.897 8.741 ( -5.988 -0.000 -2.224) 6.387 9.389 ( -7.083 -0.000 20.816) 21.988 9.860 ( -22.099 -0.000 4.208) 22.496 9.890 ( 4.977 0.000 -10.544) 11.660 10.756 ( 12.684 0.000 -14.332) 19.139 11.214 ( -13.907 -0.000 -5.148) 14.830 11.975 ( -2.975 -0.000 8.369) 8.882 12.194 ( 4.146 0.000 -2.123) 4.658 12.471 ( 0.902 0.000 2.998) 3.131 13.412 ( 10.134 0.000 -19.406) 21.893 17.326 ( 6.019 0.000 -9.807) 11.507 18.248 ( 15.878 0.000 0.203) 15.879 18.703 ( 1.474 0.000 -4.391) 4.632 19.159 ( -8.243 -0.000 16.608) 18.541 19.271 ( 16.988 0.000 0.067) 16.988 22.696 ( -2.729 -0.000 -18.044) 18.249 23.095 ( -8.788 -0.000 3.038) 9.299 23.159 ( -13.161 -0.000 -9.284) 16.106 ======================= Grid point 623 (307/361) ======================= q-point: ( 0.00 0.00 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.404 ( 7.977 0.000 10.238) 12.979 2.585 ( -6.576 -0.000 -8.492) 10.741 3.279 ( -0.296 -0.000 5.170) 5.179 3.390 ( -0.017 -0.000 -10.221) 10.221 3.447 ( 3.943 0.000 11.797) 12.438 3.727 ( -3.519 -0.000 -12.429) 12.918 4.120 ( -7.770 -0.000 -0.649) 7.797 4.122 ( 7.013 0.000 -0.654) 7.044 5.603 ( 3.421 0.000 7.402) 8.154 5.707 ( -1.573 -0.000 -2.483) 2.940 5.810 ( -3.961 -0.000 8.076) 8.995 5.931 ( -2.037 -0.000 -4.671) 5.095 6.208 ( 1.460 0.000 1.694) 2.236 6.300 ( 3.462 0.000 -6.812) 7.641 7.730 ( 0.876 0.000 13.990) 14.017 7.938 ( -4.514 -0.000 -7.568) 8.812 8.439 ( -5.705 -0.000 9.996) 11.509 8.529 ( 0.351 0.000 -1.268) 1.315 8.854 ( -1.050 -0.000 16.994) 17.027 9.259 ( 4.586 0.000 -22.102) 22.572 9.869 ( -6.730 -0.000 15.541) 16.935 10.163 ( -2.501 -0.000 -15.112) 15.318 10.215 ( 0.036 0.000 21.246) 21.246 10.611 ( 6.852 0.000 -18.323) 19.563 12.176 ( -4.307 -0.000 2.629) 5.046 12.223 ( 5.981 0.000 -2.656) 6.544 12.740 ( -5.801 -0.000 12.602) 13.873 13.004 ( 6.689 0.000 -13.858) 15.388 17.465 ( 8.295 0.000 5.952) 10.210 17.644 ( -8.041 -0.000 -12.104) 14.531 19.037 ( -14.416 -0.000 4.190) 15.013 19.084 ( 11.485 0.000 -0.830) 11.515 20.670 ( 26.072 0.000 23.316) 34.977 21.152 ( -24.753 -0.000 -25.388) 35.458 22.947 ( -5.527 -0.000 1.317) 5.682 22.983 ( 5.991 0.000 -2.624) 6.540 ======================= Grid point 624 (308/361) ======================= q-point: ( 0.10 0.00 -0.54) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.418 ( -2.131 -1.109 -10.155) 10.435 2.644 ( 10.844 -0.153 7.895) 13.414 3.283 ( -2.065 4.846 4.685) 7.050 3.293 ( -0.678 3.775 -2.688) 4.684 3.515 ( -3.199 -3.138 -14.142) 14.835 3.659 ( 2.612 2.887 12.906) 13.481 4.040 ( -4.244 -1.097 1.280) 4.567 4.251 ( 9.029 -3.198 0.460) 9.590 5.588 ( -7.719 -0.108 -6.977) 10.405 5.685 ( -2.387 -1.272 4.392) 5.158 5.825 ( -6.845 0.757 2.788) 7.430 5.861 ( -5.174 -3.220 3.408) 6.982 6.247 ( 1.110 0.429 -6.731) 6.835 6.254 ( 2.455 -0.861 1.302) 2.910 7.711 ( -5.368 12.593 -6.070) 14.975 7.856 ( 1.964 9.609 9.535) 13.679 8.451 ( -7.783 -1.414 4.968) 9.341 8.584 ( 1.681 -11.110 0.505) 11.248 9.049 ( 0.221 1.339 11.600) 11.679 9.079 ( 3.188 -4.071 -14.340) 15.244 9.965 ( -3.938 3.933 5.530) 7.846 10.012 ( -1.894 -2.744 4.115) 5.296 10.531 ( 16.036 1.069 -7.878) 17.898 10.558 ( 15.674 -3.093 0.328) 15.980 12.144 ( -5.380 -3.197 1.233) 6.379 12.276 ( 4.058 -3.875 -3.563) 6.647 12.782 ( -9.036 1.638 13.066) 15.971 12.909 ( 4.226 0.936 -13.960) 14.616 17.408 ( -8.926 -0.720 -8.879) 12.610 17.669 ( 7.229 -1.099 9.637) 12.097 18.859 ( -15.504 3.428 3.203) 16.198 19.184 ( 4.525 1.139 0.245) 4.673 20.530 ( -20.721 1.304 -25.025) 32.516 21.303 ( 24.089 -1.813 23.281) 33.549 22.915 ( -1.802 -0.076 1.254) 2.197 23.064 ( 8.707 -1.121 -1.479) 8.903 ======================= Grid point 625 (309/361) ======================= q-point: ( 0.20 0.00 -0.54) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.321 ( 2.994 -4.462 -11.058) 12.294 2.868 ( 7.992 -0.176 7.113) 10.701 3.141 ( -2.834 4.360 -11.986) 13.066 3.308 ( -0.495 3.623 9.636) 10.306 3.448 ( -0.336 -5.883 -2.182) 6.284 3.741 ( 0.127 8.438 8.210) 11.774 4.062 ( 3.249 2.085 3.032) 4.909 4.425 ( 7.751 -5.864 2.019) 9.927 5.358 ( -12.858 -0.861 -6.966) 14.649 5.631 ( -12.252 -2.297 0.718) 12.487 5.767 ( -6.038 0.433 3.149) 6.823 5.844 ( -8.272 -3.296 3.668) 9.630 6.155 ( 2.062 0.646 -8.739) 9.002 6.356 ( 5.529 -1.890 2.947) 6.544 7.465 ( -3.070 15.972 -4.328) 16.831 7.830 ( 1.500 15.183 1.294) 15.312 8.414 ( -7.536 -3.032 4.751) 9.410 8.734 ( -0.116 -13.748 3.490) 14.184 8.954 ( 0.133 -11.134 -15.223) 18.861 9.223 ( 0.946 5.046 13.893) 14.811 9.905 ( 4.408 8.019 -1.863) 9.338 10.157 ( -1.446 -2.157 14.210) 14.446 10.524 ( 22.332 3.333 -24.343) 33.202 10.975 ( 18.567 -5.521 10.370) 21.971 12.122 ( -4.596 -4.741 1.105) 6.695 12.302 ( 1.319 -4.724 -5.724) 7.538 12.753 ( -7.563 3.370 3.972) 9.183 12.829 ( -0.608 -3.716 -2.704) 4.636 17.203 ( -9.398 0.252 -4.931) 10.616 17.897 ( 5.207 -2.222 11.357) 12.689 18.637 ( -13.202 5.853 0.450) 14.449 19.196 ( -6.197 -1.895 2.610) 6.986 20.007 ( -9.851 3.803 -23.114) 25.411 21.878 ( 18.490 -2.581 20.403) 27.655 22.910 ( 1.586 3.192 -0.183) 3.569 23.218 ( 10.301 -4.154 2.063) 11.297 ======================= Grid point 626 (310/361) ======================= q-point: ( 0.30 0.00 -0.54) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.335 ( 7.853 -9.822 -9.967) 16.046 2.921 ( -3.387 2.514 -11.310) 12.071 3.026 ( -0.044 -1.125 9.290) 9.358 3.389 ( -1.972 0.365 6.123) 6.443 3.501 ( 3.348 -6.421 -1.559) 7.408 3.748 ( 1.082 13.698 8.898) 16.370 4.141 ( 9.962 5.439 0.677) 11.370 4.596 ( 3.982 -5.584 4.008) 7.943 5.136 ( -11.442 -2.598 -3.155) 12.150 5.446 ( -15.825 -1.338 -0.102) 15.881 5.659 ( -10.879 0.332 -1.323) 10.964 5.791 ( -7.505 -4.170 1.083) 8.654 6.143 ( 7.112 0.745 -2.901) 7.717 6.486 ( 5.102 -2.502 2.531) 6.220 7.236 ( -1.179 15.950 -6.971) 17.447 7.704 ( 0.626 14.366 -1.052) 14.418 8.406 ( -8.453 -6.721 4.304) 11.625 8.879 ( 2.468 -8.338 0.726) 8.725 8.921 ( -6.296 -17.069 -3.006) 18.440 9.319 ( 3.365 9.220 8.523) 12.999 9.893 ( 3.803 11.021 3.657) 12.219 10.314 ( 1.429 -2.032 8.794) 9.138 10.513 ( 22.313 4.702 -24.902) 33.765 11.346 ( 14.506 -5.037 4.672) 16.051 12.132 ( -1.264 -3.563 0.938) 3.896 12.258 ( -1.022 -2.226 -6.407) 6.859 12.656 ( -5.585 2.245 0.922) 6.090 12.885 ( -1.687 -10.214 3.528) 10.937 17.044 ( -8.327 1.498 1.061) 8.527 18.082 ( -0.546 -4.788 7.130) 8.606 18.428 ( -4.998 8.529 -2.511) 10.199 19.083 ( -17.273 -4.579 0.995) 17.897 19.701 ( 3.932 5.654 -14.188) 15.771 22.303 ( 9.368 -4.142 13.867) 17.240 22.888 ( 4.100 7.464 -2.315) 8.825 23.470 ( 11.229 -6.418 7.096) 14.752 ======================= Grid point 627 (311/361) ======================= q-point: (-0.60 0.00 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.439 ( 4.358 -9.972 -5.718) 12.293 2.782 ( 3.309 -0.122 -7.819) 8.492 3.090 ( -9.867 -0.668 10.613) 14.507 3.352 ( -3.874 3.160 -0.742) 5.054 3.606 ( 4.713 -10.521 -2.943) 11.898 3.745 ( 1.715 14.143 7.579) 16.137 4.262 ( 14.437 6.629 -0.057) 15.886 4.688 ( -5.533 -4.428 4.498) 8.393 5.043 ( -5.804 -4.071 2.245) 7.436 5.278 ( -8.324 -1.284 0.394) 8.431 5.470 ( -8.678 1.325 -4.518) 9.873 5.744 ( -5.441 -5.475 -1.233) 7.816 6.243 ( 6.167 -0.216 4.174) 7.450 6.582 ( 2.299 -2.166 1.169) 3.368 6.980 ( -1.412 12.518 -12.023) 17.414 7.609 ( 1.147 11.477 2.633) 11.831 8.373 ( -9.999 -7.824 0.801) 12.721 8.968 ( -0.845 -12.842 0.389) 12.875 9.005 ( -4.819 -8.443 6.937) 11.942 9.355 ( 6.288 12.751 2.524) 14.440 9.898 ( -1.682 9.006 10.114) 13.647 10.418 ( 0.058 -2.550 1.849) 3.150 10.469 ( 20.889 6.770 -23.585) 32.225 11.563 ( 6.642 -4.403 1.232) 8.063 12.132 ( -1.483 0.819 -1.142) 2.043 12.196 ( -0.873 -2.452 -4.538) 5.231 12.604 ( -2.612 1.949 3.269) 4.616 13.018 ( 1.340 -12.095 1.638) 12.278 17.001 ( -4.145 0.296 8.626) 9.575 18.033 ( -9.580 -4.834 -11.191) 15.504 18.355 ( 5.206 9.583 3.187) 11.362 18.902 ( -11.717 -2.851 0.409) 12.066 19.637 ( 4.658 2.809 -3.916) 6.703 22.537 ( -0.357 -7.916 7.718) 11.061 22.845 ( 6.553 10.241 -3.864) 12.757 23.763 ( 9.083 -5.267 7.897) 13.138 ======================= Grid point 628 (312/361) ======================= q-point: (-0.50 0.00 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.435 ( -4.701 0.102 0.525) 4.731 2.744 ( -12.400 6.647 5.311) 15.038 3.102 ( 8.619 -7.829 -3.065) 12.040 3.294 ( 0.490 1.943 -0.296) 2.025 3.697 ( -0.137 13.343 2.750) 13.624 3.747 ( 2.720 -15.645 -2.491) 16.073 4.365 ( 2.394 2.248 -0.339) 3.302 4.664 ( -5.492 -3.884 3.454) 7.562 5.062 ( -0.319 1.384 5.021) 5.218 5.228 ( -1.952 -0.387 -1.781) 2.671 5.362 ( 1.096 0.771 -0.958) 1.647 5.708 ( -2.270 -4.075 -2.454) 5.271 6.413 ( 4.176 -5.050 8.373) 10.632 6.592 ( -2.669 0.067 -2.810) 3.876 6.742 ( -0.333 4.807 -9.812) 10.931 7.585 ( -1.132 5.651 5.117) 7.707 8.312 ( -6.079 -2.780 1.476) 6.846 9.036 ( -13.757 -10.106 8.240) 18.955 9.105 ( 6.719 -3.058 -0.125) 7.383 9.321 ( 3.755 13.350 -0.640) 13.883 9.938 ( -7.843 1.794 16.345) 18.218 10.349 ( 10.802 2.926 -20.599) 23.443 10.482 ( 5.879 2.071 -3.864) 7.334 11.646 ( 0.444 -1.721 -0.201) 1.788 12.083 ( -2.964 0.922 1.131) 3.303 12.159 ( -0.509 -1.643 -3.130) 3.571 12.605 ( -0.335 3.473 3.235) 4.758 13.134 ( 3.843 -7.617 -4.044) 9.442 17.118 ( 1.398 -2.575 10.253) 10.664 17.781 ( -3.050 1.328 -12.852) 13.275 18.394 ( 1.435 0.835 1.778) 2.432 18.844 ( -0.540 -0.355 0.994) 1.185 19.635 ( 0.395 2.171 -0.063) 2.207 22.637 ( -6.733 -11.561 3.909) 13.938 22.809 ( 7.785 9.428 -4.196) 12.927 23.942 ( 2.716 -1.251 2.302) 3.774 ======================= Grid point 629 (313/361) ======================= q-point: (-0.40 0.00 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.324 ( -12.632 10.247 5.919) 17.309 2.564 ( -11.925 6.756 13.092) 18.954 3.274 ( 5.694 -1.652 -4.809) 7.635 3.359 ( 13.034 -7.256 -3.049) 15.226 3.573 ( -2.359 11.342 -0.732) 11.608 3.878 ( 0.466 -17.081 -4.418) 17.649 4.258 ( -15.319 -5.191 -0.166) 16.175 4.717 ( 1.644 -0.530 2.379) 2.940 5.062 ( 1.356 8.001 -1.126) 8.193 5.267 ( 8.857 1.254 4.568) 10.044 5.411 ( 5.469 -1.129 -0.007) 5.584 5.719 ( 3.015 -1.306 -0.339) 3.303 6.405 ( -6.212 -1.380 -10.989) 12.698 6.618 ( 1.506 -2.232 -0.666) 2.774 6.726 ( 0.001 -8.104 10.702) 13.424 7.590 ( -5.271 -2.915 5.671) 8.273 8.310 ( 1.067 5.346 5.912) 8.042 8.971 ( -10.334 -0.704 1.783) 10.511 9.148 ( 9.882 17.056 -7.018) 20.924 9.273 ( -10.645 -10.217 8.498) 17.027 10.013 ( -13.242 -3.173 18.649) 23.091 10.226 ( 8.200 2.024 -18.790) 20.601 10.486 ( 5.208 2.120 -4.895) 7.455 11.595 ( -5.388 2.379 -1.988) 6.217 12.076 ( -2.697 -0.499 4.216) 5.029 12.150 ( 0.942 0.148 -0.065) 0.956 12.597 ( -0.431 5.157 2.910) 5.937 13.152 ( 5.627 -2.007 -10.795) 12.338 17.191 ( 2.127 -1.841 -7.393) 7.910 17.794 ( 10.764 0.403 8.752) 13.879 18.412 ( -3.158 -7.529 -1.689) 8.337 18.902 ( 9.397 2.808 0.484) 9.819 19.593 ( -4.186 3.294 1.370) 5.500 22.646 ( -7.135 -8.684 -1.854) 11.391 22.808 ( 4.004 1.013 -1.625) 4.438 23.893 ( -5.362 4.184 -5.237) 8.584 ======================= Grid point 630 (314/361) ======================= q-point: (-0.30 0.00 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.131 ( -12.359 10.716 11.034) 19.732 2.609 ( -3.935 3.956 18.228) 19.063 3.224 ( -3.765 -0.758 -8.003) 8.877 3.473 ( 4.446 8.485 -0.838) 9.616 3.529 ( 8.767 -4.031 -6.720) 11.759 3.940 ( -1.584 -16.195 -8.898) 18.546 4.122 ( -12.390 -7.158 2.287) 14.491 4.676 ( -4.191 5.549 -3.542) 7.804 5.049 ( 4.010 3.368 4.730) 7.057 5.469 ( 16.243 1.876 -2.385) 16.524 5.555 ( 8.367 0.307 9.549) 12.700 5.797 ( 7.593 -0.511 -0.509) 7.627 6.200 ( -9.354 -2.726 -8.047) 12.636 6.562 ( -2.314 0.440 -5.468) 5.954 7.014 ( 0.359 -15.142 15.201) 21.459 7.637 ( -5.760 -9.632 6.570) 13.004 8.368 ( 3.946 10.079 8.512) 13.770 8.833 ( -5.958 4.817 -1.663) 7.840 8.991 ( -0.660 16.864 -2.482) 17.059 9.345 ( -7.673 -14.272 4.998) 16.957 10.032 ( -12.590 2.499 14.174) 19.122 10.103 ( -3.217 -2.093 -8.097) 8.961 10.482 ( 7.232 0.411 -8.874) 11.455 11.420 ( -11.405 3.882 -3.339) 12.502 12.105 ( -1.349 1.158 5.757) 6.025 12.167 ( 1.733 1.854 0.713) 2.636 12.584 ( -0.535 5.322 4.449) 6.957 13.100 ( 8.352 -0.116 -14.751) 16.952 17.145 ( 5.529 -1.505 -8.641) 10.368 18.101 ( 15.349 3.530 6.501) 17.039 18.412 ( -4.765 -14.541 -2.278) 15.471 19.076 ( 18.117 4.013 1.549) 18.620 19.511 ( -7.919 3.351 5.734) 10.336 22.537 ( -9.015 -6.025 -9.418) 14.362 22.856 ( 0.529 -5.438 0.317) 5.472 23.627 ( -11.294 9.065 -8.681) 16.885 ======================= Grid point 631 (315/361) ======================= q-point: (-0.20 0.00 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.089 ( -4.347 4.906 12.868) 14.441 2.778 ( -1.634 1.861 20.348) 20.498 3.041 ( -8.016 -0.634 -7.422) 10.943 3.474 ( 1.992 -0.621 -4.147) 4.642 3.538 ( 9.562 2.845 -11.079) 14.909 3.911 ( -4.182 -10.864 -8.849) 14.623 4.091 ( -4.298 -6.667 0.053) 7.932 4.483 ( -6.839 8.139 -4.114) 11.399 5.203 ( 8.017 0.538 8.572) 11.749 5.607 ( 6.779 2.811 3.625) 8.185 5.790 ( 10.825 0.270 1.702) 10.962 5.909 ( 10.028 -0.121 -2.753) 10.400 6.045 ( -5.812 -1.554 0.505) 6.037 6.445 ( -3.560 0.050 -6.269) 7.210 7.310 ( -0.415 -14.424 12.356) 18.997 7.759 ( -4.696 -15.417 7.925) 17.960 8.422 ( 3.381 10.719 7.268) 13.385 8.722 ( -3.846 5.385 3.237) 7.367 8.793 ( -4.477 15.362 -1.047) 16.035 9.414 ( -2.966 -14.291 -2.859) 14.873 9.940 ( 1.573 9.134 -6.413) 11.271 10.026 ( -23.725 -3.630 22.825) 33.121 10.455 ( 7.987 -0.761 -14.648) 16.701 11.138 ( -15.978 3.547 -6.359) 17.559 12.144 ( 2.410 2.484 2.004) 3.999 12.183 ( 0.836 3.829 3.441) 5.216 12.602 ( -1.405 3.019 7.288) 8.013 13.061 ( 10.172 -1.330 -14.790) 17.999 17.185 ( 8.059 -1.194 -3.060) 8.703 18.124 ( -1.489 1.128 -11.038) 11.195 18.602 ( 12.230 -8.937 3.809) 15.619 19.239 ( 2.627 1.573 -1.833) 3.568 19.596 ( 10.227 2.787 18.429) 21.260 22.259 ( -16.184 -5.150 -17.914) 24.685 22.909 ( 0.222 -5.172 -0.397) 5.192 23.290 ( -11.480 9.682 -5.222) 15.900 ======================= Grid point 632 (316/361) ======================= q-point: (-0.10 0.00 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.202 ( 2.588 1.157 12.108) 12.435 2.784 ( -9.015 0.387 -5.706) 10.676 3.076 ( 1.806 -2.533 18.326) 18.588 3.415 ( 0.122 -2.047 -7.504) 7.779 3.505 ( 5.703 1.414 -12.236) 13.574 3.846 ( -1.551 -3.758 -6.166) 7.385 4.087 ( -0.105 -3.478 -3.069) 4.640 4.275 ( -7.824 6.400 -2.452) 10.401 5.423 ( 7.384 -0.317 9.601) 12.116 5.696 ( 1.612 2.587 5.394) 6.195 5.809 ( -2.018 0.220 -0.860) 2.205 5.975 ( 5.359 0.904 -4.800) 7.250 6.127 ( 5.681 -0.481 4.009) 6.970 6.343 ( -0.005 -0.524 -6.415) 6.436 7.538 ( -0.639 -8.105 12.043) 14.531 7.932 ( -2.994 -17.909 2.362) 18.311 8.441 ( -0.017 11.198 8.183) 13.869 8.596 ( -4.310 8.623 -1.740) 9.795 8.724 ( -2.845 3.581 11.819) 12.673 9.410 ( 2.926 -7.788 -16.187) 18.199 9.838 ( -3.763 5.301 4.834) 8.101 10.047 ( -15.890 -0.604 25.589) 30.127 10.359 ( 4.992 0.947 -17.789) 18.500 10.814 ( -10.727 1.023 -11.366) 15.662 12.178 ( 5.588 2.487 -1.536) 6.306 12.194 ( -1.726 3.237 4.354) 5.694 12.662 ( -3.126 0.096 10.490) 10.946 13.046 ( 9.230 -1.551 -13.755) 16.637 17.302 ( 8.705 -0.177 1.839) 8.899 17.903 ( -6.415 0.759 -13.853) 15.285 18.883 ( 15.080 -4.031 0.674) 15.624 19.165 ( -10.536 -0.888 2.476) 10.860 20.067 ( 23.683 1.893 21.410) 31.982 21.769 ( -23.020 -2.007 -23.729) 33.121 22.943 ( 1.963 -2.525 -1.704) 3.624 23.057 ( -8.077 4.922 -0.749) 9.488 ======================= Grid point 634 (317/361) ======================= q-point: ( 0.10 0.10 -0.54) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.282 ( 1.438 0.000 -11.138) 11.230 2.866 ( 8.786 0.000 5.834) 10.547 3.187 ( -2.989 -0.000 -16.027) 16.304 3.349 ( -4.790 -0.000 6.777) 8.299 3.379 ( 0.973 0.000 2.554) 2.733 3.828 ( 1.194 0.000 9.759) 9.832 4.090 ( 4.152 0.000 6.532) 7.740 4.349 ( 7.699 0.000 -0.436) 7.712 5.353 ( -13.126 -0.000 -6.954) 14.854 5.604 ( -11.753 -0.000 0.639) 11.771 5.784 ( -4.415 -0.000 1.189) 4.572 5.807 ( -9.826 -0.000 6.858) 11.982 6.160 ( 1.843 0.000 -8.759) 8.951 6.339 ( 4.808 0.000 3.683) 6.057 7.627 ( -3.549 -0.000 -6.242) 7.180 7.971 ( -4.728 -0.000 4.316) 6.401 8.466 ( -6.897 -0.000 10.934) 12.927 8.511 ( 4.078 0.000 -6.138) 7.370 8.845 ( -0.214 -0.000 -16.109) 16.110 9.272 ( -0.525 -0.000 17.533) 17.541 9.987 ( 12.465 0.000 -9.143) 15.458 10.139 ( -3.506 -0.000 17.789) 18.131 10.556 ( 23.233 0.000 -25.350) 34.386 10.922 ( 17.905 0.000 12.549) 21.865 12.079 ( -3.920 -0.000 1.624) 4.244 12.248 ( 1.589 0.000 -4.949) 5.197 12.787 ( 1.687 0.000 -13.656) 13.760 12.796 ( -12.263 -0.000 13.432) 18.188 17.205 ( -8.996 -0.000 -4.252) 9.951 17.877 ( 5.041 0.000 11.601) 12.649 18.695 ( -13.825 -0.000 1.196) 13.876 19.172 ( -9.679 -0.000 2.892) 10.102 20.042 ( -6.097 -0.000 -25.948) 26.655 21.852 ( 15.755 0.000 23.185) 28.031 22.952 ( 3.863 0.000 2.800) 4.771 23.170 ( 10.050 0.000 -1.500) 10.161 ======================= Grid point 635 (318/361) ======================= q-point: ( 0.20 0.10 -0.54) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.215 ( 5.436 -3.550 -10.094) 12.002 2.927 ( 1.009 -0.866 -17.644) 17.694 3.034 ( -1.075 1.321 8.263) 8.437 3.339 ( -5.674 -3.275 2.224) 6.919 3.466 ( 3.351 0.319 4.350) 5.501 3.950 ( 1.046 7.646 13.289) 15.367 4.231 ( 10.009 4.245 3.405) 11.393 4.469 ( 4.520 -6.990 1.043) 8.390 5.115 ( -10.844 -0.175 -3.605) 11.429 5.400 ( -19.138 -2.367 -0.053) 19.284 5.683 ( -8.665 1.698 -1.335) 8.930 5.747 ( -8.896 -1.436 3.907) 9.822 6.151 ( 6.449 0.170 -2.239) 6.829 6.453 ( 4.234 -1.019 3.696) 5.712 7.473 ( -2.681 9.106 -6.786) 11.669 7.850 ( -9.633 2.270 -3.143) 10.384 8.404 ( -1.039 6.763 -0.248) 6.847 8.616 ( -3.574 -14.929 2.574) 15.565 8.763 ( 3.679 -4.821 -3.774) 7.143 9.430 ( -2.854 3.142 15.845) 16.404 10.068 ( 16.690 6.866 -8.092) 19.779 10.289 ( -0.343 -1.066 10.962) 11.019 10.578 ( 23.884 2.121 -25.501) 35.004 11.281 ( 15.154 -2.016 6.206) 16.499 12.086 ( 0.157 -1.391 2.952) 3.267 12.203 ( -0.483 -2.816 -6.223) 6.848 12.659 ( -0.085 -1.205 -10.105) 10.177 12.784 ( -12.417 -1.573 14.178) 18.912 17.063 ( -8.447 0.576 1.265) 8.561 18.028 ( -2.545 -1.471 6.451) 7.089 18.547 ( -5.234 4.136 2.343) 7.070 19.014 ( -17.158 -2.577 2.209) 17.490 19.766 ( 5.231 1.780 -20.422) 21.156 22.231 ( 2.553 -2.680 17.161) 17.556 23.059 ( 10.141 9.570 3.413) 14.355 23.334 ( 10.463 -7.960 1.583) 13.242 ======================= Grid point 636 (319/361) ======================= q-point: ( 0.30 0.10 -0.54) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.276 ( 9.505 -7.361 -5.677) 13.295 2.761 ( 3.846 -1.976 -15.339) 15.937 3.094 ( -8.763 0.838 12.742) 15.488 3.309 ( -4.792 -5.489 -1.624) 7.466 3.528 ( 1.957 0.060 0.001) 1.958 4.007 ( -0.114 14.316 11.799) 18.553 4.379 ( 13.658 5.921 0.579) 14.897 4.573 ( -5.399 -8.124 3.622) 10.405 5.001 ( -3.544 -0.325 0.118) 3.560 5.187 ( -14.593 -7.604 1.125) 16.494 5.516 ( -6.749 3.092 -4.074) 8.468 5.691 ( -6.287 -1.201 3.085) 7.106 6.243 ( 3.533 0.027 4.871) 6.017 6.545 ( 1.408 -1.769 2.816) 3.612 7.212 ( -4.807 13.480 -12.032) 18.697 7.666 ( -11.249 -4.625 -4.149) 12.851 8.350 ( 1.245 4.150 -0.297) 4.343 8.703 ( -6.811 -12.402 5.918) 15.337 8.900 ( 6.845 -5.990 2.588) 9.457 9.514 ( -3.473 5.254 12.808) 14.273 10.105 ( 11.959 12.786 -5.327) 18.299 10.390 ( 3.832 -1.648 -0.545) 4.207 10.574 ( 20.562 4.797 -22.354) 30.749 11.497 ( 6.853 -2.509 2.198) 7.621 12.137 ( 0.973 -0.189 -0.043) 0.992 12.150 ( -1.258 -2.913 -3.862) 4.999 12.589 ( 0.448 -3.574 -5.480) 6.557 12.851 ( -6.240 -5.562 14.454) 16.697 17.008 ( -6.128 0.362 8.110) 10.172 17.940 ( -10.636 -4.060 -7.558) 13.666 18.554 ( 4.545 10.164 6.330) 12.807 18.855 ( -9.585 -2.208 0.714) 9.862 19.646 ( 4.219 -1.059 -11.688) 12.471 22.385 ( -8.004 -7.026 10.168) 14.725 23.105 ( 10.977 16.707 -0.541) 19.998 23.621 ( 9.373 -10.866 6.748) 15.858 ======================= Grid point 637 (320/361) ======================= q-point: ( 0.40 0.10 -0.54) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.411 ( 4.906 -2.392 0.944) 5.539 2.752 ( 8.845 -5.399 -7.810) 12.976 3.058 ( -11.860 2.555 10.149) 15.818 3.267 ( -2.941 -4.569 -3.099) 6.256 3.555 ( 1.177 -5.495 -1.600) 5.843 3.976 ( -0.257 17.090 6.702) 18.359 4.382 ( -11.310 -1.003 -3.638) 11.923 4.609 ( 0.651 -1.396 7.146) 7.310 5.041 ( 3.780 -4.910 3.271) 7.006 5.176 ( -0.333 -3.661 0.608) 3.726 5.389 ( -1.194 2.190 -2.880) 3.810 5.679 ( -2.116 0.119 4.397) 4.881 6.351 ( -0.597 -2.351 8.798) 9.126 6.577 ( -3.146 -1.484 1.363) 3.736 6.866 ( -6.839 9.316 -13.583) 17.834 7.522 ( -12.245 -10.681 -4.455) 16.849 8.372 ( 5.506 6.809 4.349) 9.777 8.785 ( -10.435 -12.951 8.653) 18.748 9.067 ( 7.317 -2.364 2.044) 7.957 9.541 ( -1.686 7.830 7.186) 10.760 10.051 ( 0.285 11.305 0.607) 11.324 10.388 ( 13.163 1.316 -20.052) 24.022 10.560 ( 11.427 5.902 -9.103) 15.757 11.595 ( 0.559 -3.300 2.124) 3.964 12.109 ( -2.091 1.381 -0.215) 2.515 12.131 ( -1.162 -1.405 -0.181) 1.833 12.595 ( 1.962 -4.695 -3.733) 6.311 13.013 ( 0.169 -5.174 9.761) 11.049 17.086 ( -1.624 -1.164 12.869) 13.024 17.713 ( -7.876 -6.209 -13.152) 16.540 18.556 ( 3.910 14.325 1.648) 14.940 18.835 ( 2.563 -0.639 1.514) 3.044 19.607 ( -0.309 -4.873 -5.066) 7.036 22.410 ( -13.283 -10.936 7.053) 18.595 23.073 ( 9.766 17.109 -3.478) 20.005 23.864 ( 3.210 -7.544 4.021) 9.131 ======================= Grid point 638 (321/361) ======================= q-point: (-0.50 0.10 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.471 ( -0.131 5.423 6.254) 8.279 2.698 ( -14.290 8.809 7.951) 18.575 3.160 ( 11.918 -11.795 -0.567) 16.777 3.247 ( 0.163 -3.339 -3.506) 4.845 3.613 ( -0.888 -11.386 -2.833) 11.767 3.853 ( -0.172 17.767 -0.219) 17.769 4.153 ( -19.453 -6.780 -0.891) 20.620 4.710 ( 0.786 0.067 5.707) 5.761 5.164 ( -3.834 -1.140 -0.168) 4.003 5.237 ( 14.386 -0.202 1.177) 14.435 5.393 ( 6.151 0.167 0.319) 6.161 5.740 ( 2.729 2.579 6.768) 7.739 6.391 ( -11.007 -0.247 -4.652) 11.953 6.536 ( -2.405 -5.197 8.387) 10.156 6.659 ( -2.935 -0.953 -3.386) 4.581 7.422 ( -10.947 -13.835 -2.866) 17.874 8.465 ( 6.617 9.481 8.447) 14.319 8.829 ( -13.871 -11.928 8.735) 20.273 9.175 ( 5.259 0.690 -0.181) 5.307 9.477 ( 2.056 14.056 -2.598) 14.441 9.969 ( -12.624 1.127 10.824) 16.667 10.293 ( 17.271 3.716 -27.157) 32.397 10.559 ( 6.275 6.575 -3.420) 9.711 11.608 ( -4.815 -1.174 0.772) 5.016 12.075 ( -2.568 0.617 3.153) 4.113 12.154 ( 1.035 0.385 2.813) 3.022 12.618 ( 2.016 -2.996 -2.957) 4.667 13.125 ( 1.504 -0.780 2.179) 2.760 17.173 ( 0.295 0.048 -2.451) 2.470 17.677 ( 2.383 -12.004 5.588) 13.454 18.466 ( 1.178 12.135 -2.451) 12.435 18.947 ( 12.287 2.153 0.807) 12.501 19.580 ( -4.142 -4.845 -2.427) 6.820 22.389 ( -16.357 -13.954 5.702) 22.243 23.005 ( 8.481 14.809 -5.299) 17.869 23.906 ( -4.617 -2.592 -3.062) 6.117 ======================= Grid point 639 (322/361) ======================= q-point: (-0.40 0.10 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.365 ( -12.312 15.381 9.269) 21.773 2.655 ( -4.085 1.364 14.309) 14.943 3.196 ( -5.420 -3.007 -4.720) 7.791 3.414 ( 10.034 -8.085 -3.130) 13.260 3.620 ( -3.017 -6.493 -4.038) 8.220 3.724 ( 5.205 5.703 -8.124) 11.208 3.994 ( -12.771 -6.912 3.051) 14.838 4.725 ( -4.367 0.783 -0.403) 4.455 5.121 ( 0.368 3.301 3.637) 4.925 5.451 ( 15.874 -2.572 -3.086) 16.375 5.565 ( 10.588 0.744 7.903) 13.233 5.840 ( 5.602 4.719 5.370) 9.082 6.152 ( -12.258 -2.282 -5.178) 13.501 6.565 ( -3.525 -0.154 -3.505) 4.973 6.758 ( -2.567 -13.548 13.278) 19.142 7.406 ( -8.314 -15.517 0.631) 17.616 8.563 ( 4.983 10.532 9.012) 14.730 8.823 ( -12.088 -6.981 7.224) 15.718 9.158 ( -5.630 1.808 -2.474) 6.410 9.349 ( 7.488 14.969 -4.477) 17.326 9.939 ( -18.487 -5.880 16.130) 25.229 10.183 ( 15.386 4.732 -23.606) 28.573 10.529 ( 4.543 5.935 -5.228) 9.121 11.486 ( -10.904 2.881 -1.931) 11.442 12.111 ( -0.204 -0.378 5.830) 5.845 12.204 ( 2.509 2.449 3.222) 4.762 12.636 ( 1.532 -0.273 -0.384) 1.603 13.120 ( 1.835 2.553 -4.792) 5.732 17.119 ( 4.426 -1.290 -8.462) 9.636 18.020 ( 7.695 -14.700 14.420) 21.983 18.331 ( -0.660 8.217 -5.667) 10.004 19.147 ( 17.790 3.739 1.091) 18.212 19.524 ( -4.557 -2.204 -0.161) 5.065 22.320 ( -19.574 -14.396 2.122) 24.390 22.937 ( 7.378 10.441 -5.494) 13.915 23.726 ( -10.423 2.404 -8.674) 13.771 ======================= Grid point 640 (323/361) ======================= q-point: (-0.30 0.10 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.223 ( -7.627 10.241 11.223) 17.001 2.795 ( -3.373 -0.365 17.897) 18.216 3.028 ( -10.028 -0.817 -6.819) 12.154 3.433 ( -2.140 -4.034 -7.179) 8.508 3.640 ( 7.176 6.154 -11.218) 14.670 3.678 ( 3.420 -11.899 -5.121) 13.398 3.991 ( -2.723 -5.409 3.013) 6.764 4.580 ( -8.360 2.647 -4.396) 9.809 5.229 ( 6.502 2.315 9.020) 11.357 5.641 ( 10.778 0.508 1.718) 10.926 5.789 ( 10.113 -0.410 2.526) 10.432 5.938 ( 8.552 3.964 1.150) 9.496 6.011 ( -6.910 -2.185 2.669) 7.723 6.448 ( -5.836 0.268 -4.381) 7.302 7.015 ( -1.472 -17.697 11.435) 21.122 7.469 ( -7.787 -17.444 3.941) 19.506 8.613 ( 5.223 10.868 2.706) 12.358 8.795 ( -7.353 1.276 7.346) 10.472 8.995 ( -12.521 2.120 2.503) 12.943 9.310 ( 6.642 7.665 -3.841) 10.845 9.918 ( -18.397 -5.966 14.719) 24.304 10.094 ( 10.215 6.248 -12.993) 17.669 10.464 ( 5.284 3.134 -10.093) 11.816 11.220 ( -15.907 5.239 -5.348) 17.581 12.191 ( 1.435 1.476 6.440) 6.761 12.251 ( 4.087 4.621 2.128) 6.526 12.656 ( -1.086 1.837 4.140) 4.658 13.050 ( 4.117 0.954 -10.236) 11.074 17.157 ( 8.249 -1.875 -2.628) 8.858 18.151 ( -5.558 1.049 -8.663) 10.346 18.422 ( 13.373 -9.537 7.893) 18.223 19.248 ( -4.015 -1.153 -2.192) 4.718 19.658 ( 19.758 3.939 10.809) 22.864 22.114 ( -23.153 -10.470 -6.784) 26.301 22.909 ( 5.786 4.662 -3.416) 8.178 23.424 ( -11.770 5.432 -8.626) 15.570 ======================= Grid point 641 (324/361) ======================= q-point: (-0.20 0.10 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.247 ( 0.538 4.194 11.595) 12.342 2.795 ( -9.760 0.758 -5.841) 11.400 2.998 ( -1.939 -5.815 15.247) 16.433 3.345 ( -2.004 -6.033 -8.843) 10.891 3.539 ( 2.212 1.631 -9.701) 10.082 3.757 ( 5.545 -3.958 -6.281) 9.266 4.045 ( 2.158 -1.789 1.576) 3.216 4.378 ( -8.954 3.973 -4.357) 10.721 5.427 ( 6.787 1.123 10.257) 12.350 5.764 ( 3.642 4.206 4.916) 7.425 5.818 ( -1.312 0.881 -1.523) 2.195 6.007 ( 5.645 2.657 -3.037) 6.940 6.110 ( 5.927 -1.487 5.028) 7.913 6.330 ( -2.833 -0.671 -4.088) 5.019 7.290 ( 1.038 -18.515 9.160) 20.683 7.577 ( -8.251 -20.682 4.416) 22.701 8.595 ( 6.398 8.430 -2.573) 10.891 8.766 ( -7.467 4.850 4.411) 9.936 8.857 ( -10.683 8.238 12.842) 18.625 9.295 ( 5.023 -0.306 -7.781) 9.266 9.884 ( -12.791 -2.064 11.078) 17.047 10.078 ( 4.187 4.788 2.361) 6.784 10.388 ( 6.831 2.778 -13.362) 15.262 10.862 ( -14.886 4.792 -9.498) 18.297 12.255 ( 1.016 4.388 5.083) 6.792 12.279 ( 4.357 6.629 0.798) 7.972 12.672 ( -4.631 1.139 8.439) 9.693 13.000 ( 6.848 -3.110 -12.880) 14.915 17.296 ( 9.187 -0.449 3.145) 9.721 17.930 ( -6.473 2.349 -12.032) 13.863 18.758 ( 14.307 -9.525 2.380) 17.351 19.127 ( -12.154 -3.517 0.174) 12.654 20.127 ( 27.006 4.622 17.580) 32.554 21.703 ( -25.867 -5.229 -16.762) 31.264 22.928 ( 4.566 1.269 -1.470) 4.962 23.151 ( -9.049 5.092 -4.644) 11.375 ======================= Grid point 642 (325/361) ======================= q-point: (-0.10 0.10 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.412 ( 7.252 1.044 10.266) 12.612 2.593 ( -6.142 0.945 -8.266) 10.341 3.188 ( -1.595 -8.752 7.205) 11.448 3.306 ( 0.212 -7.610 -6.353) 9.915 3.494 ( 1.509 2.887 4.964) 5.937 3.713 ( 0.133 -0.686 -11.979) 11.999 4.122 ( 1.556 1.408 3.058) 3.709 4.187 ( -2.691 4.117 -3.753) 6.187 5.604 ( 3.405 0.593 8.300) 8.990 5.725 ( -2.396 1.810 -3.838) 4.874 5.841 ( -2.550 3.191 7.971) 8.957 5.952 ( -2.435 2.247 -4.321) 5.445 6.212 ( 2.391 0.377 1.773) 3.001 6.292 ( 2.690 -0.814 -5.552) 6.222 7.581 ( 3.154 -15.452 9.901) 18.621 7.687 ( -6.876 -21.667 -0.733) 22.744 8.584 ( -9.106 7.420 2.061) 11.926 8.610 ( 5.373 9.373 0.113) 10.804 8.888 ( -5.272 4.036 17.743) 18.945 9.242 ( 6.142 -0.341 -16.249) 17.375 9.888 ( -9.594 -0.056 15.299) 18.058 10.128 ( 0.320 0.509 -5.059) 5.095 10.313 ( 4.356 7.906 5.229) 10.432 10.599 ( 3.669 -0.716 -16.718) 17.130 12.232 ( -4.610 5.617 3.379) 8.014 12.286 ( 6.447 6.714 -2.491) 9.636 12.721 ( -6.383 -1.945 11.920) 13.660 12.974 ( 6.586 -3.279 -13.394) 15.282 17.474 ( 8.247 1.021 6.869) 10.781 17.665 ( -7.829 2.284 -12.177) 14.655 18.984 ( -11.810 -5.955 4.231) 13.887 19.041 ( 9.620 -4.712 -1.630) 10.835 20.694 ( 25.098 2.634 21.996) 33.476 21.140 ( -24.193 -1.279 -23.045) 33.436 22.960 ( -1.646 1.562 0.996) 2.478 23.000 ( 2.032 1.851 -3.101) 4.144 ======================= Grid point 645 (326/361) ======================= q-point: ( 0.20 0.20 -0.54) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.209 ( 10.268 0.000 -5.358) 11.582 2.738 ( 4.245 0.000 -18.081) 18.572 3.106 ( -7.001 -0.000 11.699) 13.634 3.251 ( -5.304 -0.000 -0.761) 5.358 3.535 ( 0.467 0.000 1.657) 1.721 4.167 ( -2.005 -0.000 16.646) 16.766 4.439 ( 12.568 0.000 -0.256) 12.570 4.466 ( -0.876 -0.000 0.570) 1.045 5.023 ( 0.893 0.000 0.393) 0.976 5.085 ( -22.363 -0.000 0.654) 22.372 5.547 ( -5.249 -0.000 -5.935) 7.923 5.683 ( -7.903 -0.000 6.381) 10.158 6.243 ( 2.438 0.000 5.524) 6.039 6.528 ( 1.082 0.000 3.301) 3.474 7.383 ( -2.492 -0.000 -10.490) 10.782 7.565 ( -19.667 -0.000 -8.416) 21.392 8.398 ( 5.356 0.000 -9.127) 10.583 8.604 ( -6.609 -0.000 15.905) 17.224 8.830 ( 9.437 0.000 1.587) 9.569 9.557 ( -7.769 -0.000 16.497) 18.235 10.254 ( 24.679 0.000 -16.443) 29.655 10.353 ( -1.264 -0.000 2.608) 2.898 10.619 ( 20.074 0.000 -20.929) 29.000 11.479 ( 7.400 0.000 2.558) 7.829 12.111 ( -1.078 -0.000 -4.393) 4.523 12.138 ( 1.577 0.000 2.001) 2.548 12.541 ( 1.019 0.000 -9.031) 9.089 12.812 ( -9.398 -0.000 18.978) 21.177 17.011 ( -6.871 -0.000 7.972) 10.524 17.904 ( -11.139 -0.000 -7.281) 13.308 18.652 ( 4.317 0.000 9.659) 10.580 18.834 ( -8.617 -0.000 1.311) 8.716 19.631 ( 3.948 0.000 -16.177) 16.652 22.321 ( -9.106 -0.000 10.729) 14.072 23.390 ( 9.104 0.000 -0.177) 9.106 23.390 ( 11.296 0.000 7.662) 13.650 ======================= Grid point 646 (327/361) ======================= q-point: ( 0.30 0.20 -0.54) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.373 ( 12.982 -1.375 2.485) 13.289 2.650 ( 8.652 -4.016 -13.495) 16.525 3.115 ( -10.887 2.721 12.392) 16.718 3.185 ( -3.075 -3.553 -2.523) 5.333 3.520 ( -3.232 -0.067 -0.100) 3.234 4.218 ( -9.435 6.656 10.746) 15.773 4.384 ( -10.726 5.353 -3.521) 12.494 4.569 ( 5.341 -5.450 1.493) 7.775 4.941 ( -3.297 -3.576 6.442) 8.072 5.130 ( 8.889 -1.583 1.477) 9.149 5.423 ( -0.679 1.265 -6.104) 6.270 5.686 ( -4.530 0.345 9.501) 10.531 6.325 ( -3.755 -0.688 9.741) 10.463 6.554 ( -3.502 -0.866 2.917) 4.639 7.058 ( -13.925 12.102 -13.138) 22.649 7.299 ( -11.109 -13.237 -10.733) 20.343 8.411 ( 5.500 -2.082 -3.012) 6.607 8.695 ( -7.434 1.484 16.471) 18.132 9.021 ( 11.809 -2.225 2.159) 12.209 9.610 ( -10.600 1.410 15.738) 19.027 10.254 ( 5.542 9.317 -10.953) 15.411 10.381 ( 20.859 -2.465 -25.122) 32.746 10.653 ( 12.342 3.520 -8.112) 15.183 11.558 ( -0.290 -0.768 2.799) 2.917 12.093 ( 0.544 -1.580 0.913) 1.905 12.137 ( -2.918 0.725 0.706) 3.089 12.494 ( 2.991 -4.423 -7.159) 8.931 12.962 ( -2.296 -1.132 17.499) 17.685 17.074 ( -3.393 -0.311 15.035) 15.416 17.629 ( -9.679 -2.682 -14.833) 17.913 18.786 ( 4.560 8.911 5.566) 11.453 18.826 ( 4.520 -0.190 2.442) 5.141 19.503 ( -1.242 -5.124 -11.711) 12.843 22.279 ( -14.135 -3.793 8.047) 16.702 23.363 ( 6.972 14.507 -2.927) 16.359 23.692 ( 4.497 -10.912 5.928) 13.207 ======================= Grid point 647 (328/361) ======================= q-point: ( 0.40 0.20 -0.54) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.535 ( 5.265 3.380 4.797) 7.884 2.767 ( 8.515 -5.326 -0.941) 10.088 3.036 ( -9.764 1.798 5.500) 11.349 3.192 ( 2.673 -2.759 -0.547) 3.880 3.473 ( -4.529 -4.741 -1.462) 6.718 4.027 ( -23.472 -6.302 -1.655) 24.360 4.169 ( -1.795 16.526 1.810) 16.722 4.694 ( 1.431 -3.453 3.342) 5.014 5.060 ( -1.134 -5.112 6.566) 8.398 5.282 ( 13.087 2.069 -1.481) 13.332 5.406 ( 7.355 0.648 -1.416) 7.518 5.776 ( -0.083 1.279 12.083) 12.151 6.380 ( -10.037 -1.163 9.326) 13.750 6.482 ( -12.263 -1.092 2.759) 12.617 6.675 ( -7.061 2.958 -8.430) 11.388 7.175 ( -6.481 -13.034 -9.403) 17.329 8.492 ( 2.335 -6.267 0.206) 6.691 8.755 ( -9.110 3.957 17.692) 20.289 9.200 ( 11.047 1.368 -0.284) 11.135 9.610 ( -10.274 2.609 11.507) 15.645 10.066 ( -3.717 7.644 -8.569) 12.070 10.335 ( 23.620 0.977 -35.029) 42.260 10.702 ( 9.296 8.470 -1.373) 12.651 11.565 ( -5.630 -2.975 2.779) 6.948 12.093 ( -3.483 1.093 2.158) 4.241 12.160 ( 1.761 0.113 5.445) 5.724 12.523 ( 4.683 -6.235 -5.622) 9.613 13.121 ( -1.182 0.010 11.386) 11.448 17.199 ( -1.222 3.081 2.781) 4.327 17.460 ( -1.786 -11.431 1.172) 11.629 18.742 ( 1.999 17.198 -1.197) 17.355 18.975 ( 14.444 1.015 1.000) 14.514 19.433 ( -4.051 -11.312 -6.697) 13.756 22.203 ( -17.002 -7.155 7.553) 19.933 23.270 ( 5.148 14.511 -5.141) 16.232 23.813 ( -3.701 -7.530 -0.483) 8.404 ======================= Grid point 648 (329/361) ======================= q-point: (-0.50 0.20 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.614 ( -2.986 8.374 8.473) 12.281 2.703 ( -9.342 8.697 7.554) 14.832 3.073 ( -3.174 -11.255 -0.441) 11.702 3.298 ( 9.793 -3.733 -1.785) 10.632 3.430 ( -6.499 -9.791 -5.565) 13.003 3.810 ( -8.446 -5.374 -2.766) 10.386 4.024 ( -3.181 13.282 1.575) 13.748 4.713 ( -4.974 -2.428 -1.478) 5.730 5.137 ( 0.075 -0.696 6.750) 6.786 5.435 ( 15.432 0.955 -2.576) 15.675 5.572 ( 11.433 -0.218 4.981) 12.473 5.916 ( 2.605 2.916 10.689) 11.382 6.141 ( -16.838 1.542 -1.076) 16.942 6.551 ( -6.510 -9.964 11.727) 16.708 6.559 ( -3.826 -0.323 -1.883) 4.276 7.136 ( -4.419 -14.267 -4.966) 15.739 8.574 ( -2.038 -8.933 2.060) 9.391 8.797 ( -9.305 5.839 18.883) 21.846 9.256 ( 5.688 7.427 -6.056) 11.144 9.542 ( -2.832 5.787 0.079) 6.443 9.885 ( -12.821 0.098 5.205) 13.837 10.234 ( 21.545 1.367 -32.558) 39.065 10.699 ( 6.526 12.570 -2.683) 14.415 11.501 ( -10.046 -1.400 0.127) 10.144 12.097 ( -1.214 -0.907 4.866) 5.096 12.252 ( 3.936 2.690 5.485) 7.268 12.583 ( 4.458 -4.778 -3.766) 7.543 13.174 ( -3.263 2.933 5.037) 6.680 17.105 ( 3.068 -0.242 -9.583) 10.065 17.755 ( 3.413 -13.503 18.279) 22.980 18.553 ( -0.995 15.517 -5.559) 16.513 19.189 ( 11.618 0.295 0.572) 11.636 19.436 ( 5.609 -7.179 -4.208) 10.035 22.106 ( -20.096 -9.386 6.490) 23.110 23.145 ( 4.191 12.413 -6.390) 14.577 23.718 ( -9.494 -3.048 -7.070) 12.224 ======================= Grid point 649 (330/361) ======================= q-point: (-0.40 0.20 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.433 ( -11.108 13.119 7.991) 18.957 2.772 ( -4.132 -1.577 13.731) 14.426 3.004 ( -10.498 -2.259 -3.931) 11.436 3.326 ( -5.662 -8.614 -9.080) 13.737 3.448 ( 4.703 -9.817 -2.325) 11.131 3.795 ( 10.314 3.498 -10.256) 14.960 3.933 ( -3.236 3.045 6.369) 7.765 4.581 ( -9.833 -2.132 -4.989) 11.230 5.269 ( 5.868 1.927 9.316) 11.178 5.633 ( 14.445 -0.836 0.265) 14.472 5.778 ( 8.810 -0.849 3.146) 9.393 5.973 ( -7.785 -1.849 4.690) 9.275 6.036 ( 4.224 6.365 6.521) 10.044 6.451 ( -7.402 -0.114 -2.245) 7.736 6.725 ( -4.219 -14.764 10.669) 18.698 7.171 ( -5.412 -15.871 -0.922) 16.794 8.648 ( -2.273 -8.176 2.900) 8.968 8.839 ( -8.205 6.832 18.269) 21.160 9.076 ( -3.496 9.340 -10.005) 14.127 9.482 ( 4.431 6.909 -4.070) 9.161 9.823 ( -17.557 -4.425 15.156) 23.612 10.163 ( 20.779 1.695 -26.975) 34.092 10.606 ( 3.663 13.084 -4.822) 14.417 11.301 ( -14.531 3.432 -3.675) 15.377 12.177 ( -0.316 -2.551 6.910) 7.373 12.351 ( 8.154 6.143 3.478) 10.785 12.635 ( 2.506 -3.850 -1.863) 4.957 13.106 ( -4.663 4.769 -0.680) 6.704 17.124 ( 8.424 -1.837 -2.482) 8.973 18.079 ( -0.430 -9.068 8.164) 12.209 18.383 ( 3.152 5.637 -2.675) 6.990 19.186 ( -9.041 -6.012 -3.722) 11.477 19.724 ( 29.575 3.404 4.567) 30.119 21.935 ( -24.553 -9.070 1.549) 26.220 23.035 ( 4.260 8.797 -5.833) 11.382 23.478 ( -11.039 0.856 -9.406) 14.528 ======================= Grid point 650 (331/361) ======================= q-point: (-0.30 0.20 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.349 ( -3.037 7.128 9.990) 12.642 2.803 ( -10.197 -0.082 -5.508) 11.590 2.893 ( -5.067 -5.659 12.376) 14.521 3.213 ( -3.904 -8.271 -10.548) 13.961 3.527 ( 0.325 -2.841 -0.471) 2.898 3.770 ( 11.189 4.859 -10.815) 16.303 4.008 ( 2.961 -2.240 4.314) 5.692 4.398 ( -9.975 -1.534 -5.134) 11.323 5.458 ( 6.765 2.030 10.113) 12.335 5.815 ( 8.004 1.011 2.096) 8.335 5.837 ( 0.171 1.245 -0.239) 1.279 6.045 ( 2.158 -0.278 4.401) 4.909 6.105 ( 5.270 3.085 3.160) 6.876 6.326 ( -5.698 0.261 -1.467) 5.890 6.949 ( -0.978 -19.259 8.681) 21.148 7.231 ( -7.349 -18.328 0.500) 19.753 8.704 ( 1.043 -2.122 -0.689) 2.463 8.810 ( -5.678 6.747 -0.141) 8.819 8.929 ( -8.925 3.445 14.732) 17.566 9.410 ( 4.945 8.400 -8.215) 12.748 9.813 ( -18.592 -4.752 18.804) 26.867 10.151 ( 19.808 2.227 -20.036) 28.262 10.499 ( 5.751 10.961 -5.119) 13.395 10.973 ( -16.080 7.209 -7.083) 18.992 12.276 ( -1.345 -1.728 8.239) 8.525 12.425 ( 8.720 8.947 -0.314) 12.498 12.680 ( -0.715 -1.455 3.172) 3.562 12.977 ( -2.047 1.676 -6.882) 7.373 17.287 ( 10.242 -0.662 4.988) 11.411 17.984 ( -6.568 3.746 -9.396) 12.060 18.576 ( 10.365 -10.503 5.190) 15.642 19.042 ( -12.061 -6.148 -3.523) 13.988 20.216 ( 32.009 5.106 11.809) 34.498 21.601 ( -28.200 -5.917 -7.877) 29.872 22.984 ( 4.735 4.772 -3.230) 7.458 23.222 ( -9.060 2.859 -6.787) 11.675 ======================= Grid point 651 (332/361) ======================= q-point: (-0.20 0.20 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.445 ( 5.384 2.737 9.936) 11.628 2.617 ( -4.980 1.688 -7.313) 9.007 3.022 ( -3.004 -9.313 7.783) 12.503 3.151 ( -0.849 -9.395 -6.732) 11.589 3.534 ( -1.600 1.910 5.039) 5.621 3.728 ( 5.247 2.445 -12.272) 13.569 4.130 ( 1.279 -1.202 5.257) 5.543 4.233 ( -2.538 0.696 -5.358) 5.970 5.630 ( 3.895 2.027 8.766) 9.804 5.762 ( -3.007 2.106 -4.572) 5.863 5.908 ( -1.202 4.093 6.712) 7.953 6.000 ( -2.634 2.866 -3.770) 5.419 6.214 ( 2.735 -0.454 3.129) 4.181 6.282 ( 2.085 0.270 -3.266) 3.884 7.235 ( 0.552 -22.590 7.573) 23.832 7.312 ( -3.878 -19.957 -0.286) 20.332 8.677 ( -10.066 2.491 2.076) 10.576 8.718 ( 7.395 3.679 -2.634) 8.669 8.978 ( -8.858 5.256 18.508) 21.181 9.297 ( 6.722 6.357 -12.640) 15.664 9.834 ( -16.794 -5.029 19.120) 25.941 10.177 ( 13.944 2.722 -15.325) 20.897 10.481 ( 9.228 11.393 2.038) 14.802 10.629 ( -6.078 5.265 -11.185) 13.776 12.329 ( -3.982 3.847 6.456) 8.505 12.425 ( 5.687 7.672 -3.411) 10.141 12.698 ( -6.852 0.733 9.376) 11.636 12.905 ( 5.849 -3.705 -11.318) 13.268 17.500 ( 8.618 1.799 9.034) 12.614 17.718 ( -7.821 3.637 -12.446) 15.142 18.837 ( -4.747 -10.414 5.554) 12.721 18.934 ( 3.766 -7.027 -4.247) 9.033 20.755 ( 23.232 4.150 18.124) 29.756 21.110 ( -22.341 -2.090 -17.557) 28.491 22.999 ( 2.469 2.758 0.233) 3.709 23.041 ( -2.610 2.556 -3.872) 5.323 ======================= Grid point 652 (333/361) ======================= q-point: (-0.10 0.20 -0.54) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.458 ( -0.233 3.515 -9.660) 10.282 2.651 ( 10.007 0.679 8.169) 12.936 3.152 ( -2.239 -8.932 6.649) 11.358 3.185 ( 1.640 -7.882 -2.907) 8.559 3.587 ( 0.054 4.367 -11.511) 12.311 3.600 ( -1.318 -2.850 8.979) 9.512 4.063 ( -5.544 0.858 -0.255) 5.616 4.314 ( 9.743 2.583 2.046) 10.285 5.601 ( -7.880 1.436 -7.166) 10.747 5.721 ( -1.221 2.421 5.518) 6.148 5.832 ( -8.863 1.227 0.902) 8.993 5.934 ( -4.479 5.116 3.585) 7.687 6.230 ( 0.242 -1.628 -6.044) 6.264 6.284 ( 4.371 2.590 0.174) 5.083 7.391 ( -5.453 -21.547 -1.504) 22.277 7.578 ( 6.115 -19.592 4.565) 21.026 8.530 ( -9.574 5.703 3.180) 11.589 8.777 ( 5.778 7.982 1.474) 9.964 9.025 ( -5.144 0.174 13.530) 14.476 9.191 ( 6.750 7.462 -13.232) 16.623 9.863 ( -11.606 -6.799 9.334) 16.373 10.100 ( -0.745 7.143 1.783) 7.400 10.489 ( 14.232 -2.410 -18.441) 23.418 10.670 ( 17.220 8.653 8.211) 20.948 12.243 ( -6.406 7.382 1.860) 9.950 12.379 ( 3.385 6.173 -4.831) 8.538 12.732 ( -8.625 -3.713 11.506) 14.851 12.890 ( 6.285 -0.352 -10.593) 12.323 17.430 ( -9.675 1.694 -10.011) 14.025 17.706 ( 7.366 3.024 10.099) 12.860 18.758 ( -14.836 -7.285 2.210) 16.675 19.132 ( 9.458 -5.161 -0.123) 10.776 20.494 ( -26.468 -2.331 -18.595) 32.431 21.355 ( 27.660 3.737 17.237) 32.805 22.924 ( -3.274 1.260 -0.610) 3.561 23.095 ( 8.503 2.114 0.859) 8.804 ======================= Grid point 656 (334/361) ======================= q-point: ( 0.30 0.30 -0.54) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.623 ( 8.989 0.000 10.457) 13.790 2.627 ( 10.319 0.000 -8.040) 13.081 3.090 ( 0.413 0.000 -6.441) 6.454 3.162 ( -7.388 -0.000 12.823) 14.799 3.435 ( -7.726 -0.000 -0.999) 7.790 3.961 ( -24.939 -0.000 -0.677) 24.948 4.364 ( -5.015 -0.000 -0.571) 5.048 4.613 ( 3.343 0.000 3.421) 4.784 5.025 ( 0.635 0.000 8.178) 8.202 5.299 ( 12.809 0.000 0.508) 12.819 5.410 ( 7.959 0.000 -4.044) 8.927 5.786 ( -1.796 -0.000 14.252) 14.365 6.367 ( -8.285 -0.000 12.928) 15.355 6.475 ( -16.077 -0.000 3.545) 16.464 6.725 ( -15.246 -0.000 -8.859) 17.633 7.035 ( 0.857 0.000 -14.151) 14.177 8.420 ( 1.814 0.000 -1.088) 2.115 8.805 ( -9.437 -0.000 18.988) 21.204 9.213 ( 14.075 0.000 -0.095) 14.075 9.626 ( -14.555 -0.000 16.039) 21.659 10.147 ( -2.361 -0.000 -14.481) 14.673 10.338 ( 27.031 0.000 -38.496) 47.039 10.790 ( 11.925 0.000 -1.337) 12.000 11.534 ( -7.365 -0.000 3.229) 8.042 12.104 ( -4.088 -0.000 2.100) 4.596 12.159 ( 2.620 0.000 6.502) 7.010 12.459 ( 5.718 0.000 -5.341) 7.824 13.121 ( -1.883 -0.000 13.942) 14.068 17.268 ( 0.256 0.000 21.587) 21.588 17.316 ( -5.035 -0.000 -17.368) 18.084 18.955 ( 1.976 0.000 4.316) 4.747 18.982 ( 16.379 0.000 0.692) 16.393 19.274 ( -5.272 -0.000 -12.920) 13.955 22.140 ( -17.034 -0.000 8.109) 18.866 23.438 ( 3.514 0.000 -7.268) 8.073 23.707 ( -3.158 -0.000 2.768) 4.200 ======================= Grid point 657 (335/361) ======================= q-point: ( 0.40 0.30 -0.54) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.692 ( 4.539 4.840 5.000) 8.308 2.830 ( -0.401 -6.583 6.601) 9.332 2.961 ( -6.499 7.528 -4.419) 10.883 3.221 ( -3.975 -6.754 3.320) 8.511 3.323 ( -5.456 -1.442 -1.751) 5.909 3.710 ( -9.712 -3.969 -0.081) 10.492 4.243 ( -3.653 8.818 -1.556) 9.671 4.642 ( -4.742 -4.360 -2.264) 6.828 5.135 ( 2.902 0.443 8.241) 8.748 5.466 ( 12.852 1.980 -0.639) 13.020 5.551 ( 11.577 -1.832 2.148) 11.917 5.938 ( -0.510 0.234 12.072) 12.085 6.194 ( -20.796 3.101 4.814) 21.570 6.418 ( -9.830 -4.703 12.979) 16.947 6.560 ( -4.149 0.388 -2.076) 4.656 6.943 ( 1.782 -6.557 -10.287) 12.329 8.446 ( -0.637 -4.128 1.288) 4.371 8.876 ( -11.607 2.359 20.231) 23.444 9.361 ( 11.608 3.561 -4.152) 12.832 9.580 ( -12.812 0.121 7.898) 15.051 9.916 ( -7.168 1.913 -9.213) 11.828 10.244 ( 23.672 0.065 -36.121) 43.187 10.899 ( 11.158 7.783 -3.341) 14.009 11.452 ( -10.340 -2.867 1.905) 10.898 12.087 ( -3.277 -0.269 4.051) 5.217 12.286 ( 4.938 1.059 6.900) 8.551 12.509 ( 6.147 -2.628 -3.626) 7.605 13.210 ( -5.015 1.036 9.585) 10.867 17.108 ( 1.964 0.322 -12.195) 12.357 17.584 ( 2.645 -5.401 22.858) 23.636 18.842 ( -4.989 16.716 -5.602) 18.322 19.102 ( -6.044 -11.356 -3.083) 13.228 19.339 ( 27.651 -2.280 -3.514) 27.966 21.998 ( -19.788 -3.060 8.049) 21.581 23.337 ( 1.462 7.929 -7.966) 11.334 23.640 ( -8.730 -4.572 -4.254) 10.734 ======================= Grid point 658 (336/361) ======================= q-point: ( 0.50 0.30 -0.54) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.654 ( -14.151 10.999 4.766) 18.545 2.765 ( -4.389 1.531 7.269) 8.628 2.941 ( -4.976 -4.772 -0.154) 6.896 3.155 ( -7.860 -9.574 -4.096) 13.046 3.337 ( 3.649 -3.560 -0.800) 5.160 3.749 ( 7.613 -4.116 -1.670) 8.814 4.097 ( -1.752 10.463 -1.722) 10.747 4.520 ( -10.837 -4.419 -5.254) 12.829 5.295 ( 6.639 1.169 8.717) 11.019 5.627 ( 12.723 0.220 0.025) 12.725 5.756 ( 9.260 -1.691 3.719) 10.122 5.947 ( -8.185 -1.100 5.337) 9.834 6.141 ( -0.731 5.057 11.766) 12.828 6.434 ( -9.397 -2.605 3.001) 10.203 6.528 ( -5.646 -6.355 7.272) 11.187 6.939 ( -0.217 -9.962 -5.792) 11.525 8.510 ( -1.059 -6.003 4.055) 7.321 8.928 ( -12.011 3.169 21.260) 24.623 9.268 ( -0.883 10.895 -13.716) 17.538 9.523 ( 3.307 -1.604 -5.570) 6.673 9.771 ( -16.087 -1.554 11.926) 20.086 10.172 ( 23.302 -0.131 -31.189) 38.932 10.866 ( 6.018 14.320 -5.038) 16.330 11.325 ( -11.911 -0.846 -1.608) 12.049 12.124 ( -1.975 -2.862 6.141) 7.057 12.444 ( 10.561 3.922 5.301) 12.451 12.557 ( 3.456 -3.923 -4.682) 7.018 13.183 ( -8.712 3.391 5.523) 10.858 17.097 ( 8.494 -1.123 -2.762) 9.002 17.926 ( 2.908 -6.938 17.619) 19.157 18.540 ( -7.216 10.595 -7.960) 15.089 19.045 ( -8.471 -9.487 -5.287) 13.774 19.770 ( 35.496 1.830 1.266) 35.566 21.814 ( -24.227 -4.626 5.399) 25.249 23.189 ( 1.006 8.014 -7.225) 10.837 23.461 ( -9.915 -2.486 -8.326) 13.184 ======================= Grid point 659 (337/361) ======================= q-point: (-0.40 0.30 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.482 ( -7.059 7.614 7.380) 12.738 2.778 ( -6.167 -2.777 -0.507) 6.782 2.822 ( -9.615 -2.363 4.749) 10.981 3.086 ( -4.618 -5.693 -7.389) 10.408 3.466 ( 5.485 -3.578 4.173) 7.765 3.848 ( 12.014 1.502 -10.602) 16.093 4.007 ( -1.171 3.916 3.667) 5.491 4.339 ( -10.830 -4.743 -5.558) 13.065 5.485 ( 6.707 0.854 8.854) 11.140 5.791 ( 7.932 -2.861 -1.585) 8.580 5.870 ( 4.230 2.296 3.044) 5.695 6.016 ( 1.903 -2.172 8.438) 8.918 6.187 ( -1.263 4.746 3.883) 6.261 6.339 ( -6.305 0.993 1.275) 6.509 6.650 ( -4.222 -14.074 9.244) 17.359 6.958 ( -2.849 -12.356 -4.328) 13.398 8.605 ( -1.274 -5.725 5.217) 7.849 8.976 ( -2.771 8.321 -13.249) 15.889 8.990 ( -10.555 4.201 21.177) 24.031 9.500 ( 6.711 1.908 -11.195) 13.191 9.739 ( -20.127 -3.393 20.577) 28.983 10.161 ( 23.474 -0.413 -26.759) 35.598 10.748 ( 5.506 15.598 -3.816) 16.976 11.090 ( -13.582 5.504 -4.541) 15.343 12.215 ( -1.939 -4.546 8.078) 9.470 12.534 ( 3.683 0.352 -5.685) 6.783 12.651 ( 11.378 1.830 3.147) 11.946 13.048 ( -10.815 5.043 1.412) 12.016 17.274 ( 11.575 -0.735 6.397) 13.245 18.049 ( -5.032 3.025 -4.764) 7.560 18.422 ( 1.449 -6.241 5.596) 8.507 18.922 ( -8.829 -7.040 -6.760) 13.161 20.294 ( 36.813 3.653 6.419) 37.547 21.511 ( -29.250 -4.133 -1.466) 29.577 23.078 ( 2.277 5.488 -4.759) 7.613 23.250 ( -8.012 0.375 -7.182) 10.766 ======================= Grid point 660 (338/361) ======================= q-point: (-0.30 0.30 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.504 ( 3.035 3.793 8.660) 9.929 2.647 ( -3.176 1.606 -5.430) 6.492 2.881 ( -2.542 -6.520 6.863) 9.802 3.000 ( -2.212 -7.365 -6.220) 9.890 3.568 ( -2.325 2.149 7.718) 8.343 3.789 ( 5.872 4.105 -13.814) 15.562 4.080 ( -2.583 -4.113 7.070) 8.577 4.215 ( 1.640 -2.309 -6.725) 7.297 5.654 ( 3.658 0.309 8.073) 8.868 5.785 ( -2.513 0.127 -5.092) 5.679 5.971 ( 0.533 2.934 5.167) 5.966 6.043 ( -1.134 2.035 -2.997) 3.796 6.204 ( -2.173 0.035 7.322) 7.638 6.304 ( 3.621 1.525 -2.460) 4.636 6.862 ( -3.796 -18.676 9.295) 21.204 6.997 ( 1.270 -15.476 -4.629) 16.203 8.670 ( -4.031 -1.806 4.955) 6.638 8.786 ( 1.695 3.593 -7.168) 8.196 9.060 ( -9.871 4.094 20.621) 23.225 9.409 ( 6.885 5.228 -14.484) 16.867 9.745 ( -20.546 -4.740 21.850) 30.365 10.191 ( 21.847 -0.680 -23.112) 31.810 10.706 ( 10.417 13.735 0.717) 17.253 10.777 ( -11.044 10.395 -5.774) 16.229 12.327 ( -2.726 -3.689 9.539) 10.585 12.491 ( 0.521 -0.974 -6.583) 6.675 12.781 ( -1.049 7.777 5.451) 9.555 12.884 ( 2.371 1.975 -5.349) 6.176 17.533 ( 9.986 1.814 11.356) 15.231 17.785 ( -8.972 3.727 -13.254) 16.433 18.643 ( -0.754 -10.912 8.833) 14.059 18.809 ( 0.519 -6.822 -7.800) 10.375 20.830 ( 22.431 4.218 12.467) 26.007 21.070 ( -20.190 -2.435 -11.575) 23.399 23.051 ( 2.672 2.960 -0.648) 4.040 23.084 ( -3.895 2.199 -3.954) 5.970 ======================= Grid point 661 (339/361) ======================= q-point: (-0.20 -0.70 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.537 ( 3.156 5.204 -8.757) 10.664 2.668 ( 8.250 1.175 8.239) 11.718 2.998 ( -0.214 -8.227 4.903) 9.580 3.047 ( 3.287 -7.272 1.105) 8.056 3.571 ( -6.508 -0.528 5.252) 8.379 3.655 ( 0.072 3.066 -8.366) 8.910 4.063 ( -3.907 -0.588 -0.962) 4.066 4.324 ( 10.591 -1.274 1.774) 10.814 5.630 ( -7.871 1.425 -7.496) 10.962 5.748 ( -2.623 0.006 5.677) 6.254 5.863 ( -8.743 2.398 -0.313) 9.072 6.041 ( -1.611 6.850 3.351) 7.795 6.191 ( -2.454 -2.519 -3.453) 4.929 6.340 ( 7.403 3.399 -2.348) 8.478 7.013 ( -5.687 -20.438 2.153) 21.324 7.229 ( 9.150 -19.318 0.725) 21.387 8.623 ( -7.166 4.746 4.675) 9.784 8.810 ( 7.081 -2.369 -0.594) 7.490 9.096 ( -9.984 6.099 14.236) 18.427 9.305 ( 8.566 5.186 -11.693) 15.394 9.749 ( -19.232 -5.869 17.300) 26.525 10.212 ( 13.815 3.220 -14.169) 20.050 10.513 ( 0.317 7.383 -8.567) 11.314 10.840 ( 17.033 10.255 5.512) 20.632 12.367 ( -6.168 5.325 4.670) 9.392 12.424 ( -0.997 -1.780 -4.818) 5.232 12.673 ( -8.415 -2.204 3.369) 9.328 12.939 ( 10.686 6.536 -3.454) 12.994 17.460 ( -11.192 1.554 -11.814) 16.347 17.770 ( 7.872 4.173 11.118) 14.248 18.630 ( -11.655 -6.665 0.529) 13.436 19.002 ( 13.392 -9.453 0.143) 16.393 20.460 ( -32.718 -1.488 -12.068) 34.905 21.418 ( 31.862 3.060 9.694) 33.444 22.962 ( -4.198 3.053 -0.779) 5.250 23.129 ( 7.469 1.634 2.450) 8.029 ======================= Grid point 662 (340/361) ======================= q-point: (-0.10 0.30 -0.54) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.435 ( 6.753 8.222 -10.485) 14.938 2.867 ( 4.676 -0.498 9.723) 10.800 3.056 ( 0.063 -4.934 -7.582) 9.047 3.229 ( 3.772 -5.061 10.402) 12.168 3.538 ( -0.173 0.392 -0.692) 0.814 3.603 ( -2.975 -3.185 3.058) 5.325 4.033 ( 2.502 -0.843 -1.623) 3.099 4.492 ( 7.929 1.356 4.167) 9.059 5.388 ( -11.859 2.270 -6.926) 13.920 5.653 ( -13.734 -0.163 0.299) 13.738 5.780 ( -5.364 1.457 1.933) 5.885 5.932 ( -8.008 7.110 2.237) 10.940 6.135 ( 2.413 -1.685 -8.136) 8.652 6.402 ( 7.328 3.250 0.683) 8.046 7.144 ( -1.570 -19.348 -1.800) 19.495 7.513 ( 5.940 -19.437 -0.468) 20.329 8.525 ( -8.028 8.058 6.293) 12.999 8.922 ( 3.171 5.605 1.834) 6.696 9.065 ( 1.815 -1.881 0.748) 2.719 9.224 ( -1.828 9.150 -1.971) 9.536 9.755 ( -9.112 -8.122 10.253) 15.941 10.224 ( 3.610 5.212 4.343) 7.685 10.465 ( 17.054 -2.026 -19.329) 25.857 11.093 ( 18.529 7.346 7.313) 21.231 12.230 ( -6.458 6.929 0.343) 9.478 12.355 ( -0.725 0.551 -6.086) 6.154 12.673 ( -7.177 -5.537 5.411) 10.557 12.946 ( 5.542 9.569 -2.436) 11.323 17.194 ( -10.453 -0.703 -6.503) 12.330 17.954 ( 5.713 4.178 10.871) 12.972 18.524 ( -10.535 -6.130 -2.078) 12.364 19.203 ( 2.725 -1.909 2.320) 4.056 19.927 ( -20.274 -4.614 -16.458) 26.518 21.920 ( 24.437 1.602 12.418) 27.458 22.887 ( -2.508 1.210 -0.794) 2.896 23.282 ( 10.213 2.791 5.617) 11.985 ======================= Grid point 667 (341/361) ======================= q-point: ( 0.40 0.40 -0.54) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.747 ( -14.312 -0.000 8.018) 16.405 2.826 ( -8.844 -0.000 -4.801) 10.063 2.880 ( 2.717 0.000 2.294) 3.556 3.042 ( -8.820 -0.000 2.015) 9.048 3.308 ( 1.302 0.000 -0.312) 1.339 3.708 ( 7.745 0.000 0.159) 7.746 4.208 ( -1.848 -0.000 -3.567) 4.017 4.464 ( -11.376 -0.000 -4.788) 12.342 5.307 ( 7.167 0.000 7.683) 10.507 5.633 ( 10.000 0.000 -0.042) 10.000 5.735 ( 10.634 0.000 4.765) 11.652 5.937 ( -8.125 -0.000 5.002) 9.541 6.191 ( -3.382 -0.000 14.102) 14.502 6.388 ( -11.685 -0.000 10.728) 15.863 6.493 ( -5.156 -0.000 1.128) 5.278 6.847 ( 3.297 0.000 -8.602) 9.212 8.456 ( 0.321 0.000 3.886) 3.899 8.955 ( -13.418 -0.000 21.980) 25.752 9.402 ( -8.543 -0.000 -11.916) 14.661 9.470 ( 11.025 0.000 -8.208) 13.744 9.760 ( -15.813 -0.000 10.108) 18.767 10.170 ( 23.781 0.000 -32.070) 39.925 11.018 ( 7.934 0.000 -6.362) 10.170 11.299 ( -11.092 -0.000 0.048) 11.092 12.096 ( -3.312 -0.000 6.036) 6.885 12.475 ( 10.387 0.000 5.674) 11.836 12.524 ( 4.571 0.000 -5.029) 6.796 13.214 ( -9.657 -0.000 7.459) 12.202 17.087 ( 8.500 0.000 -2.985) 9.009 17.863 ( 3.165 0.000 20.277) 20.522 18.674 ( -15.244 -0.000 -10.090) 18.281 18.921 ( -2.832 -0.000 -4.952) 5.704 19.787 ( 37.332 0.000 0.314) 37.333 21.774 ( -23.962 -0.000 6.417) 24.806 23.276 ( -0.198 -0.000 -8.754) 8.756 23.423 ( -9.660 -0.000 -6.623) 11.712 ======================= Grid point 668 (342/361) ======================= q-point: ( 0.50 0.40 -0.54) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.591 ( -10.696 3.941 5.228) 12.541 2.743 ( -3.655 -0.545 1.451) 3.970 2.783 ( -10.467 -2.251 -0.165) 10.707 3.022 ( -4.527 -1.645 -3.136) 5.748 3.417 ( 9.203 -1.656 5.854) 11.032 3.836 ( 10.473 -1.124 -2.557) 10.839 4.117 ( -1.592 6.471 -4.175) 7.864 4.248 ( -12.673 -5.213 -5.074) 14.613 5.491 ( 6.447 0.062 7.284) 9.727 5.745 ( 6.390 -1.682 -1.815) 6.852 5.913 ( 6.084 2.406 5.029) 8.252 5.973 ( 2.447 -2.525 7.236) 8.045 6.254 ( -5.597 2.837 6.197) 8.819 6.340 ( -9.099 -1.437 5.732) 10.849 6.488 ( -3.810 -3.855 7.763) 9.468 6.809 ( 1.910 -4.433 -7.989) 9.334 8.535 ( 0.711 -2.057 6.174) 6.546 9.021 ( -12.276 1.001 17.162) 21.124 9.111 ( -5.491 4.420 -11.366) 13.375 9.502 ( 9.900 -0.678 -11.948) 15.532 9.699 ( -20.498 -1.142 20.341) 28.900 10.153 ( 24.227 -0.311 -28.171) 37.157 10.978 ( 4.258 8.837 -5.473) 11.233 11.144 ( -10.015 0.508 -2.350) 10.300 12.146 ( -2.963 -2.538 8.060) 8.954 12.487 ( 1.577 -2.427 -8.094) 8.596 12.716 ( 15.755 2.724 3.963) 16.472 13.116 ( -13.603 2.175 4.988) 14.651 17.264 ( 12.497 -0.344 7.011) 14.333 18.074 ( -0.355 0.120 3.698) 3.717 18.372 ( -11.011 -0.280 -0.194) 11.016 18.820 ( -3.752 -3.729 -8.177) 9.739 20.338 ( 39.711 1.278 3.272) 39.866 21.462 ( -29.619 -1.405 1.485) 29.690 23.161 ( -0.251 3.493 -6.118) 7.050 23.239 ( -6.759 -1.328 -6.291) 9.329 ======================= Grid point 669 (343/361) ======================= q-point: (-0.40 0.40 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.567 ( 1.239 3.118 6.593) 7.397 2.666 ( -1.561 0.440 -2.929) 3.348 2.797 ( 0.051 -3.130 5.658) 6.466 2.905 ( -4.882 -3.439 -5.675) 8.238 3.605 ( 0.718 1.817 10.202) 10.387 3.856 ( 1.099 3.085 -14.886) 15.242 4.006 ( -7.012 -3.672 8.679) 11.746 4.170 ( 7.449 -2.309 -7.903) 11.103 5.642 ( 2.174 -1.333 6.877) 7.334 5.763 ( -0.970 -2.115 -5.188) 5.685 6.014 ( 1.018 2.191 4.731) 5.312 6.071 ( 0.600 1.081 -0.910) 1.535 6.221 ( -1.581 1.300 7.832) 8.095 6.307 ( -2.764 -1.502 0.423) 3.174 6.621 ( -0.950 -8.305 9.391) 12.573 6.789 ( 2.326 -7.926 -8.286) 11.700 8.641 ( 0.091 -1.225 7.964) 8.059 8.837 ( -2.409 2.117 -11.735) 12.166 9.117 ( -11.479 2.293 21.266) 24.275 9.470 ( 8.739 1.995 -14.797) 17.301 9.677 ( -22.254 -2.805 23.119) 32.212 10.174 ( 23.935 -0.833 -26.184) 35.485 10.925 ( 7.579 10.055 -1.179) 12.646 10.946 ( -8.741 7.870 -2.739) 12.076 12.243 ( -3.084 -4.704 9.993) 11.467 12.430 ( 0.558 -4.209 -8.794) 9.765 12.911 ( -5.385 5.890 3.592) 8.752 12.948 ( 5.767 3.912 -0.053) 6.969 17.559 ( 12.075 1.089 12.981) 17.762 17.840 ( -11.564 2.332 -14.594) 18.765 18.483 ( 0.570 -6.780 12.359) 14.108 18.709 ( 0.012 -4.331 -10.348) 11.218 20.897 ( 26.166 3.262 6.575) 27.176 21.027 ( -22.231 -2.331 -6.474) 23.271 23.096 ( 0.369 2.027 -1.442) 2.515 23.113 ( -2.656 1.122 -3.321) 4.398 ======================= Grid point 670 (344/361) ======================= q-point: (-0.30 -0.60 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.628 ( 6.542 4.857 -7.185) 10.863 2.689 ( 6.342 1.193 6.812) 9.383 2.872 ( 1.649 -6.103 1.118) 6.420 2.949 ( 4.871 -3.688 5.826) 8.442 3.570 ( -12.467 -0.106 -0.940) 12.503 3.689 ( -4.334 0.999 -0.050) 4.448 4.056 ( 1.571 0.005 -0.096) 1.574 4.288 ( 12.892 -2.227 -1.361) 13.154 5.639 ( -7.366 -0.402 -7.199) 10.308 5.718 ( -5.147 -2.932 5.129) 7.836 5.915 ( -7.397 3.461 -0.838) 8.209 6.109 ( 1.978 -1.668 -1.598) 3.041 6.202 ( -5.069 6.049 2.877) 8.400 6.377 ( 9.045 -0.130 -1.874) 9.238 6.725 ( -4.881 -10.978 2.473) 12.267 6.925 ( 10.172 -15.044 -1.622) 18.232 8.685 ( -3.403 1.696 1.179) 3.981 8.770 ( 3.131 -0.847 2.518) 4.106 9.177 ( -11.059 2.667 18.310) 21.556 9.379 ( 8.631 3.526 -15.233) 17.860 9.664 ( -22.844 -3.836 22.358) 32.194 10.212 ( 22.615 -1.540 -24.124) 33.103 10.721 ( -5.979 13.653 -1.084) 14.945 11.007 ( 13.862 8.206 3.181) 16.420 12.346 ( -4.052 -5.109 3.214) 7.270 12.387 ( -0.921 -3.293 0.197) 3.425 12.687 ( -13.575 3.478 -0.525) 14.023 13.081 ( 13.468 8.080 -1.381) 15.767 17.480 ( -13.052 0.631 -13.585) 18.849 17.844 ( 8.824 3.972 12.858) 16.093 18.544 ( -5.832 -2.792 -1.692) 6.684 18.820 ( 12.784 -10.717 1.160) 16.722 20.442 ( -36.225 -0.555 -8.316) 37.171 21.457 ( 34.530 1.467 3.638) 34.753 23.024 ( -3.327 3.725 0.606) 5.031 23.148 ( 5.609 0.486 2.936) 6.349 ======================= Grid point 671 (345/361) ======================= q-point: (-0.20 -0.60 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.589 ( 9.748 8.704 -8.345) 15.506 2.846 ( 1.088 -1.717 8.885) 9.115 2.980 ( 3.949 -3.571 -2.629) 5.937 3.147 ( 8.342 -4.003 7.821) 12.115 3.434 ( -6.808 -6.942 -0.600) 9.742 3.643 ( -3.905 2.156 4.007) 5.996 4.050 ( 5.045 3.028 -5.241) 7.880 4.481 ( 8.838 -1.939 4.397) 10.060 5.424 ( -10.404 1.541 -6.611) 12.423 5.633 ( -14.303 -1.714 0.549) 14.416 5.804 ( -5.486 1.349 -0.573) 5.678 6.075 ( -4.981 4.784 -0.868) 6.961 6.105 ( 1.105 2.126 -4.105) 4.753 6.461 ( 9.633 3.046 -2.736) 10.467 6.825 ( -1.165 -16.222 0.991) 16.294 7.185 ( 8.554 -17.448 -2.325) 19.571 8.640 ( -5.080 2.692 4.167) 7.101 8.888 ( 5.770 -1.987 4.669) 7.684 9.140 ( -4.275 6.870 1.354) 8.204 9.342 ( 1.730 2.956 -1.732) 3.838 9.641 ( -20.148 -4.703 20.477) 29.109 10.264 ( 19.791 -1.700 -19.143) 27.587 10.546 ( -0.411 12.065 -1.077) 12.120 11.213 ( 16.680 5.790 4.894) 18.321 12.293 ( -4.138 -2.516 -4.671) 6.729 12.375 ( -6.728 4.579 2.103) 8.406 12.571 ( -5.557 -5.606 3.496) 8.633 13.132 ( 9.476 10.548 -2.945) 14.482 17.178 ( -11.612 -1.110 -8.037) 14.166 18.034 ( 5.692 4.487 9.715) 12.121 18.449 ( -4.945 -1.711 -5.222) 7.393 19.113 ( 10.764 -8.384 3.108) 13.993 19.865 ( -31.362 -2.325 -10.087) 33.026 21.925 ( 28.325 -0.847 2.752) 28.471 22.954 ( -3.526 5.956 2.162) 7.251 23.311 ( 9.434 0.434 7.325) 11.952 ======================= Grid point 672 (346/361) ======================= q-point: (-0.10 -0.60 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.536 ( 9.426 12.316 -8.499) 17.685 2.855 ( -6.669 -4.456 -2.975) 8.555 3.050 ( 1.062 1.018 7.484) 7.627 3.344 ( -0.523 -3.917 4.045) 5.654 3.509 ( 2.598 -12.476 4.894) 13.651 3.643 ( 3.710 7.438 1.625) 8.469 4.069 ( 9.778 -1.531 -4.651) 10.935 4.644 ( 3.801 0.209 6.272) 7.337 5.200 ( -9.825 4.072 -2.702) 10.973 5.432 ( -14.273 -1.943 -1.509) 14.483 5.666 ( -10.769 0.445 -3.115) 11.220 5.911 ( -6.612 9.358 -0.667) 11.477 6.124 ( 7.682 -1.380 -2.890) 8.322 6.533 ( 6.521 2.704 0.009) 7.059 6.955 ( 1.656 -15.531 -5.329) 16.504 7.406 ( 4.391 -18.242 -0.689) 18.776 8.565 ( -9.258 8.662 6.376) 14.191 8.998 ( 4.538 4.214 -4.872) 7.879 9.108 ( 4.675 -3.093 3.672) 6.701 9.227 ( -10.034 8.127 3.963) 13.507 9.728 ( -7.339 -7.557 16.191) 19.316 10.345 ( 14.355 -1.391 -9.774) 17.422 10.470 ( 6.447 3.760 -8.278) 11.146 11.436 ( 13.894 4.566 3.240) 14.979 12.187 ( -4.263 1.401 -1.894) 4.871 12.280 ( -1.577 1.517 -3.835) 4.415 12.593 ( -5.882 -4.530 4.355) 8.607 13.096 ( 4.983 12.475 -2.376) 13.642 17.014 ( -7.977 -1.838 0.966) 8.243 18.176 ( 4.919 2.419 8.006) 9.703 18.298 ( -6.729 -2.091 -10.072) 12.292 19.157 ( -15.770 3.487 0.357) 16.155 19.567 ( 0.026 -9.645 -5.935) 11.325 22.315 ( 20.249 -3.364 3.165) 20.769 22.867 ( -4.232 5.506 1.105) 7.032 23.547 ( 11.342 2.328 9.316) 14.861 ======================= Grid point 678 (347/361) ======================= q-point: (-0.50 -0.50 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.599 ( 1.028 0.000 5.217) 5.317 2.667 ( -1.631 -0.000 -1.285) 2.076 2.770 ( 1.752 0.000 5.161) 5.450 2.876 ( -6.228 -0.000 -5.712) 8.450 3.623 ( 3.103 0.000 11.171) 11.594 3.884 ( -4.357 -0.000 -14.868) 15.493 3.971 ( -6.868 -0.000 9.127) 11.423 4.148 ( 10.153 0.000 -8.418) 13.189 5.627 ( 1.391 0.000 6.229) 6.383 5.740 ( -0.392 -0.000 -4.792) 4.808 6.040 ( -0.974 -0.000 4.073) 4.187 6.078 ( 4.864 0.000 1.205) 5.011 6.231 ( -6.576 -0.000 6.685) 9.377 6.285 ( -1.974 -0.000 2.868) 3.482 6.555 ( 0.628 0.000 8.367) 8.391 6.722 ( 2.981 0.000 -9.747) 10.193 8.630 ( 1.451 0.000 9.056) 9.171 8.856 ( -3.886 -0.000 -13.357) 13.911 9.137 ( -12.203 -0.000 21.052) 24.333 9.486 ( 9.928 0.000 -14.552) 17.616 9.652 ( -22.963 -0.000 23.572) 32.908 10.167 ( 24.409 0.000 -27.040) 36.427 11.015 ( -6.515 -0.000 -0.936) 6.582 11.025 ( 5.341 0.000 -2.869) 6.063 12.196 ( -3.229 -0.000 10.098) 10.602 12.387 ( 0.773 0.000 -9.232) 9.264 12.964 ( -16.747 -0.000 3.358) 17.080 12.987 ( 16.565 0.000 1.263) 16.613 17.569 ( 13.239 0.000 13.528) 18.928 17.861 ( -13.343 -0.000 -15.277) 20.283 18.422 ( 1.138 0.000 13.814) 13.860 18.669 ( 0.111 0.000 -11.139) 11.139 20.932 ( 39.331 0.000 3.163) 39.458 21.000 ( -34.669 -0.000 -3.574) 34.853 23.116 ( -3.300 -0.000 -1.950) 3.833 23.122 ( 0.584 0.000 -2.748) 2.809 ======================= Grid point 679 (348/361) ======================= q-point: (-0.40 -0.50 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.696 ( 10.074 2.093 -4.517) 11.237 2.713 ( 5.285 2.252 3.651) 6.807 2.782 ( 0.710 -4.199 -0.173) 4.262 2.913 ( 6.475 -0.800 7.498) 9.939 3.559 ( -18.202 -0.722 -6.301) 19.275 3.702 ( -7.064 0.520 7.460) 10.287 4.060 ( 5.359 0.291 1.595) 5.598 4.260 ( 15.847 -0.847 -4.908) 16.611 5.626 ( -6.445 -0.649 -6.655) 9.287 5.670 ( -5.938 -1.826 5.043) 8.001 5.981 ( -6.615 4.073 -0.970) 7.828 6.054 ( -3.929 -3.955 -1.763) 5.847 6.310 ( 1.190 4.399 2.457) 5.178 6.338 ( 5.798 -2.381 4.200) 7.545 6.641 ( 1.559 0.011 -4.515) 4.776 6.717 ( 7.577 -8.119 -0.714) 11.128 8.685 ( -1.855 -0.543 -8.904) 9.111 8.782 ( 2.066 1.031 12.901) 13.106 9.198 ( -12.481 0.261 18.808) 22.574 9.426 ( 9.034 1.615 -16.706) 19.061 9.617 ( -24.555 -1.498 25.286) 35.278 10.189 ( 23.842 -0.759 -26.618) 35.743 10.917 ( -4.458 7.065 1.320) 8.458 11.103 ( 9.980 2.441 1.098) 10.333 12.282 ( -3.143 -1.384 5.673) 6.632 12.312 ( 0.049 -3.785 -2.256) 4.406 12.745 ( -16.470 2.136 0.828) 16.628 13.185 ( 14.372 3.273 -1.689) 14.836 17.485 ( -14.288 0.054 -14.603) 20.430 17.897 ( 9.633 1.743 14.612) 17.588 18.541 ( 1.927 2.399 -6.048) 6.786 18.652 ( 7.576 -7.696 4.324) 11.633 20.437 ( -37.443 -0.118 -6.860) 38.066 21.472 ( 35.544 0.356 0.445) 35.549 23.080 ( -1.506 2.179 2.048) 3.348 23.146 ( 3.631 -0.477 2.717) 4.560 ======================= Grid point 680 (349/361) ======================= q-point: (-0.30 -0.50 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.711 ( 5.152 4.358 -0.910) 6.809 2.828 ( 6.762 0.608 0.795) 6.836 2.929 ( 5.290 -2.602 1.438) 6.068 3.091 ( 9.091 -2.422 3.028) 9.884 3.332 ( -8.324 -4.259 -0.574) 9.368 3.657 ( -7.340 -0.052 5.125) 8.952 4.121 ( 6.844 4.103 -2.680) 8.418 4.445 ( 11.211 -1.795 1.631) 11.470 5.437 ( -9.166 0.120 -6.417) 11.190 5.603 ( -12.871 -1.461 2.589) 13.210 5.829 ( -7.521 1.513 -3.256) 8.334 6.037 ( 2.075 -3.124 -3.440) 5.089 6.255 ( -2.833 8.642 -0.220) 9.097 6.481 ( 8.926 -2.109 -1.220) 9.253 6.622 ( 0.197 -5.264 -1.999) 5.634 6.920 ( 9.683 -12.278 -3.354) 15.992 8.603 ( -1.205 -3.969 -5.057) 6.541 8.947 ( 0.882 5.980 15.635) 16.763 9.227 ( -8.835 2.122 10.703) 14.040 9.352 ( 7.957 -0.166 -11.505) 13.990 9.586 ( -25.417 -1.884 26.316) 36.635 10.220 ( 22.760 -2.323 -25.271) 34.088 10.790 ( -4.491 13.174 2.859) 14.210 11.277 ( 13.478 1.276 2.796) 13.824 12.233 ( -2.033 -2.788 -4.727) 5.853 12.407 ( -4.271 -2.493 9.022) 10.289 12.525 ( -10.309 1.277 -1.471) 10.491 13.284 ( 11.108 6.266 -4.319) 13.465 17.160 ( -12.287 -0.874 -8.961) 15.233 18.090 ( 3.136 1.641 4.878) 6.027 18.485 ( 4.928 5.704 -4.600) 8.831 18.930 ( 10.794 -11.504 5.331) 16.652 19.842 ( -36.443 -0.522 -6.699) 37.058 21.903 ( 29.092 -1.239 -3.461) 29.323 23.067 ( -1.481 6.122 4.811) 7.926 23.300 ( 8.289 -1.452 7.704) 11.409 ======================= Grid point 681 (350/361) ======================= q-point: (-0.20 -0.50 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.726 ( 2.366 7.693 -3.379) 8.730 2.782 ( -7.388 -2.962 0.734) 7.993 3.042 ( 5.743 -2.671 2.986) 7.002 3.282 ( -2.036 -1.418 0.134) 2.485 3.339 ( 7.329 -6.553 2.626) 10.176 3.705 ( 5.721 -0.632 6.066) 8.362 4.121 ( 8.819 6.780 -6.695) 12.983 4.620 ( 4.136 -2.514 6.291) 7.937 5.254 ( -6.398 1.683 -3.962) 7.711 5.413 ( -15.466 0.390 -0.581) 15.482 5.664 ( -10.013 -0.734 -4.757) 11.110 6.080 ( -1.367 3.945 -5.997) 7.307 6.115 ( 5.301 5.671 1.837) 7.977 6.573 ( 8.357 1.644 -3.493) 9.206 6.710 ( 2.513 -12.032 -1.458) 12.378 7.101 ( 5.653 -15.790 -3.302) 17.093 8.597 ( -2.764 -5.305 0.384) 5.994 9.041 ( 0.651 6.288 5.995) 8.712 9.152 ( 0.604 5.409 -2.740) 6.093 9.349 ( -9.057 3.589 8.478) 12.915 9.621 ( -14.622 -4.853 24.667) 29.083 10.273 ( 21.653 -4.591 -23.077) 31.976 10.642 ( -4.773 12.839 2.745) 13.970 11.484 ( 12.546 0.495 1.717) 12.672 12.171 ( -3.598 -1.782 -2.724) 4.852 12.332 ( -4.245 3.568 -1.764) 5.819 12.507 ( -4.528 -5.025 4.132) 7.926 13.286 ( 7.757 8.640 -6.048) 13.091 16.984 ( -7.422 -1.468 1.107) 7.646 18.092 ( 0.977 -6.480 -11.299) 13.062 18.445 ( 1.692 13.526 3.161) 13.993 19.181 ( -3.439 -2.388 1.753) 4.539 19.385 ( -15.374 -9.316 -0.862) 17.997 22.228 ( 22.432 -5.158 -5.593) 23.687 23.025 ( -3.363 10.582 5.468) 12.377 23.555 ( 11.126 -1.245 9.411) 14.626 ======================= Grid point 682 (351/361) ======================= q-point: (-0.10 -0.50 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.563 ( -8.558 2.544 -2.913) 9.392 2.775 ( -1.713 -0.447 0.895) 1.984 3.140 ( -1.251 5.465 3.115) 6.413 3.222 ( 0.146 -9.538 -2.890) 9.967 3.545 ( 4.132 -8.171 3.930) 9.964 3.836 ( 6.881 12.561 1.809) 14.436 4.174 ( 14.781 -2.394 -3.591) 15.398 4.720 ( -2.765 -0.755 5.121) 5.868 5.127 ( -10.704 5.090 4.175) 12.566 5.247 ( -2.717 -3.236 -3.155) 5.273 5.461 ( -9.815 -0.413 -5.532) 11.274 5.876 ( -4.968 8.453 -5.666) 11.324 6.263 ( 9.295 2.732 5.827) 11.305 6.613 ( 3.310 1.236 -1.514) 3.844 6.785 ( 3.483 -9.596 -10.583) 14.704 7.332 ( 5.690 -18.175 4.759) 19.630 8.530 ( -12.548 5.823 2.226) 14.011 9.023 ( 9.177 -1.622 -9.141) 13.054 9.155 ( -2.797 -3.302 1.771) 4.676 9.256 ( -11.793 11.832 16.138) 23.227 9.793 ( -6.555 -4.225 19.925) 21.397 10.350 ( 20.519 -6.405 -23.009) 31.488 10.509 ( -4.937 8.093 2.413) 9.782 11.620 ( 6.599 1.362 -0.294) 6.745 12.113 ( -3.030 -0.828 -0.782) 3.237 12.242 ( -0.472 2.663 -4.979) 5.666 12.536 ( -3.920 -5.471 4.735) 8.229 13.218 ( 5.222 9.763 -6.415) 12.796 17.000 ( -1.520 0.173 9.791) 9.910 17.975 ( -2.639 -10.173 -19.466) 22.122 18.384 ( 0.028 12.225 5.963) 13.602 18.947 ( -13.923 2.236 0.440) 14.109 19.533 ( 5.045 -9.233 2.012) 10.712 22.498 ( 17.002 -8.977 -4.974) 19.859 22.906 ( -6.806 13.446 4.283) 15.667 23.806 ( 9.015 -0.236 7.131) 11.497 ======================= Grid point 689 (352/361) ======================= q-point: (-0.40 -0.40 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.741 ( -0.815 -0.000 4.528) 4.601 2.860 ( 16.450 0.000 -3.820) 16.888 2.889 ( 2.384 0.000 1.489) 2.811 3.068 ( 7.321 0.000 0.265) 7.326 3.295 ( -6.757 -0.000 0.817) 6.806 3.655 ( -8.589 -0.000 4.348) 9.627 4.162 ( 6.614 0.000 0.622) 6.643 4.428 ( 12.833 0.000 -0.970) 12.870 5.437 ( -8.729 -0.000 -6.362) 10.802 5.590 ( -11.656 -0.000 3.966) 12.313 5.847 ( -9.606 -0.000 -5.162) 10.905 6.002 ( 3.219 0.000 -1.543) 3.570 6.353 ( 0.656 0.000 -2.745) 2.822 6.430 ( 0.538 0.000 6.191) 6.214 6.602 ( 6.511 0.000 -9.396) 11.432 6.796 ( 9.519 0.000 -2.564) 9.858 8.563 ( -1.480 -0.000 -6.961) 7.116 9.014 ( 1.792 0.000 19.565) 19.647 9.228 ( -12.236 -0.000 16.187) 20.291 9.358 ( 10.305 0.000 -18.564) 21.233 9.570 ( -26.485 -0.000 28.186) 38.676 10.198 ( 22.935 0.000 -26.321) 34.911 10.925 ( -5.292 -0.000 3.787) 6.507 11.276 ( 11.745 0.000 1.636) 11.858 12.210 ( -0.124 -0.000 -5.888) 5.890 12.369 ( -3.377 -0.000 10.698) 11.218 12.546 ( -12.569 -0.000 -1.206) 12.626 13.340 ( 11.511 0.000 -4.969) 12.538 17.151 ( -12.460 -0.000 -9.247) 15.516 18.101 ( 1.593 0.000 1.325) 2.072 18.580 ( 14.875 0.000 -5.082) 15.719 18.785 ( 4.361 0.000 8.776) 9.800 19.839 ( -37.511 -0.000 -5.775) 37.953 21.891 ( 29.035 0.000 -5.361) 29.526 23.132 ( -0.227 -0.000 5.847) 5.851 23.279 ( 7.729 0.000 7.537) 10.796 ======================= Grid point 690 (353/361) ======================= q-point: (-0.30 -0.40 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.728 ( -17.367 -1.317 -0.505) 17.424 2.816 ( -1.417 1.182 9.203) 9.386 2.989 ( 8.264 -1.571 -7.168) 11.052 3.244 ( 13.309 -2.622 1.190) 13.617 3.332 ( 4.864 3.218 -1.334) 5.982 3.662 ( 5.144 -2.710 4.417) 7.302 4.240 ( 7.670 4.811 -1.305) 9.148 4.573 ( 4.672 -2.160 3.361) 6.147 5.264 ( -5.455 -0.020 -5.322) 7.621 5.439 ( -14.821 1.619 2.419) 15.104 5.645 ( -9.655 -1.016 -6.827) 11.869 6.070 ( 6.285 -0.734 -2.474) 6.794 6.280 ( 2.625 7.836 -2.629) 8.672 6.532 ( 2.252 -6.078 3.840) 7.534 6.605 ( 6.358 0.274 -5.610) 8.483 6.885 ( 6.715 -7.635 -7.167) 12.440 8.496 ( -1.486 -3.791 -3.483) 5.358 9.175 ( -4.388 6.558 9.636) 12.454 9.225 ( -4.792 1.881 1.810) 5.457 9.361 ( 6.047 -1.223 3.944) 7.322 9.561 ( -24.569 -1.851 31.508) 39.997 10.215 ( 21.717 -1.790 -24.547) 32.823 10.837 ( -8.420 7.258 3.436) 11.635 11.462 ( 11.410 -1.899 0.590) 11.582 12.154 ( -0.756 -0.137 -3.075) 3.170 12.379 ( -6.396 1.409 -0.595) 6.576 12.434 ( -4.328 -2.584 3.619) 6.205 13.388 ( 8.782 2.956 -8.271) 12.421 16.966 ( -6.980 -0.552 1.277) 7.117 18.010 ( 0.476 -2.527 -17.389) 17.579 18.708 ( 7.856 15.409 6.042) 18.321 19.016 ( 8.081 -14.008 5.366) 17.039 19.312 ( -31.608 -0.647 -1.285) 31.641 22.162 ( 22.105 -1.996 -8.684) 23.833 23.182 ( -0.984 5.816 7.483) 9.529 23.518 ( 10.903 -2.085 8.215) 13.810 ======================= Grid point 691 (354/361) ======================= q-point: (-0.20 -0.40 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 652 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.535 ( -15.518 -3.844 3.099) 16.285 2.766 ( -16.180 -0.757 2.060) 16.328 3.059 ( 6.420 -6.548 -0.475) 9.183 3.294 ( 8.229 9.280 -7.340) 14.412 3.444 ( 7.291 -3.659 1.733) 8.339 3.932 ( 16.514 -1.636 6.863) 17.958 4.244 ( 8.337 9.677 -5.217) 13.797 4.669 ( -2.940 -4.703 5.603) 7.883 5.184 ( 0.997 -1.289 -4.364) 4.658 5.226 ( -14.919 3.653 1.633) 15.446 5.446 ( -9.302 -1.290 -5.639) 10.954 5.991 ( -2.773 3.859 -9.300) 10.444 6.367 ( 12.096 9.213 8.380) 17.361 6.623 ( 3.539 -0.550 -4.303) 5.599 6.651 ( 8.192 -5.046 -7.225) 12.032 7.019 ( 4.817 -16.643 3.107) 17.603 8.495 ( -5.040 -6.773 0.634) 8.466 9.058 ( -0.243 5.856 -9.319) 11.009 9.156 ( -7.321 0.773 2.856) 7.896 9.443 ( -12.135 9.483 21.966) 26.827 9.714 ( -7.971 -5.430 24.227) 26.076 10.260 ( 20.435 -3.553 -21.730) 30.040 10.672 ( -9.142 8.936 2.107) 12.956 11.607 ( 6.780 -2.131 -1.404) 7.245 12.116 ( -1.362 1.036 -0.351) 1.747 12.282 ( -1.049 1.759 -5.725) 6.080 12.431 ( -5.894 -5.673 3.796) 9.018 13.345 ( 6.831 4.762 -11.194) 13.951 17.006 ( 0.905 0.455 11.588) 11.632 17.806 ( -0.358 -7.557 -23.412) 24.604 18.663 ( -2.145 17.991 6.388) 19.211 18.977 ( -14.983 1.112 0.474) 15.032 19.319 ( 5.840 -14.836 5.049) 16.724 22.363 ( 17.814 -5.559 -8.743) 20.608 23.153 ( -3.916 12.791 6.491) 14.869 23.764 ( 8.704 -3.956 4.736) 10.670 ======================= Grid point 692 (355/361) ======================= q-point: (-0.10 -0.40 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.410 ( -12.420 -2.304 1.980) 12.786 2.583 ( -20.953 -10.255 7.892) 24.627 3.216 ( 5.030 -5.509 2.131) 7.758 3.266 ( 15.463 9.045 -9.656) 20.351 3.542 ( 0.601 -4.347 -0.113) 4.389 4.050 ( 1.738 17.389 0.689) 17.489 4.325 ( 10.183 -1.935 0.272) 10.369 4.695 ( -1.717 -1.440 0.081) 2.242 5.045 ( -10.426 0.543 4.108) 11.219 5.178 ( -0.150 -5.023 -2.996) 5.851 5.353 ( 1.419 -0.469 -0.298) 1.524 5.805 ( -1.886 5.813 -7.717) 9.843 6.537 ( 8.448 9.140 6.001) 13.817 6.581 ( 0.091 -0.667 -6.373) 6.408 6.688 ( 3.468 -1.736 -3.454) 5.193 7.367 ( 8.568 -16.625 10.267) 21.335 8.400 ( -13.780 2.716 1.820) 14.163 8.988 ( 8.323 -8.411 -10.565) 15.863 9.078 ( -7.906 -0.889 1.589) 8.113 9.398 ( -14.002 13.108 18.301) 26.510 9.916 ( -6.122 -2.890 19.281) 20.435 10.304 ( 15.615 -1.451 -19.979) 25.398 10.508 ( -6.224 4.679 0.971) 7.847 11.644 ( -0.034 -1.582 -2.528) 2.982 12.089 ( -2.540 1.469 2.023) 3.564 12.183 ( -0.740 0.777 -5.448) 5.553 12.497 ( -1.701 -7.821 5.303) 9.601 13.246 ( 6.073 4.820 -12.990) 15.128 17.179 ( 4.978 4.346 9.039) 11.197 17.655 ( 2.070 -10.523 -13.310) 17.093 18.540 ( -2.538 14.519 3.479) 15.145 18.850 ( -3.111 0.578 -0.080) 3.165 19.529 ( 1.247 -9.690 3.381) 10.339 22.555 ( 14.569 -8.935 -7.711) 18.750 22.994 ( -8.602 17.949 4.454) 20.396 23.909 ( 2.162 -4.910 -0.305) 5.373 ======================= Grid point 700 (356/361) ======================= q-point: (-0.30 -0.30 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.492 ( -17.935 -0.000 5.545) 18.772 2.757 ( -20.493 -0.000 0.117) 20.493 3.002 ( 8.056 0.000 0.145) 8.057 3.389 ( 7.655 0.000 -8.035) 11.098 3.417 ( 11.476 0.000 -0.568) 11.490 3.895 ( 19.942 0.000 5.938) 20.807 4.367 ( 8.325 0.000 -0.850) 8.369 4.601 ( -4.712 -0.000 4.000) 6.181 5.165 ( -0.106 -0.000 -6.252) 6.253 5.273 ( -15.144 -0.000 2.761) 15.394 5.428 ( -8.110 -0.000 -6.267) 10.249 6.020 ( -1.242 -0.000 -9.434) 9.516 6.512 ( 20.687 0.000 4.512) 21.173 6.571 ( 2.910 0.000 1.511) 3.279 6.633 ( 5.667 0.000 -4.191) 7.049 6.830 ( 1.209 0.000 -2.384) 2.673 8.421 ( -3.848 -0.000 -0.456) 3.875 9.136 ( 2.150 0.000 -12.098) 12.288 9.150 ( -14.160 -0.000 6.446) 15.559 9.592 ( 4.922 0.000 13.984) 14.825 9.599 ( -24.896 -0.000 35.553) 43.403 10.229 ( 20.430 0.000 -20.650) 29.048 10.761 ( -11.214 -0.000 2.137) 11.416 11.582 ( 7.695 0.000 -1.548) 7.849 12.131 ( 0.355 0.000 -0.880) 0.949 12.297 ( -1.952 -0.000 -6.483) 6.771 12.374 ( -7.290 -0.000 3.941) 8.287 13.386 ( 7.287 0.000 -12.902) 14.818 17.011 ( 1.962 0.000 12.660) 12.811 17.737 ( -0.121 -0.000 -25.434) 25.435 18.925 ( -21.142 -0.000 8.118) 22.647 18.987 ( 0.649 0.000 0.989) 1.183 19.086 ( 8.843 0.000 4.262) 9.816 22.314 ( 17.813 0.000 -9.595) 20.233 23.284 ( -2.370 -0.000 8.183) 8.519 23.713 ( 8.502 0.000 2.468) 8.853 ======================= Grid point 701 (357/361) ======================= q-point: (-0.20 -0.30 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.376 ( -15.192 -0.959 7.824) 17.115 2.435 ( -23.799 -5.327 3.142) 24.590 3.140 ( 7.885 -2.448 1.394) 8.373 3.376 ( 10.739 2.667 -12.312) 16.554 3.522 ( 4.896 0.985 -0.407) 5.011 4.240 ( 10.672 0.978 9.787) 14.513 4.384 ( 6.933 11.596 -5.341) 14.528 4.605 ( -1.583 -8.295 -0.023) 8.445 5.066 ( -5.540 -0.028 -5.278) 7.652 5.108 ( -8.886 -1.050 1.682) 9.105 5.341 ( 0.637 -0.694 0.054) 0.944 5.879 ( -0.312 2.229 -9.700) 9.957 6.570 ( 4.770 -0.150 -12.113) 13.019 6.644 ( 5.853 -0.157 -6.718) 8.911 6.772 ( 7.602 14.103 14.679) 21.730 7.061 ( 11.582 -17.542 12.145) 24.277 8.364 ( -9.750 -3.591 2.902) 10.788 8.972 ( -3.251 3.999 -7.912) 9.442 9.043 ( -7.372 -3.177 -2.395) 8.377 9.611 ( -17.750 10.566 25.980) 33.191 9.815 ( -3.360 -7.772 13.742) 16.141 10.299 ( 17.998 0.311 -13.620) 22.572 10.597 ( -12.391 3.705 1.136) 12.983 11.618 ( 0.640 -0.766 -3.070) 3.228 12.124 ( -1.652 2.379 0.507) 2.940 12.173 ( -2.825 -2.043 -5.476) 6.492 12.382 ( -1.734 -3.906 4.618) 6.292 13.300 ( 7.133 1.458 -17.017) 18.509 17.264 ( 9.144 4.618 13.417) 16.881 17.485 ( 1.892 -7.354 -18.312) 19.824 18.762 ( -7.840 5.788 5.723) 11.301 18.908 ( -1.707 8.054 -3.286) 8.864 19.326 ( 3.108 -11.308 6.449) 13.384 22.447 ( 15.451 -3.170 -9.055) 18.187 23.272 ( -5.470 11.223 6.066) 13.881 23.796 ( 0.980 -6.160 -4.028) 7.425 ======================= Grid point 702 (358/361) ======================= q-point: (-0.10 -0.30 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.165 ( -19.383 -6.846 5.674) 21.325 2.447 ( -9.327 -6.070 16.330) 19.761 3.273 ( 5.827 -1.707 -0.391) 6.085 3.369 ( 10.218 -2.551 -12.275) 16.174 3.536 ( 2.288 3.620 -0.873) 4.371 4.181 ( -3.555 16.156 -1.804) 16.640 4.336 ( -9.692 4.072 0.832) 10.545 4.678 ( 4.504 -6.736 -5.509) 9.798 4.970 ( -2.727 -0.692 2.279) 3.621 5.193 ( 12.377 -6.141 2.114) 13.977 5.410 ( 3.650 -0.690 3.959) 5.429 5.777 ( 3.464 3.850 -5.730) 7.724 6.433 ( -2.089 1.523 -13.209) 13.460 6.627 ( 1.766 -0.355 -5.737) 6.013 6.919 ( 2.996 12.732 17.321) 21.705 7.507 ( 9.626 -10.196 11.840) 18.353 8.277 ( -10.692 -1.217 5.935) 12.290 8.871 ( 1.360 -6.628 -8.485) 10.853 8.952 ( -5.806 -5.180 -2.428) 8.151 9.520 ( -14.521 14.695 15.688) 25.941 9.960 ( -5.375 -8.409 9.496) 13.776 10.299 ( -2.553 8.206 -4.886) 9.886 10.464 ( 2.103 -1.066 -3.474) 4.199 11.551 ( -5.884 -1.858 -3.334) 7.013 12.075 ( -3.770 -1.077 2.734) 4.781 12.151 ( 0.681 0.373 -0.791) 1.109 12.479 ( -0.104 -6.704 4.853) 8.277 13.183 ( 8.399 1.352 -18.222) 20.110 17.227 ( 3.235 1.958 -12.895) 13.438 17.727 ( 15.326 -4.567 12.333) 20.195 18.644 ( -4.000 15.155 -1.447) 15.741 18.857 ( 6.285 -2.118 -0.241) 6.637 19.481 ( -3.621 -8.424 5.656) 10.773 22.575 ( 11.897 -5.885 -9.388) 16.257 23.072 ( -10.190 19.435 2.721) 22.112 23.761 ( -6.820 -10.538 -7.290) 14.516 ======================= Grid point 711 (359/361) ======================= q-point: (-0.20 -0.20 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 361 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.104 ( -20.806 -0.000 5.517) 21.525 2.387 ( -9.078 -0.000 17.617) 19.818 3.249 ( 8.938 0.000 -0.653) 8.962 3.352 ( 5.301 0.000 -12.379) 13.466 3.574 ( 4.372 0.000 -2.728) 5.153 4.326 ( -16.337 -0.000 10.979) 19.683 4.474 ( 4.332 0.000 -13.648) 14.319 4.508 ( 3.226 0.000 -3.551) 4.797 4.997 ( -6.311 -0.000 2.905) 6.947 5.112 ( 17.556 0.000 -0.568) 17.565 5.402 ( 2.683 0.000 5.778) 6.371 5.815 ( 4.019 0.000 -6.999) 8.071 6.448 ( -0.473 -0.000 -14.172) 14.180 6.622 ( 2.066 0.000 -6.197) 6.532 7.085 ( -0.828 -0.000 19.310) 19.328 7.360 ( 19.654 0.000 12.162) 23.112 8.250 ( -12.443 -0.000 7.356) 14.455 8.863 ( -8.843 -0.000 -1.648) 8.995 8.872 ( -0.471 -0.000 -10.913) 10.923 9.729 ( -23.808 -0.000 31.852) 39.767 9.802 ( 3.792 0.000 -6.086) 7.171 10.416 ( 14.147 0.000 -7.384) 15.958 10.425 ( -17.447 -0.000 2.678) 17.651 11.537 ( -6.325 -0.000 -3.527) 7.242 12.056 ( -4.058 -0.000 1.070) 4.196 12.157 ( 0.158 0.000 0.060) 0.169 12.413 ( 0.912 0.000 4.496) 4.588 13.195 ( 9.293 0.000 -20.221) 22.254 17.247 ( 3.425 0.000 -16.046) 16.407 17.683 ( 16.748 0.000 15.039) 22.510 18.814 ( 5.383 0.000 3.906) 6.651 18.834 ( -4.663 -0.000 -8.348) 9.562 19.378 ( -2.794 -0.000 9.529) 9.930 22.521 ( 12.925 0.000 -9.901) 16.281 23.312 ( -7.320 -0.000 5.076) 8.908 23.604 ( -9.397 -0.000 -11.221) 14.637 ======================= Grid point 712 (360/361) ======================= q-point: (-0.10 -0.20 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 650 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.005 ( -11.119 -3.573 11.718) 16.544 2.540 ( -3.828 -2.766 20.849) 21.377 3.231 ( -3.092 0.182 -10.178) 10.638 3.375 ( 9.657 -2.653 -2.189) 10.251 3.577 ( 4.572 1.334 -6.680) 8.204 4.157 ( -12.781 5.577 0.860) 13.971 4.268 ( -3.261 11.060 -7.065) 13.523 4.526 ( -3.398 -10.493 -5.223) 12.203 5.027 ( 4.395 0.162 5.060) 6.704 5.412 ( 19.218 -2.837 -1.562) 19.489 5.551 ( 6.387 -0.092 10.833) 12.576 5.828 ( 8.158 1.600 -4.072) 9.257 6.236 ( -7.880 1.150 -10.013) 12.794 6.554 ( -1.129 -0.275 -6.695) 6.795 7.248 ( 0.202 9.371 16.619) 19.080 7.720 ( 8.797 0.745 9.941) 13.295 8.230 ( -7.823 -5.274 12.501) 15.661 8.739 ( -2.143 -2.530 -5.423) 6.357 8.786 ( -3.407 -6.619 -5.199) 9.080 9.621 ( -8.799 15.638 5.991) 18.918 9.870 ( -6.652 -12.271 6.210) 15.277 10.199 ( -20.811 3.953 8.834) 22.952 10.486 ( 10.009 0.378 -10.091) 14.218 11.371 ( -12.167 -1.428 -3.887) 12.852 12.074 ( -1.753 -1.735 6.277) 6.744 12.145 ( 0.719 -0.546 -2.185) 2.364 12.501 ( 0.772 -2.918 5.648) 6.404 13.108 ( 11.376 0.425 -18.431) 21.663 17.165 ( 6.138 0.658 -9.058) 10.962 18.051 ( 15.634 -1.510 4.952) 16.469 18.633 ( -3.074 8.009 -6.508) 10.768 19.022 ( 17.522 -1.761 2.077) 17.732 19.439 ( -9.008 -3.375 12.321) 15.631 22.537 ( 5.549 -1.689 -14.025) 15.177 23.106 ( -11.168 18.103 -0.661) 21.281 23.411 ( -12.413 -15.246 -6.974) 20.860 ======================= Grid point 722 (361/361) ======================= q-point: (-0.10 -0.10 0.46) Boundary mean free path (millimeter): 1000.000 Mass variance parameters: 4.65e-08 4.65e-08 0.00e+00 0.00e+00 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 3.36e-05 Number of triplets: 360 Calculating Gamma of ph-isotope with tetrahedron method Frequency group velocity (x, y, z) |gv| 2.048 ( -2.982 -0.000 13.264) 13.595 2.756 ( -0.503 -0.000 21.202) 21.208 3.047 ( -7.153 -0.000 -7.228) 10.169 3.471 ( 11.051 0.000 -5.221) 12.222 3.523 ( 1.780 0.000 -10.109) 10.265 4.003 ( -8.613 -0.000 -4.860) 9.889 4.209 ( -1.884 -0.000 -7.738) 7.964 4.355 ( -6.899 -0.000 -1.444) 7.049 5.201 ( 8.762 0.000 8.153) 11.968 5.576 ( 6.092 0.000 3.988) 7.281 5.786 ( 10.539 0.000 1.983) 10.724 5.914 ( 9.649 0.000 -4.156) 10.506 6.059 ( -5.410 -0.000 -0.368) 5.423 6.445 ( -2.289 -0.000 -7.140) 7.498 7.450 ( -1.703 -0.000 13.169) 13.279 7.953 ( 6.704 0.000 5.563) 8.712 8.265 ( -8.117 -0.000 18.296) 20.016 8.644 ( -0.877 -0.000 -7.373) 7.425 8.669 ( -2.965 -0.000 1.676) 3.406 9.618 ( 3.308 0.000 -16.843) 17.164 9.787 ( -10.747 -0.000 14.563) 18.099 10.065 ( -24.373 -0.000 20.554) 31.883 10.464 ( 8.298 0.000 -15.749) 17.802 11.107 ( -15.674 -0.000 -6.738) 17.061 12.130 ( -1.323 -0.000 7.246) 7.366 12.132 ( 3.851 0.000 -3.570) 5.251 12.574 ( -0.326 -0.000 7.965) 7.972 13.075 ( 11.624 0.000 -15.487) 19.364 17.196 ( 7.981 0.000 -3.285) 8.630 18.115 ( -0.040 -0.000 -11.556) 11.556 18.688 ( 11.675 0.000 1.231) 11.739 19.219 ( 5.358 0.000 -1.923) 5.693 19.570 ( 6.581 0.000 22.231) 23.184 22.298 ( -10.560 -0.000 -22.204) 24.587 23.025 ( -6.596 -0.000 -4.971) 8.259 23.141 ( -9.665 -0.000 1.722) 9.817 =================== 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 3/46800 10.0 2418.775 3119.519 2951.477 0.000 532.316 0.000 3/46800 20.0 420.798 482.065 519.908 0.000 54.423 0.000 3/46800 30.0 136.522 137.725 161.457 0.000 11.626 0.000 3/46800 40.0 66.295 62.635 76.542 0.000 3.887 0.000 3/46800 50.0 40.290 36.601 45.903 0.000 1.637 0.000 3/46800 60.0 27.987 24.775 31.622 0.000 0.760 0.000 3/46800 70.0 21.153 18.399 23.769 0.000 0.348 0.000 3/46800 80.0 16.918 14.537 18.937 0.000 0.127 0.000 3/46800 90.0 14.080 11.996 15.718 0.000 -0.004 0.000 3/46800 100.0 12.065 10.217 13.442 0.000 -0.085 0.000 3/46800 110.0 10.570 8.911 11.758 0.000 -0.139 0.000 3/46800 120.0 9.422 7.914 10.467 0.000 -0.174 0.000 3/46800 130.0 8.513 7.130 9.446 0.000 -0.197 0.000 3/46800 140.0 7.777 6.497 8.620 0.000 -0.211 0.000 3/46800 150.0 7.170 5.975 7.938 0.000 -0.219 0.000 3/46800 160.0 6.660 5.537 7.365 0.000 -0.223 0.000 3/46800 170.0 6.225 5.164 6.876 0.000 -0.223 0.000 3/46800 180.0 5.850 4.842 6.453 0.000 -0.222 0.000 3/46800 190.0 5.522 4.562 6.084 0.000 -0.218 0.000 3/46800 200.0 5.234 4.314 5.759 0.000 -0.214 0.000 3/46800 210.0 4.977 4.095 5.469 0.000 -0.209 0.000 3/46800 220.0 4.748 3.898 5.209 0.000 -0.203 0.000 3/46800 230.0 4.541 3.721 4.975 0.000 -0.197 0.000 3/46800 240.0 4.353 3.561 4.762 0.000 -0.192 0.000 3/46800 250.0 4.181 3.414 4.568 0.000 -0.186 0.000 3/46800 260.0 4.024 3.281 4.391 0.000 -0.180 0.000 3/46800 270.0 3.879 3.157 4.227 0.000 -0.174 0.000 3/46800 280.0 3.745 3.044 4.075 0.000 -0.169 0.000 3/46800 290.0 3.621 2.938 3.935 0.000 -0.163 0.000 3/46800 300.0 3.505 2.840 3.805 0.000 -0.158 0.000 3/46800 310.0 3.397 2.749 3.683 0.000 -0.153 0.000 3/46800 320.0 3.296 2.664 3.569 0.000 -0.148 0.000 3/46800 330.0 3.201 2.584 3.462 0.000 -0.144 0.000 3/46800 340.0 3.111 2.509 3.361 0.000 -0.140 0.000 3/46800 350.0 3.027 2.438 3.267 0.000 -0.135 0.000 3/46800 360.0 2.947 2.371 3.177 0.000 -0.132 0.000 3/46800 370.0 2.871 2.308 3.093 0.000 -0.128 0.000 3/46800 380.0 2.800 2.248 3.013 0.000 -0.124 0.000 3/46800 390.0 2.731 2.192 2.937 0.000 -0.121 0.000 3/46800 400.0 2.667 2.138 2.865 0.000 -0.118 0.000 3/46800 410.0 2.605 2.087 2.796 0.000 -0.115 0.000 3/46800 420.0 2.546 2.038 2.731 0.000 -0.112 0.000 3/46800 430.0 2.490 1.991 2.668 0.000 -0.109 0.000 3/46800 440.0 2.436 1.947 2.609 0.000 -0.106 0.000 3/46800 450.0 2.384 1.905 2.552 0.000 -0.104 0.000 3/46800 460.0 2.335 1.864 2.497 0.000 -0.101 0.000 3/46800 470.0 2.287 1.825 2.445 0.000 -0.099 0.000 3/46800 480.0 2.242 1.788 2.395 0.000 -0.096 0.000 3/46800 490.0 2.198 1.752 2.347 0.000 -0.094 0.000 3/46800 500.0 2.156 1.718 2.301 0.000 -0.092 0.000 3/46800 510.0 2.116 1.685 2.257 0.000 -0.090 0.000 3/46800 520.0 2.077 1.653 2.214 0.000 -0.088 0.000 3/46800 530.0 2.039 1.622 2.173 0.000 -0.087 0.000 3/46800 540.0 2.003 1.593 2.133 0.000 -0.085 0.000 3/46800 550.0 1.968 1.564 2.095 0.000 -0.083 0.000 3/46800 560.0 1.934 1.537 2.058 0.000 -0.081 0.000 3/46800 570.0 1.902 1.510 2.023 0.000 -0.080 0.000 3/46800 580.0 1.870 1.485 1.988 0.000 -0.078 0.000 3/46800 590.0 1.839 1.460 1.955 0.000 -0.077 0.000 3/46800 600.0 1.810 1.436 1.923 0.000 -0.076 0.000 3/46800 610.0 1.781 1.413 1.892 0.000 -0.074 0.000 3/46800 620.0 1.754 1.391 1.862 0.000 -0.073 0.000 3/46800 630.0 1.727 1.369 1.833 0.000 -0.072 0.000 3/46800 640.0 1.701 1.348 1.805 0.000 -0.070 0.000 3/46800 650.0 1.675 1.328 1.777 0.000 -0.069 0.000 3/46800 660.0 1.651 1.308 1.751 0.000 -0.068 0.000 3/46800 670.0 1.627 1.288 1.725 0.000 -0.067 0.000 3/46800 680.0 1.604 1.270 1.700 0.000 -0.066 0.000 3/46800 690.0 1.581 1.252 1.676 0.000 -0.065 0.000 3/46800 700.0 1.559 1.234 1.652 0.000 -0.064 0.000 3/46800 710.0 1.538 1.217 1.629 0.000 -0.063 0.000 3/46800 720.0 1.517 1.200 1.607 0.000 -0.062 0.000 3/46800 730.0 1.497 1.184 1.585 0.000 -0.061 0.000 3/46800 740.0 1.477 1.168 1.564 0.000 -0.060 0.000 3/46800 750.0 1.458 1.153 1.543 0.000 -0.059 0.000 3/46800 760.0 1.439 1.138 1.523 0.000 -0.059 0.000 3/46800 770.0 1.421 1.123 1.503 0.000 -0.058 0.000 3/46800 780.0 1.403 1.109 1.484 0.000 -0.057 0.000 3/46800 790.0 1.386 1.095 1.466 0.000 -0.056 0.000 3/46800 800.0 1.369 1.082 1.448 0.000 -0.055 0.000 3/46800 810.0 1.352 1.069 1.430 0.000 -0.055 0.000 3/46800 820.0 1.336 1.056 1.413 0.000 -0.054 0.000 3/46800 830.0 1.321 1.043 1.396 0.000 -0.053 0.000 3/46800 840.0 1.305 1.031 1.379 0.000 -0.053 0.000 3/46800 850.0 1.290 1.019 1.363 0.000 -0.052 0.000 3/46800 860.0 1.275 1.007 1.348 0.000 -0.051 0.000 3/46800 870.0 1.261 0.996 1.332 0.000 -0.051 0.000 3/46800 880.0 1.247 0.984 1.317 0.000 -0.050 0.000 3/46800 890.0 1.233 0.973 1.303 0.000 -0.049 0.000 3/46800 900.0 1.220 0.963 1.288 0.000 -0.049 0.000 3/46800 910.0 1.207 0.952 1.274 0.000 -0.048 0.000 3/46800 920.0 1.194 0.942 1.260 0.000 -0.048 0.000 3/46800 930.0 1.181 0.932 1.247 0.000 -0.047 0.000 3/46800 940.0 1.169 0.922 1.234 0.000 -0.047 0.000 3/46800 950.0 1.157 0.913 1.221 0.000 -0.046 0.000 3/46800 960.0 1.145 0.903 1.208 0.000 -0.046 0.000 3/46800 970.0 1.133 0.894 1.196 0.000 -0.045 0.000 3/46800 980.0 1.122 0.885 1.184 0.000 -0.045 0.000 3/46800 990.0 1.111 0.876 1.172 0.000 -0.044 0.000 3/46800 1000.0 1.100 0.867 1.160 0.000 -0.044 0.000 3/46800 Thermal conductivity related properties were written into "kappa-m101013.hdf5". Summary of calculation was written in "phono3py.yaml". -------------------------[time 2026-01-08 10:43:18]------------------------- _ ___ _ __ __| | / _ \ '_ \ / _` | | __/ | | | (_| | \___|_| |_|\__,_|